*HEADER    PROTEIN TRANSPORT                       31-AUG-09   2KNQ              
*TITLE     SOLUTION STRUCTURE OF E.COLI GSPH                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GENERAL SECRETION PATHWAY PROTEIN H;                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_TAXID: 562;                                                 
*SOURCE   4 GENE: ECOLC_0384;                                                    
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET-21A                                    
*KEYWDS    GSPH, MINOR PSEUDOPILIN, METHYLATION, TRANSPORT PROTEIN, PROTEIN      
*KEYWDS   2 TRANSPORT                                                            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.ZHANG, C.JIN                                                        
*REVDAT   2   06-OCT-10 2KNQ    1       UPDATE CONSTRAINT DATA                     
*REVDAT   1   08-SEP-10 2KNQ    0                                                


#
#  chirality for residue 1 atoms:  CA CG HB2 HB3
 &rst iat=5,10,8,9, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 150., rk3=150.,  &end
#
#  chirality for residue 1 atoms:  CB SD HG2 HG3
 &rst iat=7,13,11,12, &end
#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,18,6,7, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=20,28,23,24, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=32,37,35,36, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=30,49,33,34, &end
#
#  chirality for residue 4 atoms:  N C HA2 HA3
 &rst iat=51,56,54,55, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=60,65,63,64, &end
#
#  chirality for residue 5 atoms:  CB CD HG2 HG3
 &rst iat=62,68,66,67, &end
#
#  chirality for residue 5 atoms:  CG NE HD2 HD3
 &rst iat=65,71,69,70, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=58,80,61,62, &end
#
#  chirality for residue 6 atoms:  CA CG HB2 HB3
 &rst iat=84,89,87,88, &end
#
#  chirality for residue 6 atoms:  CB CD HG2 HG3
 &rst iat=86,92,90,91, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=82,95,85,86, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=99,104,102,103, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=97,107,100,101, &end
#
#  chirality for residue 8 atoms:  CA CG1 CG2 HB
 &rst iat=111,115,119,114, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=109,123,112,113, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=125,133,128,129, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=137,142,140,141, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=135,147,138,139, &end
#
#  chirality for residue 11 atoms:  CA CG2 OG1 HB
 &rst iat=151,155,159,154, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=149,161,152,153, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=165,170,168,169, &end
#
#  chirality for residue 12 atoms:  CB CD HG2 HG3
 &rst iat=167,173,171,172, &end
#
#  chirality for residue 12 atoms:  CG NE HD2 HD3
 &rst iat=170,176,174,175, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=163,185,166,167, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=187,195,190,191, &end
#
#  chirality for residue 14 atoms:  CA CG HB2 HB3
 &rst iat=199,204,202,203, &end
#
#  chirality for residue 14 atoms:  CB CD HG2 HG3
 &rst iat=201,207,205,206, &end
#
#  chirality for residue 14 atoms:  CG NE HD2 HD3
 &rst iat=204,210,208,209, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=197,219,200,201, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=223,228,226,227, &end
#
#  chirality for residue 15 atoms:  CB CD HG2 HG3
 &rst iat=225,231,229,230, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=221,234,224,225, &end
#
#  chirality for residue 16 atoms:  CA CG2 OG1 HB
 &rst iat=238,242,246,241, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=236,248,239,240, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=250,258,253,254, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=260,268,263,264, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=272,277,275,276, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=274,280,278,279, &end
#
#  chirality for residue 19 atoms:  CG NE HD2 HD3
 &rst iat=277,283,281,282, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=270,292,273,274, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=296,301,299,300, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=294,312,297,298, &end
#
#  chirality for residue 21 atoms:  CA CG2 OG1 HB
 &rst iat=316,320,324,319, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=314,326,317,318, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=328,336,331,332, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=338,346,341,342, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=350,355,353,354, &end
#
#  chirality for residue 24 atoms:  CB CD1 CD2 HG
 &rst iat=352,357,361,356, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=348,365,351,352, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=369,374,372,373, &end
#
#  chirality for residue 25 atoms:  CB CD HG2 HG3
 &rst iat=371,377,375,376, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=367,380,370,371, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=384,389,387,388, &end
#
#  chirality for residue 26 atoms:  CB CD1 CD2 HG
 &rst iat=386,391,395,390, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=382,399,385,386, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=401,409,404,405, &end
#
#  chirality for residue 28 atoms:  CA CG2 CG1 HB
 &rst iat=413,417,421,416, &end
#
#  chirality for residue 28 atoms:  CB CD1 HG12 HG13
 &rst iat=415,424,422,423, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=411,428,414,415, &end
#
#  chirality for residue 29 atoms:  CA CG HB2 HB3
 &rst iat=432,437,435,436, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=430,440,433,434, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=444,449,447,448, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=446,452,450,451, &end
#
#  chirality for residue 30 atoms:  CG NE HD2 HD3
 &rst iat=449,455,453,454, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=442,464,445,446, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=466,474,469,470, &end
#
#  chirality for residue 32 atoms:  CA CG2 OG1 HB
 &rst iat=478,482,486,481, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=476,488,479,480, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=492,497,495,496, &end
#
#  chirality for residue 33 atoms:  CB CD1 CD2 HG
 &rst iat=494,499,503,498, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=490,507,493,494, &end
#
#  chirality for residue 34 atoms:  CA OG HB2 HB3
 &rst iat=511,516,514,515, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=509,518,512,513, &end
#
#  chirality for residue 35 atoms:  N C HA2 HA3
 &rst iat=520,525,523,524, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=529,534,532,533, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=531,537,535,536, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=527,542,530,531, &end
#
#  chirality for residue 37 atoms:  CA CG HB2 HB3
 &rst iat=554,548,552,553, &end
#
#  chirality for residue 37 atoms:  CB CD HG2 HG3
 &rst iat=551,545,549,550, &end
#
#  chirality for residue 37 atoms:  CG N HD2 HD3
 &rst iat=548,544,546,547, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=544,556,555,551, &end
#
#  chirality for residue 38 atoms:  CA CG1 CG2 HB
 &rst iat=560,564,568,563, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=558,572,561,562, &end
#
#  chirality for residue 39 atoms:  N C HA2 HA3
 &rst iat=574,579,577,578, &end
#
#  chirality for residue 40 atoms:  CA CG2 CG1 HB
 &rst iat=583,587,591,586, &end
#
#  chirality for residue 40 atoms:  CB CD1 HG12 HG13
 &rst iat=585,594,592,593, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=581,598,584,585, &end
#
#  chirality for residue 41 atoms:  CA CG HB2 HB3
 &rst iat=602,607,605,606, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=600,615,603,604, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=619,624,622,623, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=617,635,620,621, &end
#
#  chirality for residue 43 atoms:  CA OG HB2 HB3
 &rst iat=639,644,642,643, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=637,646,640,641, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=650,655,653,654, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=648,658,651,652, &end
#
#  chirality for residue 45 atoms:  CA OG HB2 HB3
 &rst iat=662,667,665,666, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=660,669,663,664, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=671,679,674,675, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=683,688,686,687, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=681,703,684,685, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=707,712,710,711, &end
#
#  chirality for residue 48 atoms:  CB CD HG2 HG3
 &rst iat=709,715,713,714, &end
#
#  chirality for residue 48 atoms:  CG NE HD2 HD3
 &rst iat=712,718,716,717, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=705,727,708,709, &end
#
#  chirality for residue 49 atoms:  CA CG2 CG1 HB
 &rst iat=731,735,739,734, &end
#
#  chirality for residue 49 atoms:  CB CD1 HG12 HG13
 &rst iat=733,742,740,741, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=729,746,732,733, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=750,755,753,754, &end
#
#  chirality for residue 50 atoms:  CB SD HG2 HG3
 &rst iat=752,758,756,757, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=748,763,751,752, &end
#
#  chirality for residue 51 atoms:  CA CG1 CG2 HB
 &rst iat=767,771,775,770, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=765,779,768,769, &end
#
#  chirality for residue 52 atoms:  CA CG HB2 HB3
 &rst iat=791,785,789,790, &end
#
#  chirality for residue 52 atoms:  CB CD HG2 HG3
 &rst iat=788,782,786,787, &end
#
#  chirality for residue 52 atoms:  CG N HD2 HD3
 &rst iat=785,781,783,784, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=781,793,792,788, &end
#
#  chirality for residue 53 atoms:  N C HA2 HA3
 &rst iat=795,800,798,799, &end
#
#  chirality for residue 54 atoms:  CA CG HB2 HB3
 &rst iat=804,809,807,808, &end
#
#  chirality for residue 54 atoms:  CB CD HG2 HG3
 &rst iat=806,812,810,811, &end
#
#  chirality for residue 54 atoms:  CD NZ HE2 HE3
 &rst iat=812,818,816,817, &end
#
#  chirality for residue 54 atoms:  CG CE HD2 HD3
 &rst iat=809,815,813,814, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=802,822,805,806, &end
#
#  chirality for residue 55 atoms:  CA CG2 OG1 HB
 &rst iat=826,830,834,829, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=824,836,827,828, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=848,842,846,847, &end
#
#  chirality for residue 56 atoms:  CB CD HG2 HG3
 &rst iat=845,839,843,844, &end
#
#  chirality for residue 56 atoms:  CG N HD2 HD3
 &rst iat=842,838,840,841, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=838,850,849,845, &end
#
#  chirality for residue 57 atoms:  CA OG HB2 HB3
 &rst iat=854,859,857,858, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=852,861,855,856, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=863,871,866,867, &end
#
#  chirality for residue 59 atoms:  CA CG HB2 HB3
 &rst iat=875,880,878,879, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=873,895,876,877, &end
#
#  chirality for residue 60 atoms:  CA CG HB2 HB3
 &rst iat=899,904,902,903, &end
#
#  chirality for residue 60 atoms:  CB CD HG2 HG3
 &rst iat=901,907,905,906, &end
#
#  chirality for residue 60 atoms:  CG NE HD2 HD3
 &rst iat=904,910,908,909, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=897,919,900,901, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=923,928,926,927, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=921,943,924,925, &end
#
#  chirality for residue 62 atoms:  CA CG1 CG2 HB
 &rst iat=947,951,955,950, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=945,959,948,949, &end
#
#  chirality for residue 63 atoms:  CA CG HB2 HB3
 &rst iat=971,965,969,970, &end
#
#  chirality for residue 63 atoms:  CB CD HG2 HG3
 &rst iat=968,962,966,967, &end
#
#  chirality for residue 63 atoms:  CG N HD2 HD3
 &rst iat=965,961,963,964, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=961,973,972,968, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=977,982,980,981, &end
#
#  chirality for residue 64 atoms:  CB CD1 CD2 HG
 &rst iat=979,984,988,983, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=975,992,978,979, &end
#
#  chirality for residue 65 atoms:  CA CG HB2 HB3
 &rst iat=996,1001,999,1000, &end
#
#  chirality for residue 65 atoms:  CB CD HG2 HG3
 &rst iat=998,1004,1002,1003, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=994,1009,997,998, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=1013,1018,1016,1017, &end
#
#  chirality for residue 66 atoms:  CB CD HG2 HG3
 &rst iat=1015,1021,1019,1020, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1011,1024,1014,1015, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=1028,1033,1031,1032, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1026,1036,1029,1030, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1038,1046,1041,1042, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1048,1056,1051,1052, &end
#
#  chirality for residue 70 atoms:  CA CG HB2 HB3
 &rst iat=1060,1065,1063,1064, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1058,1068,1061,1062, &end
#
#  chirality for residue 71 atoms:  CA CG HB2 HB3
 &rst iat=1072,1077,1075,1076, &end
#
#  chirality for residue 71 atoms:  CB CD HG2 HG3
 &rst iat=1074,1080,1078,1079, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1070,1083,1073,1074, &end
#
#  chirality for residue 72 atoms:  CA OG HB2 HB3
 &rst iat=1087,1092,1090,1091, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1085,1094,1088,1089, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1098,1103,1101,1102, &end
#
#  chirality for residue 73 atoms:  CB CD HG2 HG3
 &rst iat=1100,1106,1104,1105, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1096,1111,1099,1100, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1115,1120,1118,1119, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1113,1125,1116,1117, &end
#
#  chirality for residue 75 atoms:  CA CG HB2 HB3
 &rst iat=1129,1134,1132,1133, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1127,1137,1130,1131, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1141,1146,1144,1145, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1139,1161,1142,1143, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1165,1170,1168,1169, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1163,1173,1166,1167, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1177,1182,1180,1181, &end
#
#  chirality for residue 78 atoms:  CB CD HG2 HG3
 &rst iat=1179,1185,1183,1184, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1175,1188,1178,1179, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1192,1197,1195,1196, &end
#
#  chirality for residue 79 atoms:  CB CD HG2 HG3
 &rst iat=1194,1200,1198,1199, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1190,1203,1193,1194, &end
#
#  chirality for residue 80 atoms:  CA CG HB2 HB3
 &rst iat=1207,1212,1210,1211, &end
#
#  chirality for residue 80 atoms:  CB CD1 CD2 HG
 &rst iat=1209,1214,1218,1213, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1205,1222,1208,1209, &end
#
#  chirality for residue 81 atoms:  CA OG HB2 HB3
 &rst iat=1226,1231,1229,1230, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1224,1233,1227,1228, &end
#
#  chirality for residue 82 atoms:  CA CG2 CG1 HB
 &rst iat=1237,1241,1245,1240, &end
#
#  chirality for residue 82 atoms:  CB CD1 HG12 HG13
 &rst iat=1239,1248,1246,1247, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1235,1252,1238,1239, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1256,1261,1259,1260, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1254,1269,1257,1258, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1273,1278,1276,1277, &end
#
#  chirality for residue 84 atoms:  CB CD1 CD2 HG
 &rst iat=1275,1280,1284,1279, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1271,1288,1274,1275, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1292,1297,1295,1296, &end
#
#  chirality for residue 85 atoms:  CB CD HG2 HG3
 &rst iat=1294,1300,1298,1299, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1290,1305,1293,1294, &end
#
#  chirality for residue 86 atoms:  CA CG HB2 HB3
 &rst iat=1317,1311,1315,1316, &end
#
#  chirality for residue 86 atoms:  CB CD HG2 HG3
 &rst iat=1314,1308,1312,1313, &end
#
#  chirality for residue 86 atoms:  CG N HD2 HD3
 &rst iat=1311,1307,1309,1310, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1307,1319,1318,1314, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1323,1328,1326,1327, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1321,1339,1324,1325, &end
#
#  chirality for residue 88 atoms:  CA CG HB2 HB3
 &rst iat=1343,1348,1346,1347, &end
#
#  chirality for residue 88 atoms:  CB CD HG2 HG3
 &rst iat=1345,1351,1349,1350, &end
#
#  chirality for residue 88 atoms:  CD NZ HE2 HE3
 &rst iat=1351,1357,1355,1356, &end
#
#  chirality for residue 88 atoms:  CG CE HD2 HD3
 &rst iat=1348,1354,1352,1353, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1341,1361,1344,1345, &end
#
#  chirality for residue 89 atoms:  CA CG HB2 HB3
 &rst iat=1373,1367,1371,1372, &end
#
#  chirality for residue 89 atoms:  CB CD HG2 HG3
 &rst iat=1370,1364,1368,1369, &end
#
#  chirality for residue 89 atoms:  CG N HD2 HD3
 &rst iat=1367,1363,1365,1366, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1363,1375,1374,1370, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=1379,1384,1382,1383, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1377,1387,1380,1381, &end
#
#  chirality for residue 91 atoms:  CA CG HB2 HB3
 &rst iat=1391,1396,1394,1395, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1389,1399,1392,1393, &end
#
#  chirality for residue 92 atoms:  CA OG HB2 HB3
 &rst iat=1403,1408,1406,1407, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1401,1410,1404,1405, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1414,1419,1417,1418, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1412,1424,1415,1416, &end
#
#  chirality for residue 94 atoms:  CA CG HB2 HB3
 &rst iat=1428,1433,1431,1432, &end
#
#  chirality for residue 94 atoms:  CB CD HG2 HG3
 &rst iat=1430,1436,1434,1435, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1426,1441,1429,1430, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1453,1447,1451,1452, &end
#
#  chirality for residue 95 atoms:  CB CD HG2 HG3
 &rst iat=1450,1444,1448,1449, &end
#
#  chirality for residue 95 atoms:  CG N HD2 HD3
 &rst iat=1447,1443,1445,1446, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1443,1455,1454,1450, &end
#
#  chirality for residue 96 atoms:  CA CG HB2 HB3
 &rst iat=1459,1464,1462,1463, &end
#
#  chirality for residue 96 atoms:  CB CD HG2 HG3
 &rst iat=1461,1467,1465,1466, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1457,1472,1460,1461, &end
#
#  chirality for residue 97 atoms:  CA CG1 CG2 HB
 &rst iat=1476,1480,1484,1479, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1474,1488,1477,1478, &end
#
#  chirality for residue 98 atoms:  CA CG1 CG2 HB
 &rst iat=1492,1496,1500,1495, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1490,1504,1493,1494, &end
#
#  chirality for residue 99 atoms:  CA CG2 CG1 HB
 &rst iat=1508,1512,1516,1511, &end
#
#  chirality for residue 99 atoms:  CB CD1 HG12 HG13
 &rst iat=1510,1519,1517,1518, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1506,1523,1509,1510, &end
#
#  chirality for residue 100 atoms:  CA CG HB2 HB3
 &rst iat=1527,1532,1530,1531, &end
#
#  chirality for residue 100 atoms:  CB CD1 CD2 HG
 &rst iat=1529,1534,1538,1533, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1525,1542,1528,1529, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1544,1552,1547,1548, &end
#
#  chirality for residue 102 atoms:  CA CG HB2 HB3
 &rst iat=1556,1561,1559,1560, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1554,1564,1557,1558, &end
#
#  chirality for residue 103 atoms:  N C HA2 HA3
 &rst iat=1566,1571,1569,1570, &end
#
#  chirality for residue 104 atoms:  CA CG HB2 HB3
 &rst iat=1575,1580,1578,1579, &end
#
#  chirality for residue 104 atoms:  CB CD HG2 HG3
 &rst iat=1577,1583,1581,1582, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1573,1588,1576,1577, &end
#
#  chirality for residue 105 atoms:  CA CG2 CG1 HB
 &rst iat=1592,1596,1600,1595, &end
#
#  chirality for residue 105 atoms:  CB CD1 HG12 HG13
 &rst iat=1594,1603,1601,1602, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1590,1607,1593,1594, &end
#
#  chirality for residue 106 atoms:  CA CG2 OG1 HB
 &rst iat=1611,1615,1619,1614, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1609,1621,1612,1613, &end
#
#  chirality for residue 107 atoms:  CA CG HB2 HB3
 &rst iat=1633,1627,1631,1632, &end
#
#  chirality for residue 107 atoms:  CB CD HG2 HG3
 &rst iat=1630,1624,1628,1629, &end
#
#  chirality for residue 107 atoms:  CG N HD2 HD3
 &rst iat=1627,1623,1625,1626, &end
#
#  chirality for residue 107 atoms:  N C HA CB
 &rst iat=1623,1635,1634,1630, &end
#
#  chirality for residue 108 atoms:  CA CG HB2 HB3
 &rst iat=1639,1644,1642,1643, &end
#
#  chirality for residue 108 atoms:  N C HA CB
 &rst iat=1637,1655,1640,1641, &end
#
#  chirality for residue 109 atoms:  CA OG HB2 HB3
 &rst iat=1659,1664,1662,1663, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=1657,1666,1660,1661, &end
#
#  chirality for residue 110 atoms:  CA CG HB2 HB3
 &rst iat=1670,1675,1673,1674, &end
#
#  chirality for residue 110 atoms:  CB CD1 CD2 HG
 &rst iat=1672,1677,1681,1676, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=1668,1685,1671,1672, &end
#
#  chirality for residue 111 atoms:  CA CG HB2 HB3
 &rst iat=1689,1694,1692,1693, &end
#
#  chirality for residue 111 atoms:  CB CD1 CD2 HG
 &rst iat=1691,1696,1700,1695, &end
#
#  chirality for residue 111 atoms:  N C HA CB
 &rst iat=1687,1704,1690,1691, &end
#
#  chirality for residue 112 atoms:  CA CG HB2 HB3
 &rst iat=1708,1713,1711,1712, &end
#
#  chirality for residue 112 atoms:  CB SD HG2 HG3
 &rst iat=1710,1716,1714,1715, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=1706,1721,1709,1710, &end
#
#  chirality for residue 113 atoms:  N C HA CB
 &rst iat=1723,1731,1726,1727, &end
#
#  chirality for residue 114 atoms:  CA CG HB2 HB3
 &rst iat=1735,1740,1738,1739, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=1733,1745,1736,1737, &end
#
#  chirality for residue 115 atoms:  N C HA CB
 &rst iat=1747,1755,1750,1751, &end
#
#  chirality for residue 116 atoms:  N C HA2 HA3
 &rst iat=1757,1762,1760,1761, &end
#
#  chirality for residue 117 atoms:  CA CG2 OG1 HB
 &rst iat=1766,1770,1774,1769, &end
#
#  chirality for residue 117 atoms:  N C HA CB
 &rst iat=1764,1776,1767,1768, &end
#
#  chirality for residue 118 atoms:  N C HA2 HA3
 &rst iat=1778,1783,1781,1782, &end
#
#  chirality for residue 119 atoms:  CA CG HB2 HB3
 &rst iat=1787,1792,1790,1791, &end
#
#  chirality for residue 119 atoms:  CB CD HG2 HG3
 &rst iat=1789,1795,1793,1794, &end
#
#  chirality for residue 119 atoms:  N C HA CB
 &rst iat=1785,1798,1788,1789, &end
#
#  chirality for residue 120 atoms:  CA CG HB2 HB3
 &rst iat=1810,1804,1808,1809, &end
#
#  chirality for residue 120 atoms:  CB CD HG2 HG3
 &rst iat=1807,1801,1805,1806, &end
#
#  chirality for residue 120 atoms:  CG N HD2 HD3
 &rst iat=1804,1800,1802,1803, &end
#
#  chirality for residue 120 atoms:  N C HA CB
 &rst iat=1800,1812,1811,1807, &end
#
#  chirality for residue 121 atoms:  CA CG HB2 HB3
 &rst iat=1816,1821,1819,1820, &end
#
#  chirality for residue 121 atoms:  CB CD1 CD2 HG
 &rst iat=1818,1823,1827,1822, &end
#
#  chirality for residue 121 atoms:  N C HA CB
 &rst iat=1814,1831,1817,1818, &end
#
#  chirality for residue 122 atoms:  CA CG HB2 HB3
 &rst iat=1835,1840,1838,1839, &end
#
#  chirality for residue 122 atoms:  CB CD1 CD2 HG
 &rst iat=1837,1842,1846,1841, &end
#
#  chirality for residue 122 atoms:  N C HA CB
 &rst iat=1833,1850,1836,1837, &end
#
#  chirality for residue 123 atoms:  CA CG2 OG1 HB
 &rst iat=1854,1858,1862,1857, &end
#
#  chirality for residue 123 atoms:  N C HA CB
 &rst iat=1852,1864,1855,1856, &end
#
#  chirality for residue 124 atoms:  CA CG HB2 HB3
 &rst iat=1868,1873,1871,1872, &end
#
#  chirality for residue 124 atoms:  CB CD1 CD2 HG
 &rst iat=1870,1875,1879,1874, &end
#
#  chirality for residue 124 atoms:  N C HA CB
 &rst iat=1866,1883,1869,1870, &end
#
#  chirality for residue 125 atoms:  CA CG1 CG2 HB
 &rst iat=1887,1891,1895,1890, &end
#
#  chirality for residue 125 atoms:  N C HA CB
 &rst iat=1885,1899,1888,1889, &end
#
#  chirality for residue 126 atoms:  CA SG HB2 HB3
 &rst iat=1903,1908,1906,1907, &end
#
#  chirality for residue 126 atoms:  N C HA CB
 &rst iat=1901,1910,1904,1905, &end
#
#  chirality for residue 127 atoms:  CA OG HB2 HB3
 &rst iat=1914,1919,1917,1918, &end
#
#  chirality for residue 127 atoms:  N C HA CB
 &rst iat=1912,1921,1915,1916, &end
#
#  chirality for residue 128 atoms:  N C HA2 HA3
 &rst iat=1923,1928,1926,1927, &end
#
#  chirality for residue 129 atoms:  CA OG HB2 HB3
 &rst iat=1932,1937,1935,1936, &end
#
#  chirality for residue 129 atoms:  N C HA CB
 &rst iat=1930,1939,1933,1934, &end
#
#  chirality for residue 130 atoms:  CA CG HB2 HB3
 &rst iat=1943,1948,1946,1947, &end
#
#  chirality for residue 130 atoms:  N C HA CB
 &rst iat=1941,1963,1944,1945, &end
#
#  chirality for residue 131 atoms:  CA CG HB2 HB3
 &rst iat=1975,1969,1973,1974, &end
#
#  chirality for residue 131 atoms:  CB CD HG2 HG3
 &rst iat=1972,1966,1970,1971, &end
#
#  chirality for residue 131 atoms:  CG N HD2 HD3
 &rst iat=1969,1965,1967,1968, &end
#
#  chirality for residue 131 atoms:  N C HA CB
 &rst iat=1965,1977,1976,1972, &end
#
#  chirality for residue 132 atoms:  CA CG HB2 HB3
 &rst iat=1981,1986,1984,1985, &end
#
#  chirality for residue 132 atoms:  CB CD1 CD2 HG
 &rst iat=1983,1988,1992,1987, &end
#
#  chirality for residue 132 atoms:  N C HA CB
 &rst iat=1979,1996,1982,1983, &end
#
#  chirality for residue 133 atoms:  CA CG HB2 HB3
 &rst iat=2000,2005,2003,2004, &end
#
#  chirality for residue 133 atoms:  N C HA CB
 &rst iat=1998,2008,2001,2002, &end
#
#  chirality for residue 134 atoms:  CA CG HB2 HB3
 &rst iat=2012,2017,2015,2016, &end
#
#  chirality for residue 134 atoms:  CB CD HG2 HG3
 &rst iat=2014,2020,2018,2019, &end
#
#  chirality for residue 134 atoms:  N C HA CB
 &rst iat=2010,2025,2013,2014, &end
#
#  chirality for residue 135 atoms:  CA CG2 OG1 HB
 &rst iat=2029,2033,2037,2032, &end
#
#  chirality for residue 135 atoms:  N C HA CB
 &rst iat=2027,2039,2030,2031, &end
#
#  chirality for residue 136 atoms:  CA CG HB2 HB3
 &rst iat=2043,2048,2046,2047, &end
#
#  chirality for residue 136 atoms:  CB CD1 CD2 HG
 &rst iat=2045,2050,2054,2049, &end
#
#  chirality for residue 136 atoms:  N C HA CB
 &rst iat=2041,2058,2044,2045, &end
#
#  chirality for residue 137 atoms:  N C HA CB
 &rst iat=2060,2068,2063,2064, &end
#
#  chirality for residue 138 atoms:  CA CG HB2 HB3
 &rst iat=2072,2077,2075,2076, &end
#
#  chirality for residue 138 atoms:  CB CD HG2 HG3
 &rst iat=2074,2080,2078,2079, &end
#
#  chirality for residue 138 atoms:  CG NE HD2 HD3
 &rst iat=2077,2083,2081,2082, &end
#
#  chirality for residue 138 atoms:  N C HA CB
 &rst iat=2070,2092,2073,2074, &end
#
#  chirality for residue 139 atoms:  CA CG HB2 HB3
 &rst iat=2096,2101,2099,2100, &end
#
#  chirality for residue 139 atoms:  N C HA CB
 &rst iat=2094,2104,2097,2098, &end
#
#  chirality for residue 140 atoms:  CA CG2 OG1 HB
 &rst iat=2108,2112,2116,2111, &end
#
#  chirality for residue 140 atoms:  N C HA CB
 &rst iat=2106,2118,2109,2110, &end
#
#  chirality for residue 141 atoms:  CA CG HB2 HB3
 &rst iat=2122,2127,2125,2126, &end
#
#  chirality for residue 141 atoms:  CB CD HG2 HG3
 &rst iat=2124,2130,2128,2129, &end
#
#  chirality for residue 141 atoms:  CG NE HD2 HD3
 &rst iat=2127,2133,2131,2132, &end
#
#  chirality for residue 141 atoms:  N C HA CB
 &rst iat=2120,2142,2123,2124, &end
#
#  chirality for residue 142 atoms:  CA CG HB2 HB3
 &rst iat=2154,2148,2152,2153, &end
#
#  chirality for residue 142 atoms:  CB CD HG2 HG3
 &rst iat=2151,2145,2149,2150, &end
#
#  chirality for residue 142 atoms:  CG N HD2 HD3
 &rst iat=2148,2144,2146,2147, &end
#
#  chirality for residue 142 atoms:  N C HA CB
 &rst iat=2144,2156,2155,2151, &end
#
#  trans-omega constraint for residue 2
 &rst iat=22,20,18,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 150., rk3=150.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=32,30,28,22, &end
#
#  trans-omega constraint for residue 4
 &rst iat=53,51,49,32, &end
#
#  trans-omega constraint for residue 5
 &rst iat=60,58,56,53, &end
#
#  trans-omega constraint for residue 6
 &rst iat=84,82,80,60, &end
#
#  trans-omega constraint for residue 7
 &rst iat=99,97,95,84, &end
#
#  trans-omega constraint for residue 8
 &rst iat=111,109,107,99, &end
#
#  trans-omega constraint for residue 9
 &rst iat=127,125,123,111, &end
#
#  trans-omega constraint for residue 10
 &rst iat=137,135,133,127, &end
#
#  trans-omega constraint for residue 11
 &rst iat=151,149,147,137, &end
#
#  trans-omega constraint for residue 12
 &rst iat=165,163,161,151, &end
#
#  trans-omega constraint for residue 13
 &rst iat=189,187,185,165, &end
#
#  trans-omega constraint for residue 14
 &rst iat=199,197,195,189, &end
#
#  trans-omega constraint for residue 15
 &rst iat=223,221,219,199, &end
#
#  trans-omega constraint for residue 16
 &rst iat=238,236,234,223, &end
#
#  trans-omega constraint for residue 17
 &rst iat=252,250,248,238, &end
#
#  trans-omega constraint for residue 18
 &rst iat=262,260,258,252, &end
#
#  trans-omega constraint for residue 19
 &rst iat=272,270,268,262, &end
#
#  trans-omega constraint for residue 20
 &rst iat=296,294,292,272, &end
#
#  trans-omega constraint for residue 21
 &rst iat=316,314,312,296, &end
#
#  trans-omega constraint for residue 22
 &rst iat=330,328,326,316, &end
#
#  trans-omega constraint for residue 23
 &rst iat=340,338,336,330, &end
#
#  trans-omega constraint for residue 24
 &rst iat=350,348,346,340, &end
#
#  trans-omega constraint for residue 25
 &rst iat=369,367,365,350, &end
#
#  trans-omega constraint for residue 26
 &rst iat=384,382,380,369, &end
#
#  trans-omega constraint for residue 27
 &rst iat=403,401,399,384, &end
#
#  trans-omega constraint for residue 28
 &rst iat=413,411,409,403, &end
#
#  trans-omega constraint for residue 29
 &rst iat=432,430,428,413, &end
#
#  trans-omega constraint for residue 30
 &rst iat=444,442,440,432, &end
#
#  trans-omega constraint for residue 31
 &rst iat=468,466,464,444, &end
#
#  trans-omega constraint for residue 32
 &rst iat=478,476,474,468, &end
#
#  trans-omega constraint for residue 33
 &rst iat=492,490,488,478, &end
#
#  trans-omega constraint for residue 34
 &rst iat=511,509,507,492, &end
#
#  trans-omega constraint for residue 35
 &rst iat=522,520,518,511, &end
#
#  trans-omega constraint for residue 36
 &rst iat=529,527,525,522, &end
#
#  trans-omega constraint for residue 37
 &rst iat=554,544,542,529, &end
#
#  trans-omega constraint for residue 38
 &rst iat=560,558,556,554, &end
#
#  trans-omega constraint for residue 39
 &rst iat=576,574,572,560, &end
#
#  trans-omega constraint for residue 40
 &rst iat=583,581,579,576, &end
#
#  trans-omega constraint for residue 41
 &rst iat=602,600,598,583, &end
#
#  trans-omega constraint for residue 42
 &rst iat=619,617,615,602, &end
#
#  trans-omega constraint for residue 43
 &rst iat=639,637,635,619, &end
#
#  trans-omega constraint for residue 44
 &rst iat=650,648,646,639, &end
#
#  trans-omega constraint for residue 45
 &rst iat=662,660,658,650, &end
#
#  trans-omega constraint for residue 46
 &rst iat=673,671,669,662, &end
#
#  trans-omega constraint for residue 47
 &rst iat=683,681,679,673, &end
#
#  trans-omega constraint for residue 48
 &rst iat=707,705,703,683, &end
#
#  trans-omega constraint for residue 49
 &rst iat=731,729,727,707, &end
#
#  trans-omega constraint for residue 50
 &rst iat=750,748,746,731, &end
#
#  trans-omega constraint for residue 51
 &rst iat=767,765,763,750, &end
#
#  trans-omega constraint for residue 52
 &rst iat=791,781,779,767, &end
#
#  trans-omega constraint for residue 53
 &rst iat=797,795,793,791, &end
#
#  trans-omega constraint for residue 54
 &rst iat=804,802,800,797, &end
#
#  trans-omega constraint for residue 55
 &rst iat=826,824,822,804, &end
#
#  trans-omega constraint for residue 56
 &rst iat=848,838,836,826, &end
#
#  trans-omega constraint for residue 57
 &rst iat=854,852,850,848, &end
#
#  trans-omega constraint for residue 58
 &rst iat=865,863,861,854, &end
#
#  trans-omega constraint for residue 59
 &rst iat=875,873,871,865, &end
#
#  trans-omega constraint for residue 60
 &rst iat=899,897,895,875, &end
#
#  trans-omega constraint for residue 61
 &rst iat=923,921,919,899, &end
#
#  trans-omega constraint for residue 62
 &rst iat=947,945,943,923, &end
#
#  trans-omega constraint for residue 63
 &rst iat=971,961,959,947, &end
#
#  trans-omega constraint for residue 64
 &rst iat=977,975,973,971, &end
#
#  trans-omega constraint for residue 65
 &rst iat=996,994,992,977, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1013,1011,1009,996, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1028,1026,1024,1013, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1040,1038,1036,1028, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1050,1048,1046,1040, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1060,1058,1056,1050, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1072,1070,1068,1060, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1087,1085,1083,1072, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1098,1096,1094,1087, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1115,1113,1111,1098, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1129,1127,1125,1115, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1141,1139,1137,1129, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1165,1163,1161,1141, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1177,1175,1173,1165, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1192,1190,1188,1177, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1207,1205,1203,1192, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1226,1224,1222,1207, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1237,1235,1233,1226, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1256,1254,1252,1237, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1273,1271,1269,1256, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1292,1290,1288,1273, &end
#
#  trans-omega constraint for residue 86
# &rst iat=1317,1307,1305,1292, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1323,1321,1319,1317, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1343,1341,1339,1323, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1373,1363,1361,1343, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1379,1377,1375,1373, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1391,1389,1387,1379, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1403,1401,1399,1391, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1414,1412,1410,1403, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1428,1426,1424,1414, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1453,1443,1441,1428, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1459,1457,1455,1453, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1476,1474,1472,1459, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1492,1490,1488,1476, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1508,1506,1504,1492, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1527,1525,1523,1508, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1546,1544,1542,1527, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1556,1554,1552,1546, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1568,1566,1564,1556, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1575,1573,1571,1568, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1592,1590,1588,1575, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1611,1609,1607,1592, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1633,1623,1621,1611, &end
#
#  trans-omega constraint for residue 108
 &rst iat=1639,1637,1635,1633, &end
#
#  trans-omega constraint for residue 109
 &rst iat=1659,1657,1655,1639, &end
#
#  trans-omega constraint for residue 110
 &rst iat=1670,1668,1666,1659, &end
#
#  trans-omega constraint for residue 111
 &rst iat=1689,1687,1685,1670, &end
#
#  trans-omega constraint for residue 112
 &rst iat=1708,1706,1704,1689, &end
#
#  trans-omega constraint for residue 113
 &rst iat=1725,1723,1721,1708, &end
#
#  trans-omega constraint for residue 114
 &rst iat=1735,1733,1731,1725, &end
#
#  trans-omega constraint for residue 115
 &rst iat=1749,1747,1745,1735, &end
#
#  trans-omega constraint for residue 116
 &rst iat=1759,1757,1755,1749, &end
#
#  trans-omega constraint for residue 117
 &rst iat=1766,1764,1762,1759, &end
#
#  trans-omega constraint for residue 118
 &rst iat=1780,1778,1776,1766, &end
#
#  trans-omega constraint for residue 119
 &rst iat=1787,1785,1783,1780, &end
#
#  trans-omega constraint for residue 120
 &rst iat=1810,1800,1798,1787, &end
#
#  trans-omega constraint for residue 121
 &rst iat=1816,1814,1812,1810, &end
#
#  trans-omega constraint for residue 122
 &rst iat=1835,1833,1831,1816, &end
#
#  trans-omega constraint for residue 123
 &rst iat=1854,1852,1850,1835, &end
#
#  trans-omega constraint for residue 124
 &rst iat=1868,1866,1864,1854, &end
#
#  trans-omega constraint for residue 125
 &rst iat=1887,1885,1883,1868, &end
#
#  trans-omega constraint for residue 126
 &rst iat=1903,1901,1899,1887, &end
#
#  trans-omega constraint for residue 127
 &rst iat=1914,1912,1910,1903, &end
#
#  trans-omega constraint for residue 128
 &rst iat=1925,1923,1921,1914, &end
#
#  trans-omega constraint for residue 129
 &rst iat=1932,1930,1928,1925, &end
#
#  trans-omega constraint for residue 130
 &rst iat=1943,1941,1939,1932, &end
#
#  trans-omega constraint for residue 131
# &rst iat=1975,1965,1963,1943, &end
#
#  trans-omega constraint for residue 132
 &rst iat=1981,1979,1977,1975, &end
#
#  trans-omega constraint for residue 133
 &rst iat=2000,1998,1996,1981, &end
#
#  trans-omega constraint for residue 134
 &rst iat=2012,2010,2008,2000, &end
#
#  trans-omega constraint for residue 135
 &rst iat=2029,2027,2025,2012, &end
#
#  trans-omega constraint for residue 136
 &rst iat=2043,2041,2039,2029, &end
#
#  trans-omega constraint for residue 137
 &rst iat=2062,2060,2058,2043, &end
#
#  trans-omega constraint for residue 138
 &rst iat=2072,2070,2068,2062, &end
#
#  trans-omega constraint for residue 139
 &rst iat=2096,2094,2092,2072, &end
#
#  trans-omega constraint for residue 140
 &rst iat=2108,2106,2104,2096, &end
#
#  trans-omega constraint for residue 141
 &rst iat=2122,2120,2118,2108, &end
#
#  trans-omega constraint for residue 142
 &rst iat=2154,2144,2142,2122, &end
#
#  cis-omega constraint for residue 86
 &rst iat=1317,1307,1305,1292,
  r1=-30., r2=-10., r3=10., r4=30., rk2 = 150., rk3=150.,  &end
#
#  cis-omega constraint for residue 131
 &rst iat=1975,1965,1963,1943,
  r1=-30., r2=-10., r3=10., r4=30., rk2 = 150., rk3=150.,  &end
#
#
#  130 TRP  HE1         130 TRP  HD1         3.50    (#      0:20  Unique         2.56, 2.57 A)
 &rst
  ixpk= 0, nxpk= 20, iat=1952,1950, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#    0 AMB  20-3:1      130 TRP  HD1         5.50    (#      1:20  Single Ambig)
 &rst
  ixpk= 1, nxpk= 20, iat=  -1,1950, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1970,1971,1973,1974,
 &end
#
#  130 TRP  HE1         130 TRP  HZ2         3.50    (#      2:20  Unique         2.88, 2.90 A)
 &rst
  ixpk= 2, nxpk= 20, iat=1952,1955, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  130 TRP  HH2         130 TRP  HZ2         2.80    (#      5:20  Unique         2.47, 2.48 A)
 &rst
  ixpk= 5, nxpk= 20, iat=1957,1955, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   22 ALA  HA          130 TRP  HZ2         5.50    (#      6:20  Unique         5.50, 5.52 A)
 &rst
  ixpk= 6, nxpk= 20, iat= 331,1955, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:7      130 TRP  HZ2         4.50    (#      7:20  Single Ambig)
 &rst
  ixpk= 7, nxpk= 20, iat=  -1,1955, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 372, 373, 372, 373,
 &end
#
#   25 GLU  HG+         130 TRP  HZ2         4.50    (#      8:20  Unique         2.92, 4.12 A)
 &rst
  ixpk= 8, nxpk= 20, iat=  -1,1955, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 375, 376,
 &end
#
#    0 AMB  20-3:9      130 TRP  HZ2         4.50    (#      9:20  Single Ambig)
 &rst
  ixpk= 9, nxpk= 20, iat=  -1,1955, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1970,1971, 321, 322, 323,
 &end
#
#  130 TRP  HZ2         130 TRP  HH2         2.80    (#     11:20  Unique         2.47, 2.48 A)
 &rst
  ixpk= 11, nxpk= 20, iat=1955,1957, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  130 TRP  HZ3         130 TRP  HH2         3.50    (#     12:20  Unique         2.47, 2.48 A)
 &rst
  ixpk= 12, nxpk= 20, iat=1959,1957, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   25 GLU  HB+         130 TRP  HH2         3.50    (#     14:20  Unique         2.15, 3.08 A)
 &rst
  ixpk= 14, nxpk= 20, iat=  -1,1957, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 372, 373,
 &end
#
#   21 THR  MG2         130 TRP  HH2         4.50    (#     15:20  Unique         2.23, 3.10 A)
 &rst
  ixpk= 15, nxpk= 20, iat=  -1,1957, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 321, 322, 323,
 &end
#
#   25 GLU  HG+         130 TRP  HH2         4.50    (#     16:20  Unique         3.34, 4.33 A)
 &rst
  ixpk= 16, nxpk= 20, iat=  -1,1957, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 375, 376,
 &end
#
#    0 AMB  20-3:17     130 TRP  HE3         5.50    (#     17:20  Single Ambig)
 &rst
  ixpk= 17, nxpk= 20, iat=  -1,1961, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 356,1973,1974,
 &end
#
#   99 ILE  HG1-        130 TRP  HE3         5.50    (#     18:20  Unique         5.74, 6.15 A)
 &rst
  ixpk= 18, nxpk= 20, iat=  -1,1961, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1517,1518,
 &end
#
#    3 TYR  HB+           3 TYR  HD          3.50    (#     20:20  Unique         2.33, 3.08 A)
 &rst
  ixpk= 20, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  35,  36,
 igr2=  39,  48,
 &end
#
#    3 TYR  HB-           3 TYR  HD          3.50    (#     21:20  Unique         2.33, 3.08 A)
 &rst
  ixpk= 21, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  35,  36,
 igr2=  39,  48,
 &end
#
#    0 AMB  20-3:22       3 TYR  HD          5.50    (#     22:20  Single Ambig)
 &rst
  ixpk= 22, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  54,  55,  54,  55,
 igr2=  39,  48,
 &end
#
#    0 AMB  20-3:23       3 TYR  HD          4.50    (#     23:20  Single Ambig)
 &rst
  ixpk= 23, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  33,1767,
 igr2=  39,  48,
 &end
#
#    3 TYR  HE            3 TYR  HD          2.80    (#     24:20  Unique         2.45, 3.73 A)
 &rst
  ixpk= 24, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  41,  46,
 igr2=  39,  48,
 &end
#
#    0 AMB  20-3:28       3 TYR  HD          5.50    (#     28:20  Single Ambig)
 &rst
  ixpk= 28, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  59,1743,1744,
 igr2=  39,  48,
 &end
#
#  117 THR  HA            3 TYR  HE          5.50    (#     29:20  Unique         3.64, 6.12 A)
 &rst
  ixpk= 29, nxpk= 20, iat=1767,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  41,  46,
 &end
#
#    3 TYR  HD            3 TYR  HE          2.80    (#     31:20  Unique         2.45, 3.73 A)
 &rst
  ixpk= 31, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  39,  48,
 igr2=  41,  46,
 &end
#
#   42 PHE  HN           42 PHE  HD          4.50    (#     32:20  Unique         2.95, 4.30 A)
 &rst
  ixpk= 32, nxpk= 20, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 626, 634,
 &end
#
#   42 PHE  HE           42 PHE  HD          2.80    (#     33:20  Unique         2.46, 3.73 A)
 &rst
  ixpk= 33, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 628, 632,
 igr2= 626, 634,
 &end
#
#    0 AMB  20-3:34      42 PHE  HD          4.50    (#     34:20  Single Ambig)
 &rst
  ixpk= 34, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 620, 603,
 igr2= 626, 634,
 &end
#
#   42 PHE  HB-          42 PHE  HD          4.50    (#     35:20  Unique         2.37, 3.08 A)
 &rst
  ixpk= 35, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 622, 623,
 igr2= 626, 634,
 &end
#
#   42 PHE  HB+          42 PHE  HD          4.50    (#     36:20  Unique         2.37, 3.08 A)
 &rst
  ixpk= 36, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 622, 623,
 igr2= 626, 634,
 &end
#
#    0 AMB  20-3:37      42 PHE  HD          4.50    (#     37:20  Single Ambig)
 &rst
  ixpk= 37, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 igr2= 626, 634,
 &end
#
#   40 ILE  QD1          42 PHE  HE          3.50    (#     39:20  Unique         2.78, 5.56 A)
 &rst
  ixpk= 39, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 595, 596, 597,
 igr2= 628, 632,
 &end
#
#   59 TRP  HE1          59 TRP  HD1         3.50    (#     41:20  Unique         2.54, 2.56 A)
 &rst
  ixpk= 41, nxpk= 20, iat= 884, 882, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 TRP  HN           59 TRP  HD1         5.50    (#     42:20  Unique         4.48, 4.69 A)
 &rst
  ixpk= 42, nxpk= 20, iat= 874, 882, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   60 ARG  HA           59 TRP  HD1         4.50    (#     44:20  Unique         3.63, 4.05 A)
 &rst
  ixpk= 44, nxpk= 20, iat= 900, 882, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:45      59 TRP  HD1         4.50    (#     45:20  Single Ambig)
 &rst
  ixpk= 45, nxpk= 20, iat=  -1, 882, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 908, 909, 908, 909,
 &end
#
#   59 TRP  HE1          59 TRP  HZ2         4.50    (#     47:20  Unique         2.87, 2.88 A)
 &rst
  ixpk= 47, nxpk= 20, iat= 884, 887, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:48      59 TRP  HZ2         3.50    (#     48:20  Single Ambig)
 &rst
  ixpk= 48, nxpk= 20, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1439,1440, 935,
 &end
#
#   59 TRP  HH2          59 TRP  HZ2         3.50    (#     49:20  Unique         2.48, 2.50 A)
 &rst
  ixpk= 49, nxpk= 20, iat= 889, 887, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:50       0 AMB  20-1:50     4.50    (#     50:20  Double Ambig)
 &rst
  ixpk= 50, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 935,1439,1440, 695,
 igr2= 889,1155,
 &end
#
#   59 TRP  HZ2          59 TRP  HH2         2.80    (#     51:20  Unique         2.48, 2.50 A)
 &rst
  ixpk= 51, nxpk= 20, iat= 887, 889, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   59 TRP  HZ3          59 TRP  HH2         3.50    (#     52:20  Unique         2.48, 2.49 A)
 &rst
  ixpk= 52, nxpk= 20, iat= 891, 889, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:53      59 TRP  HH2         4.50    (#     53:20  Single Ambig)
 &rst
  ixpk= 53, nxpk= 20, iat=  -1, 889, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 549, 550,1431,1432,1431,1432,
 &end
#
#   61 TRP  HE1          61 TRP  HD1         3.50    (#     54:20  Unique         2.56, 2.57 A)
 &rst
  ixpk= 54, nxpk= 20, iat= 932, 930, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 TRP  HN           61 TRP  HD1         5.50    (#     55:20  Unique         3.10, 3.77 A)
 &rst
  ixpk= 55, nxpk= 20, iat= 922, 930, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 TRP  HH2          61 TRP  HD1         5.50    (#     56:20  Unique         4.73, 5.08 A)
 &rst
  ixpk= 56, nxpk= 20, iat= 889, 930, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:57      61 TRP  HD1         4.50    (#     57:20  Single Ambig)
 &rst
  ixpk= 57, nxpk= 20, iat=  -1, 930, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1429, 900,
 &end
#
#   61 TRP  HE1          61 TRP  HZ2         4.50    (#     59:20  Unique         2.88, 2.90 A)
 &rst
  ixpk= 59, nxpk= 20, iat= 932, 935, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 TRP  HH2          61 TRP  HZ2         3.50    (#     60:20  Unique         2.49, 2.51 A)
 &rst
  ixpk= 60, nxpk= 20, iat= 937, 935, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 TRP  HZ2          61 TRP  HH2         3.50    (#     63:20  Unique         2.49, 2.51 A)
 &rst
  ixpk= 63, nxpk= 20, iat= 935, 937, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:64      61 TRP  HH2         4.50    (#     64:20  Single Ambig)
 &rst
  ixpk= 64, nxpk= 20, iat=  -1, 937, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 552, 553, 549, 550,
 &end
#
#   98 VAL  MGY          61 TRP  HH2         4.50    (#     66:20  Unique         2.61, 4.42 A)
 &rst
  ixpk= 66, nxpk= 20, iat=  -1, 937, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1497,1498,1499,1501,1502,1503,
 &end
#
#  111 LEU  MDY          83 HIS  HD2         4.50    (#     67:20  Unique         2.37, 4.52 A)
 &rst
  ixpk= 67, nxpk= 20, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1697,1698,1699,1701,1702,1703,
 &end
#
#  113 ALA  MB           83 HIS  HD2         4.50    (#     68:20  Unique         2.86, 3.94 A)
 &rst
  ixpk= 68, nxpk= 20, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1728,1729,1730,
 &end
#
#    0 AMB  20-3:69       0 AMB  20-1:69     5.50    (#     69:20  Double Ambig)
 &rst
  ixpk= 69, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.47, r4= 9.97,
 igr1=1711,1712,1711,1712, 333, 334, 335,1673,1674,2078,
      2079,2078,2079,
 igr2=1268,1157,
 &end
#
#   82 ILE  HA           83 HIS  HD2         5.50    (#     70:20  Unique         3.07, 3.65 A)
 &rst
  ixpk= 70, nxpk= 20, iat=1238,1268, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:72      76 TRP  HZ3         4.50    (#     72:20  Single Ambig)
 &rst
  ixpk= 72, nxpk= 20, iat=  -1,1157, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 628, 632,1155,
 &end
#
#   76 TRP  HZ3          76 TRP  HH2         3.50    (#     74:20  Unique         2.47, 2.48 A)
 &rst
  ixpk= 74, nxpk= 20, iat=1157,1155, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:75       0 AMB  20-1:75     5.50    (#     75:20  Double Ambig)
 &rst
  ixpk= 75, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 353, 354,1718,1719,1720, 387, 388,1479,
 igr2=1155, 889,
 &end
#
#   23 ALA  MB           76 TRP  HH2         3.50    (#     76:20  Unique         2.24, 3.12 A)
 &rst
  ixpk= 76, nxpk= 20, iat=  -1,1155, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 343, 344, 345,
 &end
#
#   61 TRP  HE1          59 TRP  HH2         5.50    (#     77:20  Unique         2.81, 2.95 A)
 &rst
  ixpk= 77, nxpk= 20, iat= 932, 889, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 PHE  HE           87 PHE  HD          5.50    (#     78:20  Unique         2.48, 3.73 A)
 &rst
  ixpk= 78, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1332,1336,
 igr2=1330,1338,
 &end
#
#    0 AMB  20-3:79      87 PHE  HD          4.50    (#     79:20  Single Ambig)
 &rst
  ixpk= 79, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1309,1310,1642,1643,
 igr2=1330,1338,
 &end
#
#   87 PHE  HB-          87 PHE  HD          4.50    (#     80:20  Unique         2.32, 3.08 A)
 &rst
  ixpk= 80, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1326,1327,
 igr2=1330,1338,
 &end
#
#    0 AMB  20-3:83      87 PHE  HD          5.50    (#     83:20  Single Ambig)
 &rst
  ixpk= 83, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1462,1463,1481,1482,1483,1485,1486,1487,
 igr2=1330,1338,
 &end
#
#   87 PHE  HB+          87 PHE  HD          4.50    (#     84:20  Unique         2.32, 3.08 A)
 &rst
  ixpk= 84, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1326,1327,
 igr2=1330,1338,
 &end
#
#   97 VAL  MGY          87 PHE  HE          4.50    (#     85:20  Unique         2.69, 6.99 A)
 &rst
  ixpk= 85, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1481,1482,1483,1485,1486,1487,
 igr2=1332,1336,
 &end
#
#    0 AMB  20-3:87      87 PHE  HE          3.50    (#     87:20  Single Ambig)
 &rst
  ixpk= 87, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1334,1439,1440,
 igr2=1332,1336,
 &end
#
#   87 PHE  HE           87 PHE  HZ          5.50    (#     89:20  Unique         2.48, 2.49 A)
 &rst
  ixpk= 89, nxpk= 20, iat=  -1,1334, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1332,1336,
 &end
#
#  108 PHE  HB-          87 PHE  HZ          5.50    (#     90:20  Unique         2.27, 5.36 A)
 &rst
  ixpk= 90, nxpk= 20, iat=  -1,1334, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1642,1643,
 &end
#
#  109 SER  HN          108 PHE  HD          4.50    (#     93:20  Unique         2.71, 4.29 A)
 &rst
  ixpk= 93, nxpk= 20, iat=1658,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1646,1654,
 &end
#
#  108 PHE  HE          108 PHE  HD          2.80    (#     94:20  Unique         2.46, 3.72 A)
 &rst
  ixpk= 94, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1648,1652,
 igr2=1646,1654,
 &end
#
#    0 AMB  20-3:95     108 PHE  HD          5.50    (#     95:20  Single Ambig)
 &rst
  ixpk= 95, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1650, 628, 632, 305, 309,
 igr2=1646,1654,
 &end
#
#  108 PHE  HB-         108 PHE  HD          4.50    (#     96:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 96, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1642,1643,
 igr2=1646,1654,
 &end
#
#  108 PHE  HB+         108 PHE  HD          5.50    (#     97:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 97, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1642,1643,
 igr2=1646,1654,
 &end
#
#  105 ILE  QG2         108 PHE  HD          4.50    (#     98:20  Unique         3.24, 6.17 A)
 &rst
  ixpk= 98, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1597,1598,1599,
 igr2=1646,1654,
 &end
#
#    0 AMB  20-3:100    108 PHE  HD          5.50    (#    100:20  Single Ambig)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 igr2=1646,1654,
 &end
#
#  126 CYS  HB-         108 PHE  HD          5.50    (#    101:20  Unique         2.58, 4.51 A)
 &rst
  ixpk= 101, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1906,1907,
 igr2=1646,1654,
 &end
#
#   97 VAL  MGY         108 PHE  HD          4.50    (#    103:20  Unique         2.83, 4.69 A)
 &rst
  ixpk= 103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1481,1482,1483,1485,1486,1487,
 igr2=1646,1654,
 &end
#
#  106 THR  MG2         108 PHE  HD          5.50    (#    104:20  Unique         3.20, 7.48 A)
 &rst
  ixpk= 104, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1616,1617,1618,
 igr2=1646,1654,
 &end
#
#    0 AMB  20-3:105    108 PHE  HE          4.50    (#    105:20  Single Ambig)
 &rst
  ixpk= 105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1650, 305, 309,
 igr2=1648,1652,
 &end
#
#  108 PHE  HD          108 PHE  HE          2.80    (#    106:20  Unique         2.46, 3.72 A)
 &rst
  ixpk= 106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1646,1654,
 igr2=1648,1652,
 &end
#
#  105 ILE  QG2         108 PHE  HE          3.50    (#    108:20  Unique         2.32, 5.08 A)
 &rst
  ixpk= 108, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1597,1598,1599,
 igr2=1648,1652,
 &end
#
#    0 AMB  20-3:109    108 PHE  HE          4.50    (#    109:20  Single Ambig)
 &rst
  ixpk= 109, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.39, r4= 8.89,
 igr1= 358, 359, 360, 362, 363, 364,1876,1877,1878,1880,
      1881,1882,1876,1877,1878,1880,1881,1882,1604,1605,
      1606,
 igr2=1648,1652,
 &end
#
#   97 VAL  MGY         108 PHE  HE          5.50    (#    110:20  Unique         2.32, 4.24 A)
 &rst
  ixpk= 110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1481,1482,1483,1485,1486,1487,
 igr2=1648,1652,
 &end
#
#  110 LEU  MDX         108 PHE  HE          4.50    (#    111:20  Unique         2.51, 6.15 A)
 &rst
  ixpk= 111, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1678,1679,1680,1682,1683,1684,
 igr2=1648,1652,
 &end
#
#  131 PRO  HD-         130 TRP  HD1         4.50    (#    113:20  Unique         3.52, 4.55 A)
 &rst
  ixpk= 113, nxpk= 20, iat=  -1,1950, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1967,1968,
 &end
#
#    0 AMB  20-3:114      0 AMB  20-1:114    3.50    (#    114:20  Double Ambig)
 &rst
  ixpk= 114, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 878, 879,1946,1947,1946,1947,
 igr2= 882,1950,
 &end
#
#   24 LEU  MDY         130 TRP  HZ3         5.50    (#    116:20  Unique         2.43, 4.50 A)
 &rst
  ixpk= 116, nxpk= 20, iat=  -1,1959, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 358, 359, 360, 362, 363, 364,
 &end
#
#  130 TRP  HE3         130 TRP  HZ3         3.50    (#    118:20  Unique         2.48, 2.49 A)
 &rst
  ixpk= 118, nxpk= 20, iat=1961,1959, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:120    130 TRP  HE3         4.50    (#    120:20  Single Ambig)
 &rst
  ixpk= 120, nxpk= 20, iat=  -1,1961, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1946,1947,1946,1947,
 &end
#
#   28 ILE  QD1         130 TRP  HE3         4.50    (#    121:20  Unique         2.40, 3.07 A)
 &rst
  ixpk= 121, nxpk= 20, iat=  -1,1961, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 425, 426, 427,
 &end
#
#   76 TRP  HE1          76 TRP  HD1         5.50    (#    125:20  Unique         2.54, 2.56 A)
 &rst
  ixpk= 125, nxpk= 20, iat=1150,1148, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 MET  ME           61 TRP  HD1         4.50    (#    129:20  Unique         4.71, 5.64 A)
 &rst
  ixpk= 129, nxpk= 20, iat=  -1, 930, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 760, 761, 762,
 &end
#
#   40 ILE  QG2          20 PHE  HE          4.50    (#    139:20  Unique         2.28, 5.94 A)
 &rst
  ixpk= 139, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 588, 589, 590,
 igr2= 305, 309,
 &end
#
#    0 AMB  20-3:140     20 PHE  HE          3.50    (#    140:20  Single Ambig)
 &rst
  ixpk= 140, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1876,1877,1878,1880,1881,1882, 358, 359, 360, 362,
       363, 364,
 igr2= 305, 309,
 &end
#
#   20 PHE  HZ           20 PHE  HE          2.80    (#    141:20  Unique         2.47, 2.49 A)
 &rst
  ixpk= 141, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 305, 309,
 &end
#
#  130 TRP  HZ3         130 TRP  HE3         4.50    (#    143:20  Unique         2.48, 2.49 A)
 &rst
  ixpk= 143, nxpk= 20, iat=1959,1961, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 GLU  HN          130 TRP  HH2         5.50    (#     10:20  Unique)
 &rst
  ixpk= 10, nxpk= 20, iat= 368,1957, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 PHE  HD           42 PHE  HE          2.80    (#     40:20  Unique)
 &rst
  ixpk= 40, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 626, 634,
 igr2= 628, 632,
 &end
#
#   97 VAL  MGY         108 PHE  HD          5.50    (#     99:20  Unique)
 &rst
  ixpk= 99, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1481,1482,1483,1485,1486,1487,
 igr2=1646,1654,
 &end
#
#  130 TRP  HB+         130 TRP  HD1         3.50    (#    114:20  Unique)
 &rst
  ixpk= 114, nxpk= 20, iat=  -1,1950, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1946,1947,
 &end
#
#   88 LYS  HD+          87 PHE  HD          5.50    (#     81:20  Unique)
 &rst
  ixpk= 81, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1352,1353,
 igr2=1330,1338,
 &end
#
#   51 VAL  MGX          61 TRP  HH2         5.50    (#     65:20  Unique)
 &rst
  ixpk= 65, nxpk= 20, iat=  -1, 937, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 772, 773, 774, 776, 777, 778,
 &end
#
#  132 LEU  HB-         132 LEU  HA          4.50    (#      0:20  Unique         2.16, 2.79 A)
 &rst
  ixpk= 0, nxpk= 20, iat=  -1,1982, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1=1984,1985,
 &end
#
#  132 LEU  HB+         132 LEU  HA          4.50    (#      1:20  Unique         2.16, 2.79 A)
 &rst
  ixpk= 1, nxpk= 20, iat=  -1,1982, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1984,1985,
 &end
#
#  132 LEU  MDY         132 LEU  HA          3.50    (#      3:20  Unique         2.87, 4.16 A)
 &rst
  ixpk= 3, nxpk= 20, iat=  -1,1982, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#  126 CYS  HA          132 LEU  HA          4.50    (#      5:20  Unique         2.71, 2.94 A)
 &rst
  ixpk= 5, nxpk= 20, iat=1904,1982, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    3 TYR  HB+           3 TYR  HA          5.50    (#      6:20  Unique         2.30, 2.48 A)
 &rst
  ixpk= 6, nxpk= 20, iat=  -1,  33, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  35,  36,
 &end
#
#    3 TYR  HB-           3 TYR  HA          5.50    (#      7:20  Unique         2.30, 2.48 A)
 &rst
  ixpk= 7, nxpk= 20, iat=  -1,  33, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  35,  36,
 &end
#
#    5 ARG  HB-           5 ARG  HA          3.50    (#      8:20  Unique         2.24, 2.50 A)
 &rst
  ixpk= 8, nxpk= 20, iat=  -1,  61, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  63,  64,
 &end
#
#    8 VAL  MGX           5 ARG  HA          5.50    (#      9:20  Unique         3.77, 7.43 A)
 &rst
  ixpk= 9, nxpk= 20, iat=  -1,  61, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#    0 AMB  20-2:10       5 ARG  HA          4.50    (#     10:20  Single Ambig)
 &rst
  ixpk= 10, nxpk= 20, iat=  -1,  61, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  69,  70,  69,  70,
 &end
#
#    5 ARG  HG+           5 ARG  HB-         2.80    (#     12:20  Unique         2.20, 2.75 A)
 &rst
  ixpk= 12, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  66,  67,
 igr2=  63,  64,
 &end
#
#  135 THR  MG2           0 AMB  20-1:13     5.50    (#     13:20  Single Ambig)
 &rst
  ixpk= 13, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2034,2035,2036,
 igr2=2075,2076,2075,2076,
 &end
#
#    5 ARG  HA            5 ARG  HB-         3.50    (#     14:20  Unique         2.24, 2.50 A)
 &rst
  ixpk= 14, nxpk= 20, iat=  61,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  63,  64,
 &end
#
#    0 AMB  20-2:15       0 AMB  20-1:15     2.80    (#     15:20  Double Ambig)
 &rst
  ixpk= 15, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  66,  67,  66,  67,
 igr2=  69,  70,  69,  70,
 &end
#
#    0 AMB  20-2:16       6 GLU  HA          3.50    (#     16:20  Single Ambig)
 &rst
  ixpk= 16, nxpk= 20, iat=  -1,  85, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  90,  91,  90,  91,1198,1199,
 &end
#
#    6 GLU  HB-           6 GLU  HA          2.80    (#     17:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 17, nxpk= 20, iat=  -1,  85, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  87,  88,
 &end
#
#    0 AMB  20-2:18       0 AMB  20-1:18     2.80    (#     18:20  Double Ambig)
 &rst
  ixpk= 18, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  90,  91,  90,  91,
 igr2=  87,  88,  87,  88,
 &end
#
#    0 AMB  20-2:19       0 AMB  20-1:19     3.50    (#     19:20  Double Ambig)
 &rst
  ixpk= 19, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  85,1051,
 igr2=  87,  88, 999,1000,
 &end
#
#    6 GLU  HA            6 GLU  HB+         3.50    (#     20:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 20, nxpk= 20, iat=  85,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  87,  88,
 &end
#
#   65 GLN  HA           65 GLN  HB-         3.50    (#     21:20  Unique         2.35, 2.73 A)
 &rst
  ixpk= 21, nxpk= 20, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 999,1000,
 &end
#
#    6 GLU  HA            0 AMB  20-1:22     3.50    (#     22:20  Single Ambig)
 &rst
  ixpk= 22, nxpk= 20, iat=  85,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=  90,  91,  90,  91,
 &end
#
#    0 AMB  20-2:23       0 AMB  20-1:23     5.50    (#     23:20  Double Ambig)
 &rst
  ixpk= 23, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2099,2100, 140, 141,
 igr2=2097, 100,
 &end
#
#   67 ASP  HA           67 ASP  HB-         3.50    (#     24:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 24, nxpk= 20, iat=1029,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1031,1032,
 &end
#
#   70 ASP  HN           70 ASP  HB-         3.50    (#     26:20  Unique         2.37, 3.09 A)
 &rst
  ixpk= 26, nxpk= 20, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1063,1064,
 &end
#
#    0 AMB  20-2:27       0 AMB  20-1:27     3.50    (#     27:20  Double Ambig)
 &rst
  ixpk= 27, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1390,1059,
 igr2=1394,1395,1063,1064,
 &end
#
#    7 ASP  HN            7 ASP  HB+         3.50    (#     28:20  Unique         2.02, 2.76 A)
 &rst
  ixpk= 28, nxpk= 20, iat=  98,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 102, 103,
 &end
#
#    9 ALA  HN            8 VAL  HB          4.50    (#     30:20  Unique         2.63, 2.86 A)
 &rst
  ixpk= 30, nxpk= 20, iat= 126, 114, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 ARG  HG+           8 VAL  MGX         3.50    (#     31:20  Unique         2.19, 4.87 A)
 &rst
  ixpk= 31, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 171, 172,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#  119 GLU  HB-         113 ALA  MB          5.50    (#     32:20  Unique         4.93, 6.45 A)
 &rst
  ixpk= 32, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1790,1791,
 igr2=1728,1729,1730,
 &end
#
#   80 LEU  MDX           9 ALA  HA          4.50    (#     33:20  Unique         2.26, 4.49 A)
 &rst
  ixpk= 33, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#    0 AMB  20-2:34       9 ALA  HA          4.50    (#     34:20  Single Ambig)
 &rst
  ixpk= 34, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 116, 117, 118, 120, 121, 122,1213,
 &end
#
#    9 ALA  MB            9 ALA  HA          3.50    (#     35:20  Unique         2.37, 2.66 A)
 &rst
  ixpk= 35, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 130, 131, 132,
 &end
#
#    0 AMB  20-2:36       9 ALA  HA          3.50    (#     36:20  Single Ambig)
 &rst
  ixpk= 36, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1195,1196, 171, 172,
 &end
#
#   12 ARG  HB+           9 ALA  HA          3.50    (#     37:20  Unique         2.15, 3.24 A)
 &rst
  ixpk= 37, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 168, 169,
 &end
#
#   12 ARG  HB-           9 ALA  HA          3.50    (#     38:20  Unique         2.15, 3.24 A)
 &rst
  ixpk= 38, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 168, 169,
 &end
#
#   79 GLU  HG-           9 ALA  HA          4.50    (#     39:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 39, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1198,1199,
 &end
#
#   10 ASN  HN            9 ALA  HA          4.50    (#     40:20  Unique         3.57, 3.62 A)
 &rst
  ixpk= 40, nxpk= 20, iat= 136, 128, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    9 ALA  HN            9 ALA  HA          4.50    (#     41:20  Unique         2.68, 2.79 A)
 &rst
  ixpk= 41, nxpk= 20, iat= 126, 128, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:42       9 ALA  MB          3.50    (#     42:20  Single Ambig)
 &rst
  ixpk= 42, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1195,1196,  90,  91,  90,  91,
 igr2= 130, 131, 132,
 &end
#
#    9 ALA  HA            9 ALA  MB          3.50    (#     43:20  Unique         2.37, 2.66 A)
 &rst
  ixpk= 43, nxpk= 20, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 130, 131, 132,
 &end
#
#   10 ASN  HN            9 ALA  MB          4.50    (#     44:20  Unique         2.24, 3.42 A)
 &rst
  ixpk= 44, nxpk= 20, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 130, 131, 132,
 &end
#
#    9 ALA  HN            9 ALA  MB          3.50    (#     45:20  Unique         2.16, 2.83 A)
 &rst
  ixpk= 45, nxpk= 20, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 130, 131, 132,
 &end
#
#   10 ASN  HB-          10 ASN  HA          3.50    (#     46:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 46, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 140, 141,
 &end
#
#   13 ALA  MB           10 ASN  HA          3.50    (#     47:20  Unique         2.54, 3.54 A)
 &rst
  ixpk= 47, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 192, 193, 194,
 &end
#
#  121 LEU  MDX          10 ASN  HA          3.50    (#     48:20  Unique         2.00, 3.98 A)
 &rst
  ixpk= 48, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1824,1825,1826,1828,1829,1830,
 &end
#
#  121 LEU  HG           10 ASN  HA          4.50    (#     49:20  Unique         2.10, 2.42 A)
 &rst
  ixpk= 49, nxpk= 20, iat=1822, 138, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 ASN  HN           10 ASN  HA          3.50    (#     50:20  Unique         2.75, 2.84 A)
 &rst
  ixpk= 50, nxpk= 20, iat= 136, 138, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 ASN  HA           10 ASN  HB-         3.50    (#     51:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 51, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 140, 141,
 &end
#
#   10 ASN  HA           10 ASN  HB+         3.50    (#     52:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 52, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 140, 141,
 &end
#
#   10 ASN  HD2+         10 ASN  HB+         5.50    (#     53:20  Unique         2.17, 3.29 A)
 &rst
  ixpk= 53, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 145, 146,
 igr2= 140, 141,
 &end
#
#   10 ASN  HD2+         10 ASN  HB-         5.50    (#     54:20  Unique         2.17, 3.29 A)
 &rst
  ixpk= 54, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 145, 146,
 igr2= 140, 141,
 &end
#
#   11 THR  HN           11 THR  HA          4.50    (#     55:20  Unique         2.81, 2.85 A)
 &rst
  ixpk= 55, nxpk= 20, iat= 150, 152, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 ARG  HN           11 THR  HA          4.50    (#     56:20  Unique         3.56, 3.59 A)
 &rst
  ixpk= 56, nxpk= 20, iat= 164, 152, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 THR  HB           11 THR  HA          4.50    (#     57:20  Unique         3.04, 3.05 A)
 &rst
  ixpk= 57, nxpk= 20, iat= 154, 152, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:58      11 THR  HA          3.50    (#     58:20  Single Ambig)
 &rst
  ixpk= 58, nxpk= 20, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 202, 203, 202, 203,
 &end
#
#   11 THR  MG2          11 THR  HA          3.50    (#     59:20  Unique         2.47, 3.12 A)
 &rst
  ixpk= 59, nxpk= 20, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 156, 157, 158,
 &end
#
#   14 ARG  HG-          11 THR  HA          5.50    (#     60:20  Unique         2.43, 4.58 A)
 &rst
  ixpk= 60, nxpk= 20, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 205, 206,
 &end
#
#   13 ALA  MB           11 THR  HA          5.50    (#     61:20  Unique         5.14, 6.23 A)
 &rst
  ixpk= 61, nxpk= 20, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 192, 193, 194,
 &end
#
#   15 GLU  HG+          11 THR  MG2         4.50    (#     63:20  Unique         2.79, 5.24 A)
 &rst
  ixpk= 63, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 229, 230,
 igr2= 156, 157, 158,
 &end
#
#   11 THR  HA           11 THR  MG2         3.50    (#     64:20  Unique         2.47, 3.12 A)
 &rst
  ixpk= 64, nxpk= 20, iat= 152,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 156, 157, 158,
 &end
#
#   11 THR  HB           11 THR  MG2         3.50    (#     65:20  Unique         2.45, 2.67 A)
 &rst
  ixpk= 65, nxpk= 20, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 156, 157, 158,
 &end
#
#   12 ARG  HN           11 THR  MG2         4.50    (#     66:20  Unique         3.57, 4.39 A)
 &rst
  ixpk= 66, nxpk= 20, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 156, 157, 158,
 &end
#
#  115 ALA  MB           79 GLU  HA          3.50    (#     67:20  Unique         2.18, 3.29 A)
 &rst
  ixpk= 67, nxpk= 20, iat=  -1,1193, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1752,1753,1754,
 &end
#
#    0 AMB  20-2:69       0 AMB  20-1:69     2.80    (#     69:20  Double Ambig)
 &rst
  ixpk= 69, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 226, 227,1198,1199,
 igr2= 166,1193,
 &end
#
#   12 ARG  HD-          12 ARG  HA          3.50    (#     70:20  Unique         2.10, 3.41 A)
 &rst
  ixpk= 70, nxpk= 20, iat=  -1, 166, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 174, 175,
 &end
#
#   12 ARG  HD+          12 ARG  HA          3.50    (#     71:20  Unique         2.10, 3.41 A)
 &rst
  ixpk= 71, nxpk= 20, iat=  -1, 166, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 174, 175,
 &end
#
#    0 AMB  20-2:72      12 ARG  HA          3.50    (#     72:20  Single Ambig)
 &rst
  ixpk= 72, nxpk= 20, iat=  -1, 166, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 164, 237,
 &end
#
#    6 GLU  HA            6 GLU  HB+         3.50    (#     73:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 73, nxpk= 20, iat=  85,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  87,  88,
 &end
#
#   12 ARG  HA           12 ARG  HB+         4.50    (#     74:20  Unique         2.42, 2.76 A)
 &rst
  ixpk= 74, nxpk= 20, iat= 166,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 168, 169,
 &end
#
#   12 ARG  HN           12 ARG  HG+         4.50    (#     75:20  Unique         2.17, 3.00 A)
 &rst
  ixpk= 75, nxpk= 20, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 171, 172,
 &end
#
#   12 ARG  HD-          12 ARG  HG+         3.50    (#     76:20  Unique         2.28, 2.71 A)
 &rst
  ixpk= 76, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 174, 175,
 igr2= 171, 172,
 &end
#
#   12 ARG  HD+          12 ARG  HG+         4.50    (#     77:20  Unique         2.28, 2.71 A)
 &rst
  ixpk= 77, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 174, 175,
 igr2= 171, 172,
 &end
#
#   12 ARG  HB-          12 ARG  HD+         4.50    (#     78:20  Unique         2.27, 3.11 A)
 &rst
  ixpk= 78, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 168, 169,
 igr2= 174, 175,
 &end
#
#   12 ARG  HB-          12 ARG  HD-         4.50    (#     79:20  Unique         2.27, 3.11 A)
 &rst
  ixpk= 79, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 168, 169,
 igr2= 174, 175,
 &end
#
#   12 ARG  HB+          12 ARG  HD-         3.50    (#     80:20  Unique         2.27, 3.11 A)
 &rst
  ixpk= 80, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 168, 169,
 igr2= 174, 175,
 &end
#
#   12 ARG  HB+          12 ARG  HD+         3.50    (#     81:20  Unique         2.27, 3.11 A)
 &rst
  ixpk= 81, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 168, 169,
 igr2= 174, 175,
 &end
#
#   12 ARG  HA           12 ARG  HD+         4.50    (#     82:20  Unique         2.10, 3.41 A)
 &rst
  ixpk= 82, nxpk= 20, iat= 166,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 174, 175,
 &end
#
#   12 ARG  HA           12 ARG  HD-         4.50    (#     83:20  Unique         2.10, 3.41 A)
 &rst
  ixpk= 83, nxpk= 20, iat= 166,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 174, 175,
 &end
#
#   13 ALA  HN           13 ALA  HA          4.50    (#     84:20  Unique         2.83, 2.87 A)
 &rst
  ixpk= 84, nxpk= 20, iat= 188, 190, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 ALA  MB           13 ALA  HA          3.50    (#     85:20  Unique         2.40, 2.65 A)
 &rst
  ixpk= 85, nxpk= 20, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 192, 193, 194,
 &end
#
#   80 LEU  HG           13 ALA  HA          4.50    (#     86:20  Unique         2.94, 3.99 A)
 &rst
  ixpk= 86, nxpk= 20, iat=1213, 190, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 LEU  MDX          13 ALA  HA          3.50    (#     87:20  Unique         2.13, 3.55 A)
 &rst
  ixpk= 87, nxpk= 20, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#   16 THR  HN           13 ALA  HA          4.50    (#     88:20  Unique         3.23, 3.41 A)
 &rst
  ixpk= 88, nxpk= 20, iat= 237, 190, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 ALA  HN           13 ALA  HA          6.50    (#     89:20  Unique         3.73, 3.87 A)
 &rst
  ixpk= 89, nxpk= 20, iat= 251, 190, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   14 ARG  HN           14 ARG  HA          4.50    (#     91:20  Unique         2.89, 2.91 A)
 &rst
  ixpk= 91, nxpk= 20, iat= 198, 200, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 GLU  HN           14 ARG  HA          4.50    (#     92:20  Unique         3.52, 3.53 A)
 &rst
  ixpk= 92, nxpk= 20, iat= 222, 200, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 ALA  HN           14 ARG  HA          4.50    (#     93:20  Unique         3.44, 3.54 A)
 &rst
  ixpk= 93, nxpk= 20, iat= 251, 200, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:94      14 ARG  HA          4.50    (#     94:20  Single Ambig)
 &rst
  ixpk= 94, nxpk= 20, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 208, 209, 208, 209,
 &end
#
#    0 AMB  20-2:96      14 ARG  HA          3.50    (#     96:20  Single Ambig)
 &rst
  ixpk= 96, nxpk= 20, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 205, 206, 255, 256, 257,
 &end
#
#    0 AMB  20-2:97      14 ARG  HA          5.50    (#     97:20  Single Ambig)
 &rst
  ixpk= 97, nxpk= 20, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
 igr1=1876,1877,1878,1880,1881,1882,1215,1216,1217,1219,
      1220,1221,2049,
 &end
#
#  122 LEU  MDX          14 ARG  HA          3.50    (#     98:20  Unique         2.36, 3.91 A)
 &rst
  ixpk= 98, nxpk= 20, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1843,1844,1845,1847,1848,1849,
 &end
#
#   31 ALA  HN           30 ARG  HB-         4.50    (#     99:20  Unique         2.76, 3.49 A)
 &rst
  ixpk= 99, nxpk= 20, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 447, 448,
 &end
#
#    0 AMB  20-2:101      0 AMB  20-1:101    3.50    (#    101:20  Double Ambig)
 &rst
  ixpk= 101, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 208, 209, 208, 209,
 igr2= 205, 206, 205, 206,
 &end
#
#   14 ARG  HA           14 ARG  HG+         3.50    (#    102:20  Unique         2.42, 2.85 A)
 &rst
  ixpk= 102, nxpk= 20, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 205, 206,
 &end
#
#   19 ARG  HA           19 ARG  HG+         3.50    (#    103:20  Unique         2.34, 3.05 A)
 &rst
  ixpk= 103, nxpk= 20, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 278, 279,
 &end
#
#   14 ARG  HN           14 ARG  HG+         4.50    (#    104:20  Unique         2.11, 3.02 A)
 &rst
  ixpk= 104, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 205, 206,
 &end
#
#    0 AMB  20-2:106      0 AMB  20-1:106    4.50    (#    106:20  Double Ambig)
 &rst
  ixpk= 106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.76, r4=10.26,
 igr1=2049,1215,1216,1217,1219,1220,1221,1876,1877,1878,
      1880,1881,1882,
 igr2= 208, 209, 208, 209,  69,  70,  69,  70,
 &end
#
#    0 AMB  20-2:108      0 AMB  20-1:108    3.50    (#    108:20  Double Ambig)
 &rst
  ixpk= 108, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 202, 203, 202, 203, 202, 203,
 igr2= 208, 209, 208, 209, 208, 209,
 &end
#
#   15 GLU  HN           15 GLU  HA          3.50    (#    109:20  Unique         2.85, 2.89 A)
 &rst
  ixpk= 109, nxpk= 20, iat= 222, 224, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:110     15 GLU  HA          4.50    (#    110:20  Single Ambig)
 &rst
  ixpk= 110, nxpk= 20, iat=  -1, 224, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 261, 271,
 &end
#
#   14 ARG  HN           15 GLU  HA          5.50    (#    111:20  Unique         5.34, 5.38 A)
 &rst
  ixpk= 111, nxpk= 20, iat= 198, 224, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 GLU  HG+          15 GLU  HA          3.50    (#    112:20  Unique         2.39, 2.97 A)
 &rst
  ixpk= 112, nxpk= 20, iat=  -1, 224, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 229, 230,
 &end
#
#   15 GLU  HG-          15 GLU  HA          2.80    (#    113:20  Unique         2.39, 2.97 A)
 &rst
  ixpk= 113, nxpk= 20, iat=  -1, 224, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 229, 230,
 &end
#
#   15 GLU  HB+          15 GLU  HA          3.50    (#    114:20  Unique         2.45, 2.80 A)
 &rst
  ixpk= 114, nxpk= 20, iat=  -1, 224, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 226, 227,
 &end
#
#   15 GLU  HN           15 GLU  HB-         4.50    (#    116:20  Unique         2.15, 2.82 A)
 &rst
  ixpk= 116, nxpk= 20, iat= 222,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 226, 227,
 &end
#
#   15 GLU  HN           15 GLU  HB+         3.50    (#    117:20  Unique         2.15, 2.82 A)
 &rst
  ixpk= 117, nxpk= 20, iat= 222,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 226, 227,
 &end
#
#   15 GLU  HG+          15 GLU  HB-         3.50    (#    118:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 118, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 229, 230,
 igr2= 226, 227,
 &end
#
#   15 GLU  HG+          15 GLU  HB+         3.50    (#    119:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 119, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 229, 230,
 igr2= 226, 227,
 &end
#
#   11 THR  MG2          15 GLU  HG+         4.50    (#    120:20  Unique         2.79, 5.24 A)
 &rst
  ixpk= 120, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 156, 157, 158,
 igr2= 229, 230,
 &end
#
#   15 GLU  HB+          15 GLU  HG+         3.50    (#    121:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 121, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 226, 227,
 igr2= 229, 230,
 &end
#
#   11 THR  MG2          15 GLU  HG-         4.50    (#    122:20  Unique         2.79, 5.24 A)
 &rst
  ixpk= 122, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 156, 157, 158,
 igr2= 229, 230,
 &end
#
#   15 GLU  HA           15 GLU  HG+         4.50    (#    123:20  Unique         2.39, 2.97 A)
 &rst
  ixpk= 123, nxpk= 20, iat= 224,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 229, 230,
 &end
#
#   15 GLU  HN           15 GLU  HG+         4.50    (#    124:20  Unique         2.29, 3.49 A)
 &rst
  ixpk= 124, nxpk= 20, iat= 222,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 229, 230,
 &end
#
#    0 AMB  20-2:125      0 AMB  20-1:125    4.50    (#    125:20  Double Ambig)
 &rst
  ixpk= 125, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 222,1758,
 igr2= 229, 230,1198,1199,
 &end
#
#   16 THR  HN           16 THR  HA          4.50    (#    126:20  Unique         2.81, 2.84 A)
 &rst
  ixpk= 126, nxpk= 20, iat= 237, 239, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   16 THR  HB           16 THR  HA          4.50    (#    127:20  Unique         3.03, 3.04 A)
 &rst
  ixpk= 127, nxpk= 20, iat= 241, 239, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   82 ILE  QD1          16 THR  MG2         5.50    (#    128:20  Unique         2.56, 4.71 A)
 &rst
  ixpk= 128, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1249,1250,1251,
 igr2= 243, 244, 245,
 &end
#
#   17 ALA  HN           17 ALA  HA          3.50    (#    129:20  Unique         2.85, 2.86 A)
 &rst
  ixpk= 129, nxpk= 20, iat= 251, 253, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:130     17 ALA  HA          4.50    (#    130:20  Single Ambig)
 &rst
  ixpk= 130, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 261, 271,
 &end
#
#   20 PHE  HB-          17 ALA  HA          4.50    (#    131:20  Unique         2.34, 3.14 A)
 &rst
  ixpk= 131, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 299, 300,
 &end
#
#   20 PHE  HB+          17 ALA  HA          4.50    (#    132:20  Unique         2.34, 3.14 A)
 &rst
  ixpk= 132, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 299, 300,
 &end
#
#  112 MET  ME           17 ALA  HA          4.50    (#    133:20  Unique         2.37, 3.78 A)
 &rst
  ixpk= 133, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1718,1719,1720,
 &end
#
#   17 ALA  MB           17 ALA  HA          2.80    (#    134:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 134, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 255, 256, 257,
 &end
#
#    0 AMB  20-2:135     17 ALA  HA          3.50    (#    135:20  Single Ambig)
 &rst
  ixpk= 135, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1876,1877,1878,1880,1881,1882,1876,1877,1878,1880,
      1881,1882,
 &end
#
#  122 LEU  MDX          17 ALA  HA          5.50    (#    136:20  Unique         4.62, 6.37 A)
 &rst
  ixpk= 136, nxpk= 20, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1843,1844,1845,1847,1848,1849,
 &end
#
#  134 GLN  HE2+         17 ALA  MB          4.50    (#    137:20  Unique         2.33, 3.34 A)
 &rst
  ixpk= 137, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2023,2024,
 igr2= 255, 256, 257,
 &end
#
#   76 TRP  HH2          23 ALA  MB          4.50    (#    138:20  Unique         2.24, 3.12 A)
 &rst
  ixpk= 138, nxpk= 20, iat=1155,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 343, 344, 345,
 &end
#
#   76 TRP  HZ3          23 ALA  MB          4.50    (#    139:20  Unique         3.91, 5.00 A)
 &rst
  ixpk= 139, nxpk= 20, iat=1157,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 343, 344, 345,
 &end
#
#   23 ALA  HA           23 ALA  MB          3.50    (#    140:20  Unique         2.40, 2.65 A)
 &rst
  ixpk= 140, nxpk= 20, iat= 341,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 343, 344, 345,
 &end
#
#   17 ALA  HA           17 ALA  MB          3.50    (#    141:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 141, nxpk= 20, iat= 253,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 255, 256, 257,
 &end
#
#    0 AMB  20-2:142      0 AMB  20-1:142    3.50    (#    142:20  Double Ambig)
 &rst
  ixpk= 142, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 297, 200,
 igr2= 343, 344, 345, 255, 256, 257,
 &end
#
#    0 AMB  20-2:143     17 ALA  MB          2.80    (#    143:20  Single Ambig)
 &rst
  ixpk= 143, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1876,1877,1878,1880,1881,1882,1876,1877,1878,1880,
      1881,1882,
 igr2= 255, 256, 257,
 &end
#
#  122 LEU  MDX          17 ALA  MB          3.50    (#    144:20  Unique         2.36, 4.43 A)
 &rst
  ixpk= 144, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1843,1844,1845,1847,1848,1849,
 igr2= 255, 256, 257,
 &end
#
#    0 AMB  20-2:145     18 ALA  HA          3.50    (#    145:20  Single Ambig)
 &rst
  ixpk= 145, nxpk= 20, iat=  -1, 263, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 261, 271,
 &end
#
#   21 THR  HN           18 ALA  HA          4.50    (#    146:20  Unique         3.28, 3.46 A)
 &rst
  ixpk= 146, nxpk= 20, iat= 315, 263, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 ALA  HN           18 ALA  HA          4.50    (#    147:20  Unique         4.02, 4.19 A)
 &rst
  ixpk= 147, nxpk= 20, iat= 329, 263, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 ALA  MB           18 ALA  HA          2.80    (#    149:20  Unique         2.44, 2.66 A)
 &rst
  ixpk= 149, nxpk= 20, iat=  -1, 263, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 265, 266, 267,
 &end
#
#   19 ARG  HN           19 ARG  HG-         5.50    (#    150:20  Unique         2.38, 3.72 A)
 &rst
  ixpk= 150, nxpk= 20, iat= 271,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 278, 279,
 &end
#
#   19 ARG  HN           19 ARG  HG+         5.50    (#    151:20  Unique         2.38, 3.72 A)
 &rst
  ixpk= 151, nxpk= 20, iat= 271,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 278, 279,
 &end
#
#   56 PRO  HA            0 AMB  20-1:152    3.50    (#    152:20  Single Ambig)
 &rst
  ixpk= 152, nxpk= 20, iat= 849,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 843, 844, 843, 844,
 &end
#
#   19 ARG  HA            0 AMB  20-1:153    4.50    (#    153:20  Single Ambig)
 &rst
  ixpk= 153, nxpk= 20, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 281, 282, 281, 282,
 &end
#
#   19 ARG  HN            0 AMB  20-1:154    5.50    (#    154:20  Single Ambig)
 &rst
  ixpk= 154, nxpk= 20, iat= 271,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 281, 282, 281, 282,
 &end
#
#    0 AMB  20-2:155      0 AMB  20-1:155    3.50    (#    155:20  Double Ambig)
 &rst
  ixpk= 155, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 278, 279, 278, 279,
 igr2= 281, 282, 281, 282,
 &end
#
#   19 ARG  HG-           0 AMB  20-1:156    3.50    (#    156:20  Single Ambig)
 &rst
  ixpk= 156, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 278, 279,
 igr2= 281, 282, 281, 282,
 &end
#
#    0 AMB  20-2:157      0 AMB  20-1:157    3.50    (#    157:20  Double Ambig)
 &rst
  ixpk= 157, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 275, 276, 275, 276,
 igr2= 281, 282, 281, 282,
 &end
#
#   21 THR  HB           21 THR  HA          4.50    (#    158:20  Unique         2.67, 3.02 A)
 &rst
  ixpk= 158, nxpk= 20, iat= 319, 317, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 LEU  HN           21 THR  HA          4.50    (#    159:20  Unique         3.31, 3.38 A)
 &rst
  ixpk= 159, nxpk= 20, iat= 349, 317, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 THR  HN           21 THR  HA          4.50    (#    160:20  Unique         2.81, 2.85 A)
 &rst
  ixpk= 160, nxpk= 20, iat= 315, 317, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 LEU  MDX          21 THR  HA          5.50    (#    161:20  Unique         3.30, 5.16 A)
 &rst
  ixpk= 161, nxpk= 20, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 358, 359, 360, 362, 363, 364,
 &end
#
#   22 ALA  HN           21 THR  HB          5.50    (#    162:20  Unique         2.64, 2.77 A)
 &rst
  ixpk= 162, nxpk= 20, iat= 329, 319, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 THR  HA           21 THR  HB          4.50    (#    164:20  Unique         2.67, 3.02 A)
 &rst
  ixpk= 164, nxpk= 20, iat= 317, 319, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 THR  MG2          21 THR  HB          4.50    (#    165:20  Unique         2.42, 2.67 A)
 &rst
  ixpk= 165, nxpk= 20, iat=  -1, 319, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 321, 322, 323,
 &end
#
#   21 THR  HN           21 THR  MG2         5.50    (#    166:20  Unique         3.01, 4.54 A)
 &rst
  ixpk= 166, nxpk= 20, iat= 315,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 321, 322, 323,
 &end
#
#   22 ALA  HN           21 THR  MG2         5.50    (#    167:20  Unique         3.81, 4.59 A)
 &rst
  ixpk= 167, nxpk= 20, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 321, 322, 323,
 &end
#
#  130 TRP  HZ2          21 THR  MG2         5.50    (#    168:20  Unique         3.81, 4.63 A)
 &rst
  ixpk= 168, nxpk= 20, iat=1955,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 321, 322, 323,
 &end
#
#  130 TRP  HH2          21 THR  MG2         6.50    (#    169:20  Unique         2.23, 3.10 A)
 &rst
  ixpk= 169, nxpk= 20, iat=1957,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 321, 322, 323,
 &end
#
#  130 TRP  HZ3          21 THR  MG2         5.50    (#    170:20  Unique         2.59, 3.62 A)
 &rst
  ixpk= 170, nxpk= 20, iat=1959,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 321, 322, 323,
 &end
#
#   21 THR  HB           21 THR  MG2         3.50    (#    173:20  Unique         2.42, 2.67 A)
 &rst
  ixpk= 173, nxpk= 20, iat= 319,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 321, 322, 323,
 &end
#
#   18 ALA  HA           21 THR  MG2         5.50    (#    174:20  Unique         4.27, 5.07 A)
 &rst
  ixpk= 174, nxpk= 20, iat= 263,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 321, 322, 323,
 &end
#
#   21 THR  HA           21 THR  MG2         3.50    (#    175:20  Unique         2.38, 3.11 A)
 &rst
  ixpk= 175, nxpk= 20, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 321, 322, 323,
 &end
#
#    0 AMB  20-2:176     21 THR  MG2         3.50    (#    176:20  Single Ambig)
 &rst
  ixpk= 176, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 358, 359, 360, 362, 363, 364,1989,1990,1991,1993,
      1994,1995,
 igr2= 321, 322, 323,
 &end
#
#    0 AMB  20-2:177     21 THR  MG2         3.50    (#    177:20  Single Ambig)
 &rst
  ixpk= 177, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1= 358, 359, 360, 362, 363, 364,1876,1877,1878,1880,
      1881,1882,1876,1877,1878,1880,1881,1882,
 igr2= 321, 322, 323,
 &end
#
#   22 ALA  HN           22 ALA  HA          4.50    (#    178:20  Unique         2.85, 2.87 A)
 &rst
  ixpk= 178, nxpk= 20, iat= 329, 331, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 GLU  HN           22 ALA  HA          5.50    (#    179:20  Unique         3.08, 3.21 A)
 &rst
  ixpk= 179, nxpk= 20, iat= 368, 331, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 GLU  HB+          22 ALA  HA          3.50    (#    180:20  Unique         2.61, 2.85 A)
 &rst
  ixpk= 180, nxpk= 20, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 372, 373,
 &end
#
#   23 ALA  HN           22 ALA  MB          3.50    (#    183:20  Unique         2.69, 3.53 A)
 &rst
  ixpk= 183, nxpk= 20, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 333, 334, 335,
 &end
#
#   22 ALA  HN           22 ALA  MB          3.50    (#    184:20  Unique         2.48, 2.87 A)
 &rst
  ixpk= 184, nxpk= 20, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 333, 334, 335,
 &end
#
#   23 ALA  HN           23 ALA  HA          3.50    (#    185:20  Unique         2.85, 2.87 A)
 &rst
  ixpk= 185, nxpk= 20, iat= 339, 341, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 LEU  HN           23 ALA  HA          4.50    (#    186:20  Unique         3.23, 3.38 A)
 &rst
  ixpk= 186, nxpk= 20, iat= 383, 341, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 LEU  HB-          23 ALA  HA          3.50    (#    187:20  Unique         2.12, 2.81 A)
 &rst
  ixpk= 187, nxpk= 20, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 387, 388,
 &end
#
#   26 LEU  HB+          23 ALA  HA          3.50    (#    188:20  Unique         2.12, 2.81 A)
 &rst
  ixpk= 188, nxpk= 20, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 387, 388,
 &end
#
#   23 ALA  MB           23 ALA  HA          2.80    (#    189:20  Unique         2.40, 2.65 A)
 &rst
  ixpk= 189, nxpk= 20, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 343, 344, 345,
 &end
#
#   26 LEU  MDY          23 ALA  HA          3.50    (#    190:20  Unique         2.26, 4.40 A)
 &rst
  ixpk= 190, nxpk= 20, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 392, 393, 394, 396, 397, 398,
 &end
#
#   24 LEU  HN           23 ALA  HA          4.50    (#    191:20  Unique         3.53, 3.55 A)
 &rst
  ixpk= 191, nxpk= 20, iat= 349, 341, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 ALA  HN           24 LEU  HA          4.50    (#    192:20  Unique         2.90, 3.05 A)
 &rst
  ixpk= 192, nxpk= 20, iat= 402, 351, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 LEU  HN           24 LEU  HA          4.50    (#    193:20  Unique         2.87, 2.89 A)
 &rst
  ixpk= 193, nxpk= 20, iat= 349, 351, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 LEU  HB-          24 LEU  HA          3.50    (#    194:20  Unique         2.46, 2.77 A)
 &rst
  ixpk= 194, nxpk= 20, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 353, 354,
 &end
#
#   24 LEU  HG           24 LEU  HA          3.50    (#    195:20  Unique         2.90, 3.04 A)
 &rst
  ixpk= 195, nxpk= 20, iat= 356, 351, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 LEU  MDY          24 LEU  HA          4.50    (#    197:20  Unique         2.19, 3.89 A)
 &rst
  ixpk= 197, nxpk= 20, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 358, 359, 360, 362, 363, 364,
 &end
#
#   24 LEU  MDX          24 LEU  HA          3.50    (#    198:20  Unique         2.19, 3.89 A)
 &rst
  ixpk= 198, nxpk= 20, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 358, 359, 360, 362, 363, 364,
 &end
#
#   40 ILE  QD1          24 LEU  HA          4.50    (#    199:20  Unique         2.33, 3.73 A)
 &rst
  ixpk= 199, nxpk= 20, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 595, 596, 597,
 &end
#
#   25 GLU  HN           24 LEU  HB-         4.50    (#    200:20  Unique         2.71, 3.40 A)
 &rst
  ixpk= 200, nxpk= 20, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 353, 354,
 &end
#
#   24 LEU  HN           24 LEU  HB-         4.50    (#    201:20  Unique         2.35, 2.44 A)
 &rst
  ixpk= 201, nxpk= 20, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 353, 354,
 &end
#
#   24 LEU  HN           24 LEU  HB+         4.50    (#    202:20  Unique         2.35, 2.44 A)
 &rst
  ixpk= 202, nxpk= 20, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 353, 354,
 &end
#
#  130 TRP  HZ3          24 LEU  HB-         6.50    (#    203:20  Unique         2.14, 3.06 A)
 &rst
  ixpk= 203, nxpk= 20, iat=1959,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 353, 354,
 &end
#
#    0 AMB  20-2:204     24 LEU  HB-         3.50    (#    204:20  Single Ambig)
 &rst
  ixpk= 204, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 317, 351,
 igr2= 353, 354,
 &end
#
#    0 AMB  20-2:205      0 AMB  20-1:205    4.50    (#    205:20  Double Ambig)
 &rst
  ixpk= 205, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 317, 351,
 igr2= 353, 354, 353, 354,
 &end
#
#   24 LEU  HG           24 LEU  HB+         4.50    (#    206:20  Unique         2.51, 2.81 A)
 &rst
  ixpk= 206, nxpk= 20, iat= 356,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 353, 354,
 &end
#
#   24 LEU  MDY          24 LEU  HB+         4.50    (#    207:20  Unique         2.39, 3.28 A)
 &rst
  ixpk= 207, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 358, 359, 360, 362, 363, 364,
 igr2= 353, 354,
 &end
#
#    0 AMB  20-2:208      0 AMB  20-1:208    5.50    (#    208:20  Double Ambig)
 &rst
  ixpk= 208, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 392, 393, 394, 396, 397, 398, 985, 986, 987, 989,
       990, 991,
 igr2= 353, 354, 353, 354,
 &end
#
#   24 LEU  MDY          24 LEU  HB-         3.50    (#    209:20  Unique         2.39, 3.28 A)
 &rst
  ixpk= 209, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 358, 359, 360, 362, 363, 364,
 igr2= 353, 354,
 &end
#
#  130 TRP  HZ3          24 LEU  HG          6.50    (#    210:20  Unique         2.65, 3.15 A)
 &rst
  ixpk= 210, nxpk= 20, iat=1959, 356, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  20-2:211     14 ARG  HG-         3.50    (#    211:20  Single Ambig)
 &rst
  ixpk= 211, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 208, 209, 208, 209,
 igr2= 205, 206,
 &end
#
#   24 LEU  HA           24 LEU  MDX         3.50    (#    212:20  Unique         2.19, 3.89 A)
 &rst
  ixpk= 212, nxpk= 20, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#   25 GLU  HN           25 GLU  HA          3.50    (#    213:20  Unique         2.85, 2.87 A)
 &rst
  ixpk= 213, nxpk= 20, iat= 368, 370, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:214     25 GLU  HA          4.50    (#    214:20  Single Ambig)
 &rst
  ixpk= 214, nxpk= 20, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 383,1955,
 &end
#
#   25 GLU  HG-          25 GLU  HA          3.50    (#    215:20  Unique         2.35, 2.69 A)
 &rst
  ixpk= 215, nxpk= 20, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 375, 376,
 &end
#
#   25 GLU  HG+          25 GLU  HA          3.50    (#    216:20  Unique         2.35, 2.69 A)
 &rst
  ixpk= 216, nxpk= 20, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 375, 376,
 &end
#
#   28 ILE  QG2          25 GLU  HA          4.50    (#    217:20  Unique         4.44, 5.08 A)
 &rst
  ixpk= 217, nxpk= 20, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 418, 419, 420,
 &end
#
#   28 ILE  QD1          25 GLU  HA          4.50    (#    218:20  Unique         2.28, 3.54 A)
 &rst
  ixpk= 218, nxpk= 20, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 425, 426, 427,
 &end
#
#    0 AMB  20-2:219      0 AMB  20-1:219    4.50    (#    219:20  Double Ambig)
 &rst
  ixpk= 219, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 383,1955,
 igr2= 372, 373, 372, 373,
 &end
#
#   26 LEU  HN           26 LEU  HA          3.50    (#    220:20  Unique         2.81, 2.82 A)
 &rst
  ixpk= 220, nxpk= 20, iat= 383, 385, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 ASP  HB-          26 LEU  HA          3.50    (#    222:20  Unique         2.40, 3.12 A)
 &rst
  ixpk= 222, nxpk= 20, iat=  -1, 385, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 435, 436,
 &end
#
#   26 LEU  HB-          26 LEU  HA          2.80    (#    223:20  Unique         2.30, 2.67 A)
 &rst
  ixpk= 223, nxpk= 20, iat=  -1, 385, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 387, 388,
 &end
#
#   26 LEU  HB+          26 LEU  HA          2.80    (#    224:20  Unique         2.30, 2.67 A)
 &rst
  ixpk= 224, nxpk= 20, iat=  -1, 385, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 387, 388,
 &end
#
#   26 LEU  MDX          26 LEU  HA          4.50    (#    225:20  Unique         2.53, 4.19 A)
 &rst
  ixpk= 225, nxpk= 20, iat=  -1, 385, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 392, 393, 394, 396, 397, 398,
 &end
#
#   27 ALA  HN           26 LEU  HB+         4.50    (#    226:20  Unique         2.56, 3.37 A)
 &rst
  ixpk= 226, nxpk= 20, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 387, 388,
 &end
#
#   26 LEU  HN           26 LEU  HB+         4.50    (#    227:20  Unique         2.03, 2.41 A)
 &rst
  ixpk= 227, nxpk= 20, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 387, 388,
 &end
#
#   26 LEU  HA           26 LEU  HB-         3.50    (#    229:20  Unique         2.30, 2.67 A)
 &rst
  ixpk= 229, nxpk= 20, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 387, 388,
 &end
#
#   64 LEU  HB+          64 LEU  MDX         3.50    (#    231:20  Unique         2.34, 3.40 A)
 &rst
  ixpk= 231, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 980, 981,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#   26 LEU  HA           26 LEU  MDY         4.50    (#    233:20  Unique         2.53, 4.19 A)
 &rst
  ixpk= 233, nxpk= 20, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 392, 393, 394, 396, 397, 398,
 &end
#
#  136 LEU  HA          136 LEU  HG          4.50    (#    234:20  Unique         2.42, 2.88 A)
 &rst
  ixpk= 234, nxpk= 20, iat=2044,2049, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  100 LEU  HN          100 LEU  HG          4.50    (#    235:20  Unique         2.57, 3.17 A)
 &rst
  ixpk= 235, nxpk= 20, iat=1526,1533, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 LEU  HN           26 LEU  MDY         4.50    (#    236:20  Unique         4.35, 5.12 A)
 &rst
  ixpk= 236, nxpk= 20, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 392, 393, 394, 396, 397, 398,
 &end
#
#    0 AMB  20-2:238    115 ALA  HA          5.50    (#    238:20  Single Ambig)
 &rst
  ixpk= 238, nxpk= 20, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1779,1758,
 &end
#
#  115 ALA  HN          115 ALA  HA          3.50    (#    239:20  Unique         2.81, 2.85 A)
 &rst
  ixpk= 239, nxpk= 20, iat=1748,1750, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 LEU  HA          115 ALA  HA          5.50    (#    240:20  Unique         4.18, 4.52 A)
 &rst
  ixpk= 240, nxpk= 20, iat=1208,1750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   81 SER  HA          115 ALA  HA          6.50    (#    241:20  Unique         5.00, 5.31 A)
 &rst
  ixpk= 241, nxpk= 20, iat=1227,1750, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  20-2:242    115 ALA  HA          3.50    (#    242:20  Single Ambig)
 &rst
  ixpk= 242, nxpk= 20, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1229,1230,1229,1230,
 &end
#
#   30 ARG  HB+          27 ALA  HA          3.50    (#    243:20  Unique         2.37, 3.31 A)
 &rst
  ixpk= 243, nxpk= 20, iat=  -1, 404, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 447, 448,
 &end
#
#    0 AMB  20-2:244     27 ALA  HA          3.50    (#    244:20  Single Ambig)
 &rst
  ixpk= 244, nxpk= 20, iat=  -1, 404, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 390,1511,
 &end
#
#   27 ALA  MB           27 ALA  HA          2.80    (#    245:20  Unique         2.43, 2.65 A)
 &rst
  ixpk= 245, nxpk= 20, iat=  -1, 404, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 406, 407, 408,
 &end
#
#  115 ALA  MB          115 ALA  HA          2.80    (#    246:20  Unique         2.42, 2.65 A)
 &rst
  ixpk= 246, nxpk= 20, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1752,1753,1754,
 &end
#
#   28 ILE  QD1          28 ILE  HA          4.50    (#    247:20  Unique         3.04, 4.62 A)
 &rst
  ixpk= 247, nxpk= 20, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 425, 426, 427,
 &end
#
#   99 ILE  QG2          28 ILE  HA          3.50    (#    248:20  Unique         2.11, 2.88 A)
 &rst
  ixpk= 248, nxpk= 20, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1513,1514,1515,
 &end
#
#   31 ALA  MB           28 ILE  HA          3.50    (#    249:20  Unique         2.43, 3.35 A)
 &rst
  ixpk= 249, nxpk= 20, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 471, 472, 473,
 &end
#
#   28 ILE  HG1+         28 ILE  HA          3.50    (#    250:20  Unique         2.51, 2.77 A)
 &rst
  ixpk= 250, nxpk= 20, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 422, 423,
 &end
#
#   28 ILE  HN           28 ILE  HA          3.50    (#    251:20  Unique         2.86, 2.89 A)
 &rst
  ixpk= 251, nxpk= 20, iat= 412, 414, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 ILE  HN           28 ILE  HB          3.50    (#    252:20  Unique         2.36, 2.45 A)
 &rst
  ixpk= 252, nxpk= 20, iat= 412, 416, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 ASP  HN           28 ILE  HB          4.50    (#    253:20  Unique         2.49, 2.64 A)
 &rst
  ixpk= 253, nxpk= 20, iat= 431, 416, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ILE  HA           28 ILE  HB          4.50    (#    254:20  Unique         3.00, 3.04 A)
 &rst
  ixpk= 254, nxpk= 20, iat= 414, 416, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 GLU  HA           28 ILE  HB          4.50    (#    255:20  Unique         2.52, 2.74 A)
 &rst
  ixpk= 255, nxpk= 20, iat= 370, 416, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ILE  QG2          28 ILE  HB          3.50    (#    257:20  Unique         2.43, 2.68 A)
 &rst
  ixpk= 257, nxpk= 20, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 418, 419, 420,
 &end
#
#   28 ILE  QD1          28 ILE  HB          3.50    (#    258:20  Unique         2.43, 3.14 A)
 &rst
  ixpk= 258, nxpk= 20, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 425, 426, 427,
 &end
#
#   30 ARG  HN           29 ASP  HA          3.50    (#    259:20  Unique         3.57, 3.59 A)
 &rst
  ixpk= 259, nxpk= 20, iat= 443, 433, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 ASP  HN           29 ASP  HB-         4.50    (#    260:20  Unique         2.29, 2.48 A)
 &rst
  ixpk= 260, nxpk= 20, iat= 431,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 435, 436,
 &end
#
#   29 ASP  HN           29 ASP  HB+         3.50    (#    261:20  Unique         2.29, 2.48 A)
 &rst
  ixpk= 261, nxpk= 20, iat= 431,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 435, 436,
 &end
#
#   30 ARG  HN           29 ASP  HB+         3.50    (#    262:20  Unique         2.51, 3.23 A)
 &rst
  ixpk= 262, nxpk= 20, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 435, 436,
 &end
#
#   44 ASP  HN            0 AMB  20-1:263    4.50    (#    263:20  Single Ambig)
 &rst
  ixpk= 263, nxpk= 20, iat= 649,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 653, 654, 653, 654,
 &end
#
#   26 LEU  HA           29 ASP  HB-         3.50    (#    264:20  Unique         2.40, 3.12 A)
 &rst
  ixpk= 264, nxpk= 20, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 435, 436,
 &end
#
#   26 LEU  HA           29 ASP  HB+         3.50    (#    265:20  Unique         2.40, 3.12 A)
 &rst
  ixpk= 265, nxpk= 20, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 435, 436,
 &end
#
#   29 ASP  HA           29 ASP  HB-         3.50    (#    266:20  Unique         2.37, 2.73 A)
 &rst
  ixpk= 266, nxpk= 20, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 435, 436,
 &end
#
#   29 ASP  HA           29 ASP  HB+         3.50    (#    267:20  Unique         2.37, 2.73 A)
 &rst
  ixpk= 267, nxpk= 20, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 435, 436,
 &end
#
#   30 ARG  HN           30 ARG  HA          3.50    (#    268:20  Unique         2.86, 2.90 A)
 &rst
  ixpk= 268, nxpk= 20, iat= 443, 445, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 ALA  HN           30 ARG  HA          4.50    (#    269:20  Unique         3.48, 3.54 A)
 &rst
  ixpk= 269, nxpk= 20, iat= 467, 445, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   30 ARG  HD-          30 ARG  HA          4.50    (#    270:20  Unique         2.06, 3.42 A)
 &rst
  ixpk= 270, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 453, 454,
 &end
#
#   30 ARG  HD+          30 ARG  HA          5.50    (#    271:20  Unique         2.06, 3.42 A)
 &rst
  ixpk= 271, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 453, 454,
 &end
#
#   29 ASP  HB+          30 ARG  HA          4.50    (#    272:20  Unique         4.44, 5.16 A)
 &rst
  ixpk= 272, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 435, 436,
 &end
#
#   30 ARG  HB-          30 ARG  HA          3.50    (#    273:20  Unique         2.46, 2.80 A)
 &rst
  ixpk= 273, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 447, 448,
 &end
#
#   30 ARG  HG+          30 ARG  HA          3.50    (#    274:20  Unique         2.30, 3.19 A)
 &rst
  ixpk= 274, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 450, 451,
 &end
#
#   30 ARG  HG-          30 ARG  HA          3.50    (#    275:20  Unique         2.30, 3.19 A)
 &rst
  ixpk= 275, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 450, 451,
 &end
#
#    0 AMB  20-2:276     30 ARG  HA          5.50    (#    276:20  Single Ambig)
 &rst
  ixpk= 276, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 565, 566, 567, 569, 570, 571, 772, 773, 774, 776,
       777, 778,
 &end
#
#   33 LEU  MDX          30 ARG  HA          3.50    (#    277:20  Unique         2.42, 4.69 A)
 &rst
  ixpk= 277, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 500, 501, 502, 504, 505, 506,
 &end
#
#   51 VAL  MGY          30 ARG  HD-         3.50    (#    278:20  Unique         2.40, 5.93 A)
 &rst
  ixpk= 278, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 772, 773, 774, 776, 777, 778,
 igr2= 453, 454,
 &end
#
#   51 VAL  MGY          30 ARG  HD+         3.50    (#    279:20  Unique         2.40, 5.93 A)
 &rst
  ixpk= 279, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 772, 773, 774, 776, 777, 778,
 igr2= 453, 454,
 &end
#
#   30 ARG  HG-          30 ARG  HD+         3.50    (#    280:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 280, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 450, 451,
 igr2= 453, 454,
 &end
#
#   30 ARG  HG-          30 ARG  HD-         3.50    (#    281:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 281, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 450, 451,
 igr2= 453, 454,
 &end
#
#   30 ARG  HB+          30 ARG  HD+         4.50    (#    282:20  Unique         2.34, 3.32 A)
 &rst
  ixpk= 282, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 447, 448,
 igr2= 453, 454,
 &end
#
#    0 AMB  20-2:283      0 AMB  20-1:283    2.80    (#    283:20  Double Ambig)
 &rst
  ixpk= 283, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 205, 206, 205, 206,
 igr2= 208, 209, 208, 209,
 &end
#
#   31 ALA  HN           31 ALA  MB          3.50    (#    284:20  Unique         2.34, 2.90 A)
 &rst
  ixpk= 284, nxpk= 20, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 471, 472, 473,
 &end
#
#    0 AMB  20-2:285     31 ALA  MB          4.50    (#    285:20  Single Ambig)
 &rst
  ixpk= 285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 528, 510,
 igr2= 471, 472, 473,
 &end
#
#   32 THR  HN           31 ALA  MB          3.50    (#    286:20  Unique         2.54, 3.60 A)
 &rst
  ixpk= 286, nxpk= 20, iat= 477,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 471, 472, 473,
 &end
#
#   37 PRO  HA           31 ALA  MB          4.50    (#    287:20  Unique         2.41, 3.48 A)
 &rst
  ixpk= 287, nxpk= 20, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 471, 472, 473,
 &end
#
#   31 ALA  HA           31 ALA  MB          3.50    (#    288:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 288, nxpk= 20, iat= 469,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 471, 472, 473,
 &end
#
#   32 THR  HA           31 ALA  MB          4.50    (#    289:20  Unique         4.19, 5.03 A)
 &rst
  ixpk= 289, nxpk= 20, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 471, 472, 473,
 &end
#
#  101 ALA  HA           31 ALA  MB          4.50    (#    290:20  Unique         2.38, 3.14 A)
 &rst
  ixpk= 290, nxpk= 20, iat=1547,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 471, 472, 473,
 &end
#
#   28 ILE  HA           31 ALA  MB          4.50    (#    291:20  Unique         2.43, 3.35 A)
 &rst
  ixpk= 291, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 471, 472, 473,
 &end
#
#   30 ARG  HB+          31 ALA  MB          4.50    (#    292:20  Unique         4.35, 5.82 A)
 &rst
  ixpk= 292, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 447, 448,
 igr2= 471, 472, 473,
 &end
#
#    0 AMB  20-2:293     31 ALA  MB          4.50    (#    293:20  Single Ambig)
 &rst
  ixpk= 293, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 563,1511,
 igr2= 471, 472, 473,
 &end
#
#   38 VAL  MGY          31 ALA  MB          3.50    (#    294:20  Unique         2.13, 5.03 A)
 &rst
  ixpk= 294, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 565, 566, 567, 569, 570, 571,
 igr2= 471, 472, 473,
 &end
#
#   99 ILE  QG2          31 ALA  MB          3.50    (#    295:20  Unique         2.87, 4.26 A)
 &rst
  ixpk= 295, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1513,1514,1515,
 igr2= 471, 472, 473,
 &end
#
#    0 AMB  20-2:296     32 THR  HA          4.50    (#    296:20  Single Ambig)
 &rst
  ixpk= 296, nxpk= 20, iat=  -1, 479, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 491, 510, 528,
 &end
#
#   32 THR  HN           32 THR  HA          3.50    (#    297:20  Unique         2.90, 2.94 A)
 &rst
  ixpk= 297, nxpk= 20, iat= 477, 479, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 THR  HB           32 THR  HA          2.80    (#    298:20  Unique         2.43, 2.46 A)
 &rst
  ixpk= 298, nxpk= 20, iat= 481, 479, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  101 ALA  MB           32 THR  HA          3.50    (#    300:20  Unique         2.21, 3.09 A)
 &rst
  ixpk= 300, nxpk= 20, iat=  -1, 479, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1549,1550,1551,
 &end
#
#    0 AMB  20-2:301     32 THR  HB          3.50    (#    301:20  Single Ambig)
 &rst
  ixpk= 301, nxpk= 20, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 483, 484, 485,1549,1550,1551,
 &end
#
#   32 THR  HA           32 THR  HB          2.80    (#    303:20  Unique         2.43, 2.46 A)
 &rst
  ixpk= 303, nxpk= 20, iat= 479, 481, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   33 LEU  HN           32 THR  MG2         4.50    (#    304:20  Unique         2.62, 3.41 A)
 &rst
  ixpk= 304, nxpk= 20, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 483, 484, 485,
 &end
#
#   32 THR  HN           32 THR  MG2         4.50    (#    305:20  Unique         2.27, 3.19 A)
 &rst
  ixpk= 305, nxpk= 20, iat= 477,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 483, 484, 485,
 &end
#
#    0 AMB  20-2:306     32 THR  MG2         3.50    (#    306:20  Single Ambig)
 &rst
  ixpk= 306, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 433, 481,
 igr2= 483, 484, 485,
 &end
#
#   32 THR  HA           32 THR  MG2         3.50    (#    307:20  Unique         3.72, 3.95 A)
 &rst
  ixpk= 307, nxpk= 20, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 483, 484, 485,
 &end
#
#    0 AMB  20-2:308     33 LEU  HB-         3.50    (#    308:20  Single Ambig)
 &rst
  ixpk= 308, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 491, 510,
 igr2= 495, 496,
 &end
#
#    0 AMB  20-2:309      0 AMB  20-1:309    3.50    (#    309:20  Double Ambig)
 &rst
  ixpk= 309, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 491, 510,
 igr2= 495, 496, 495, 496,
 &end
#
#   33 LEU  HA           33 LEU  HB-         3.50    (#    310:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 310, nxpk= 20, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 495, 496,
 &end
#
#   30 ARG  HA           33 LEU  HB+         4.50    (#    311:20  Unique         2.34, 3.43 A)
 &rst
  ixpk= 311, nxpk= 20, iat= 445,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 495, 496,
 &end
#
#   33 LEU  HA           33 LEU  HB+         3.50    (#    312:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 312, nxpk= 20, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 495, 496,
 &end
#
#   33 LEU  MDX          33 LEU  HB-         3.50    (#    313:20  Unique         2.31, 3.31 A)
 &rst
  ixpk= 313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 500, 501, 502, 504, 505, 506,
 igr2= 495, 496,
 &end
#
#   33 LEU  MDX          33 LEU  HB+         2.80    (#    314:20  Unique         2.31, 3.31 A)
 &rst
  ixpk= 314, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 500, 501, 502, 504, 505, 506,
 igr2= 495, 496,
 &end
#
#   31 ALA  HN           33 LEU  HG          5.50    (#    315:20  Unique         4.83, 5.49 A)
 &rst
  ixpk= 315, nxpk= 20, iat= 467, 498, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  133 ASP  HN          132 LEU  MDY         4.50    (#    316:20  Unique         3.36, 5.05 A)
 &rst
  ixpk= 316, nxpk= 20, iat=1999,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#    0 AMB  20-2:318     34 SER  HB-         4.50    (#    318:20  Single Ambig)
 &rst
  ixpk= 318, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 510, 528,
 igr2= 514, 515,
 &end
#
#    0 AMB  20-2:319      0 AMB  20-1:319    4.50    (#    319:20  Double Ambig)
 &rst
  ixpk= 319, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 510, 528,
 igr2= 514, 515, 514, 515,
 &end
#
#  100 LEU  HA           37 PRO  HB-         4.50    (#    326:20  Unique         2.41, 3.76 A)
 &rst
  ixpk= 326, nxpk= 20, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 552, 553,
 &end
#
#   37 PRO  HD-          37 PRO  HB+         4.50    (#    327:20  Unique         2.74, 3.65 A)
 &rst
  ixpk= 327, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 546, 547,
 igr2= 552, 553,
 &end
#
#   37 PRO  HG-          37 PRO  HB-         2.80    (#    328:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 328, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 549, 550,
 igr2= 552, 553,
 &end
#
#  105 ILE  QD1           0 AMB  20-1:330    3.50    (#    330:20  Single Ambig)
 &rst
  ixpk= 330, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1604,1605,1606,
 igr2=1601,1602,1601,1602,
 &end
#
#   38 VAL  HN           38 VAL  HB          4.50    (#    333:20  Unique         2.45, 2.58 A)
 &rst
  ixpk= 333, nxpk= 20, iat= 559, 563, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 ALA  MB           38 VAL  HB          4.50    (#    335:20  Unique         2.55, 4.07 A)
 &rst
  ixpk= 335, nxpk= 20, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 406, 407, 408,
 &end
#
#   31 ALA  MB           38 VAL  HB          4.50    (#    336:20  Unique         2.19, 3.62 A)
 &rst
  ixpk= 336, nxpk= 20, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 471, 472, 473,
 &end
#
#   38 VAL  MGX          38 VAL  HB          3.50    (#    337:20  Unique         2.31, 2.67 A)
 &rst
  ixpk= 337, nxpk= 20, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  20-2:338     38 VAL  HB          2.80    (#    338:20  Single Ambig)
 &rst
  ixpk= 338, nxpk= 20, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 565, 566, 567, 569, 570, 571, 772, 773, 774, 776,
       777, 778,
 &end
#
#   99 ILE  QD1          38 VAL  HB          3.50    (#    339:20  Unique         3.23, 4.60 A)
 &rst
  ixpk= 339, nxpk= 20, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1520,1521,1522,
 &end
#
#   30 ARG  HD+          38 VAL  MGY         4.50    (#    340:20  Unique         3.57, 6.02 A)
 &rst
  ixpk= 340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 453, 454,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   38 VAL  HB           38 VAL  MGY         3.50    (#    341:20  Unique         2.31, 2.67 A)
 &rst
  ixpk= 341, nxpk= 20, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   38 VAL  HB           38 VAL  MGX         3.50    (#    342:20  Unique         2.31, 2.67 A)
 &rst
  ixpk= 342, nxpk= 20, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   30 ARG  HB+          38 VAL  MGY         3.50    (#    343:20  Unique         2.26, 3.96 A)
 &rst
  ixpk= 343, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 447, 448,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   27 ALA  MB           38 VAL  MGX         3.50    (#    344:20  Unique         2.37, 4.94 A)
 &rst
  ixpk= 344, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 406, 407, 408,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   27 ALA  MB           38 VAL  MGY         3.50    (#    345:20  Unique         2.37, 4.94 A)
 &rst
  ixpk= 345, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 406, 407, 408,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  20-2:346     38 VAL  MGX         3.50    (#    346:20  Single Ambig)
 &rst
  ixpk= 346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 736, 737, 738, 592, 593,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   40 ILE  HN           40 ILE  HB          4.50    (#    355:20  Unique         2.77, 2.85 A)
 &rst
  ixpk= 355, nxpk= 20, iat= 582, 586, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 PHE  HE           40 ILE  HB          4.50    (#    356:20  Unique         2.19, 4.30 A)
 &rst
  ixpk= 356, nxpk= 20, iat=  -1, 586, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 628, 632,
 &end
#
#   97 VAL  HB           40 ILE  HB          3.50    (#    358:20  Unique         2.20, 2.29 A)
 &rst
  ixpk= 358, nxpk= 20, iat=1479, 586, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   40 ILE  HG1-         40 ILE  HB          4.50    (#    359:20  Unique         2.43, 2.76 A)
 &rst
  ixpk= 359, nxpk= 20, iat=  -1, 586, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 592, 593,
 &end
#
#    0 AMB  20-2:360     40 ILE  HB          3.50    (#    360:20  Single Ambig)
 &rst
  ixpk= 360, nxpk= 20, iat=  -1, 586, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 592, 593,1481,1482,1483,1485,1486,1487,
 &end
#
#   40 ILE  QD1          40 ILE  HB          3.50    (#    361:20  Unique         2.52, 3.23 A)
 &rst
  ixpk= 361, nxpk= 20, iat=  -1, 586, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 595, 596, 597,
 &end
#
#   40 ILE  QG2          40 ILE  HB          3.50    (#    362:20  Unique         2.44, 2.68 A)
 &rst
  ixpk= 362, nxpk= 20, iat=  -1, 586, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 588, 589, 590,
 &end
#
#   82 ILE  HG1+        110 LEU  HG          4.50    (#    363:20  Unique         4.06, 4.91 A)
 &rst
  ixpk= 363, nxpk= 20, iat=  -1,1676, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1246,1247,
 &end
#
#   40 ILE  QG2          40 ILE  HG1+        4.50    (#    365:20  Unique         2.55, 3.58 A)
 &rst
  ixpk= 365, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 588, 589, 590,
 igr2= 592, 593,
 &end
#
#   40 ILE  QD1          40 ILE  HG1+        4.50    (#    366:20  Unique         2.35, 2.65 A)
 &rst
  ixpk= 366, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 595, 596, 597,
 igr2= 592, 593,
 &end
#
#   40 ILE  QD1          40 ILE  HG1-        3.50    (#    367:20  Unique         2.35, 2.65 A)
 &rst
  ixpk= 367, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 595, 596, 597,
 igr2= 592, 593,
 &end
#
#   40 ILE  HB           40 ILE  HG1+        3.50    (#    370:20  Unique         2.43, 2.76 A)
 &rst
  ixpk= 370, nxpk= 20, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 592, 593,
 &end
#
#    0 AMB  20-2:373     40 ILE  QD1         6.50    (#    373:20  Single Ambig)
 &rst
  ixpk= 373, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 582, 618,
 igr2= 595, 596, 597,
 &end
#
#   20 PHE  HZ           40 ILE  QD1         5.50    (#    374:20  Unique         2.59, 4.21 A)
 &rst
  ixpk= 374, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 595, 596, 597,
 &end
#
#   20 PHE  HE           40 ILE  QD1         4.50    (#    375:20  Unique         2.20, 4.53 A)
 &rst
  ixpk= 375, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 305, 309,
 igr2= 595, 596, 597,
 &end
#
#    0 AMB  20-2:377     40 ILE  QD1         4.50    (#    377:20  Single Ambig)
 &rst
  ixpk= 377, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 353, 354,1479,
 igr2= 595, 596, 597,
 &end
#
#   40 ILE  HB           40 ILE  QD1         3.50    (#    378:20  Unique         2.52, 3.23 A)
 &rst
  ixpk= 378, nxpk= 20, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 595, 596, 597,
 &end
#
#   40 ILE  HG1-         40 ILE  QD1         3.50    (#    379:20  Unique         2.35, 2.65 A)
 &rst
  ixpk= 379, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 592, 593,
 igr2= 595, 596, 597,
 &end
#
#    0 AMB  20-2:380     40 ILE  QD1         3.50    (#    380:20  Single Ambig)
 &rst
  ixpk= 380, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 592, 593, 358, 359, 360, 362, 363, 364,
 igr2= 595, 596, 597,
 &end
#
#   40 ILE  QG2          40 ILE  QD1         4.50    (#    381:20  Unique         2.23, 3.71 A)
 &rst
  ixpk= 381, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 588, 589, 590,
 igr2= 595, 596, 597,
 &end
#
#   40 ILE  HN           41 HIS  HA          5.50    (#    382:20  Unique         4.79, 4.93 A)
 &rst
  ixpk= 382, nxpk= 20, iat= 582, 603, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   43 SER  HN           42 PHE  HA          4.50    (#    383:20  Unique         2.07, 2.15 A)
 &rst
  ixpk= 383, nxpk= 20, iat= 638, 620, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 LEU  MDY          42 PHE  HB+         5.50    (#    384:20  Unique         2.21, 4.42 A)
 &rst
  ixpk= 384, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2= 622, 623,
 &end
#
#   42 PHE  HA           42 PHE  HB+         5.50    (#    385:20  Unique         2.45, 2.78 A)
 &rst
  ixpk= 385, nxpk= 20, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 622, 623,
 &end
#
#    0 AMB  20-2:386     43 SER  HA          4.50    (#    386:20  Single Ambig)
 &rst
  ixpk= 386, nxpk= 20, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 649, 638,
 &end
#
#   43 SER  HB-          43 SER  HA          3.50    (#    388:20  Unique         2.29, 2.54 A)
 &rst
  ixpk= 388, nxpk= 20, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 642, 643,
 &end
#
#   89 PRO  HB+          43 SER  HA          4.50    (#    389:20  Unique         2.42, 4.07 A)
 &rst
  ixpk= 389, nxpk= 20, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1371,1372,
 &end
#
#   89 PRO  HB-          43 SER  HA          4.50    (#    390:20  Unique         2.42, 4.07 A)
 &rst
  ixpk= 390, nxpk= 20, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1371,1372,
 &end
#
#    0 AMB  20-2:391      0 AMB  20-1:391    5.50    (#    391:20  Double Ambig)
 &rst
  ixpk= 391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 649, 638,
 igr2= 642, 643, 642, 643,
 &end
#
#   43 SER  HA           43 SER  HB+         4.50    (#    392:20  Unique         2.29, 2.54 A)
 &rst
  ixpk= 392, nxpk= 20, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 642, 643,
 &end
#
#   44 ASP  HN           44 ASP  HA          4.50    (#    393:20  Unique         2.23, 2.85 A)
 &rst
  ixpk= 393, nxpk= 20, iat= 649, 651, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:394     44 ASP  HA          4.50    (#    394:20  Single Ambig)
 &rst
  ixpk= 394, nxpk= 20, iat=  -1, 651, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 653, 654, 653, 654,
 &end
#
#  105 ILE  HB          104 GLN  HA          5.50    (#    395:20  Unique         4.36, 4.66 A)
 &rst
  ixpk= 395, nxpk= 20, iat=1595,1576, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 GLN  HG-         104 GLN  HA          4.50    (#    396:20  Unique         2.53, 2.94 A)
 &rst
  ixpk= 396, nxpk= 20, iat=  -1,1576, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1581,1582,
 &end
#
#  104 GLN  HG+         104 GLN  HA          5.50    (#    397:20  Unique         2.53, 2.94 A)
 &rst
  ixpk= 397, nxpk= 20, iat=  -1,1576, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1581,1582,
 &end
#
#  105 ILE  HA          104 GLN  HA          5.50    (#    398:20  Unique         4.42, 4.49 A)
 &rst
  ixpk= 398, nxpk= 20, iat=1593,1576, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 GLN  HN          104 GLN  HA          5.50    (#    399:20  Unique         2.92, 2.95 A)
 &rst
  ixpk= 399, nxpk= 20, iat=1574,1576, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 ILE  HN          104 GLN  HA          4.50    (#    400:20  Unique         2.16, 2.22 A)
 &rst
  ixpk= 400, nxpk= 20, iat=1591,1576, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   46 ALA  HN           46 ALA  HA          5.50    (#    401:20  Unique         2.90, 2.96 A)
 &rst
  ixpk= 401, nxpk= 20, iat= 672, 674, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 TRP  HN           46 ALA  HA          4.50    (#    403:20  Unique         2.18, 2.37 A)
 &rst
  ixpk= 403, nxpk= 20, iat= 682, 674, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   46 ALA  MB           46 ALA  HA          3.50    (#    404:20  Unique         2.42, 2.67 A)
 &rst
  ixpk= 404, nxpk= 20, iat=  -1, 674, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 676, 677, 678,
 &end
#
#   74 ASN  HN           46 ALA  MB          4.50    (#    405:20  Unique         2.63, 4.50 A)
 &rst
  ixpk= 405, nxpk= 20, iat=1114,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 676, 677, 678,
 &end
#
#   46 ALA  HN           46 ALA  MB          4.50    (#    406:20  Unique         2.53, 3.31 A)
 &rst
  ixpk= 406, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 676, 677, 678,
 &end
#
#   47 TRP  HN           46 ALA  MB          4.50    (#    407:20  Unique         2.19, 3.41 A)
 &rst
  ixpk= 407, nxpk= 20, iat= 682,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 676, 677, 678,
 &end
#
#   49 ILE  HG1+         49 ILE  HB          4.50    (#    408:20  Unique         2.32, 2.48 A)
 &rst
  ixpk= 408, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 740, 741,
 &end
#
#   76 TRP  HZ3          49 ILE  QD1         6.50    (#    409:20  Unique         4.69, 6.87 A)
 &rst
  ixpk= 409, nxpk= 20, iat=1157,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 743, 744, 745,
 &end
#
#   49 ILE  HB           49 ILE  QD1         4.50    (#    410:20  Unique         2.67, 3.86 A)
 &rst
  ixpk= 410, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 743, 744, 745,
 &end
#
#   49 ILE  HG1-         49 ILE  QD1         3.50    (#    411:20  Unique         2.37, 2.66 A)
 &rst
  ixpk= 411, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 740, 741,
 igr2= 743, 744, 745,
 &end
#
#   23 ALA  MB           49 ILE  QD1         3.50    (#    412:20  Unique         2.25, 4.27 A)
 &rst
  ixpk= 412, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 343, 344, 345,
 igr2= 743, 744, 745,
 &end
#
#    0 AMB  20-2:413     49 ILE  QD1         4.50    (#    413:20  Single Ambig)
 &rst
  ixpk= 413, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 586, 353, 354,
 igr2= 743, 744, 745,
 &end
#
#   50 MET  HN           49 ILE  QG2         4.50    (#    414:20  Unique         2.42, 3.17 A)
 &rst
  ixpk= 414, nxpk= 20, iat= 749,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 736, 737, 738,
 &end
#
#   50 MET  HG+          49 ILE  QG2         5.50    (#    415:20  Unique         5.12, 6.24 A)
 &rst
  ixpk= 415, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 756, 757,
 igr2= 736, 737, 738,
 &end
#
#   49 ILE  HB           49 ILE  QG2         3.50    (#    416:20  Unique         2.41, 2.67 A)
 &rst
  ixpk= 416, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 736, 737, 738,
 &end
#
#   49 ILE  HG1-         49 ILE  QG2         3.50    (#    417:20  Unique         2.35, 3.55 A)
 &rst
  ixpk= 417, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 740, 741,
 igr2= 736, 737, 738,
 &end
#
#    0 AMB  20-2:418     49 ILE  QG2         5.50    (#    418:20  Single Ambig)
 &rst
  ixpk= 418, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 586,1517,1518,
 igr2= 736, 737, 738,
 &end
#
#   51 VAL  HN           50 MET  HA          3.50    (#    420:20  Unique         2.10, 2.22 A)
 &rst
  ixpk= 420, nxpk= 20, iat= 766, 751, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   50 MET  HN           50 MET  HA          5.50    (#    421:20  Unique         2.97, 2.98 A)
 &rst
  ixpk= 421, nxpk= 20, iat= 749, 751, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 LEU  HN           50 MET  HA          5.50    (#    422:20  Unique         2.16, 2.66 A)
 &rst
  ixpk= 422, nxpk= 20, iat= 976, 751, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   63 PRO  HA           50 MET  HA          4.50    (#    423:20  Unique         2.41, 2.71 A)
 &rst
  ixpk= 423, nxpk= 20, iat= 972, 751, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 MET  HG+          50 MET  HA          4.50    (#    424:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 424, nxpk= 20, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 756, 757,
 &end
#
#   64 LEU  HB-          50 MET  HA          5.50    (#    425:20  Unique         2.46, 3.50 A)
 &rst
  ixpk= 425, nxpk= 20, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 980, 981,
 &end
#
#   50 MET  HB-          50 MET  HA          4.50    (#    426:20  Unique         2.42, 2.76 A)
 &rst
  ixpk= 426, nxpk= 20, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 753, 754,
 &end
#
#   51 VAL  MGX          50 MET  HA          4.50    (#    427:20  Unique         3.22, 4.75 A)
 &rst
  ixpk= 427, nxpk= 20, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 772, 773, 774, 776, 777, 778,
 &end
#
#   50 MET  HB-          50 MET  HG-         4.50    (#    428:20  Unique         2.36, 2.77 A)
 &rst
  ixpk= 428, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 753, 754,
 igr2= 756, 757,
 &end
#
#   50 MET  HB-          50 MET  HG+         4.50    (#    429:20  Unique         2.36, 2.77 A)
 &rst
  ixpk= 429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 753, 754,
 igr2= 756, 757,
 &end
#
#   50 MET  HA           50 MET  HG+         5.50    (#    430:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 430, nxpk= 20, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 756, 757,
 &end
#
#   63 PRO  HA           50 MET  HG+         3.50    (#    431:20  Unique         1.96, 2.92 A)
 &rst
  ixpk= 431, nxpk= 20, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 756, 757,
 &end
#
#   52 PRO  HD-          51 VAL  HA          3.50    (#    434:20  Unique         2.00, 2.57 A)
 &rst
  ixpk= 434, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 783, 784,
 &end
#
#   52 PRO  HD+          51 VAL  HA          4.50    (#    435:20  Unique         2.00, 2.57 A)
 &rst
  ixpk= 435, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 783, 784,
 &end
#
#   51 VAL  HB           51 VAL  HA          3.50    (#    436:20  Unique         2.36, 2.53 A)
 &rst
  ixpk= 436, nxpk= 20, iat= 770, 768, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:437     51 VAL  HA          3.50    (#    437:20  Single Ambig)
 &rst
  ixpk= 437, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 772, 773, 774, 776, 777, 778, 565, 566, 567, 569,
       570, 571,
 &end
#
#   51 VAL  MGX          51 VAL  HA          4.50    (#    438:20  Unique         2.30, 3.48 A)
 &rst
  ixpk= 438, nxpk= 20, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 772, 773, 774, 776, 777, 778,
 &end
#
#   51 VAL  MGX          51 VAL  HB          3.50    (#    439:20  Unique         2.32, 2.64 A)
 &rst
  ixpk= 439, nxpk= 20, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 772, 773, 774, 776, 777, 778,
 &end
#
#    0 AMB  20-2:440     51 VAL  HB          3.50    (#    440:20  Single Ambig)
 &rst
  ixpk= 440, nxpk= 20, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 772, 773, 774, 776, 777, 778, 565, 566, 567, 569,
       570, 571,
 &end
#
#   52 PRO  HD+          51 VAL  HB          4.50    (#    441:20  Unique         2.08, 3.02 A)
 &rst
  ixpk= 441, nxpk= 20, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 783, 784,
 &end
#
#   52 PRO  HD-          51 VAL  HB          4.50    (#    442:20  Unique         2.08, 3.02 A)
 &rst
  ixpk= 442, nxpk= 20, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 783, 784,
 &end
#
#   51 VAL  HA           51 VAL  HB          4.50    (#    443:20  Unique         2.36, 2.53 A)
 &rst
  ixpk= 443, nxpk= 20, iat= 768, 770, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 VAL  HB           51 VAL  MGX         3.50    (#    444:20  Unique         2.32, 2.64 A)
 &rst
  ixpk= 444, nxpk= 20, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   64 LEU  HA           51 VAL  MGX         4.50    (#    446:20  Unique         2.23, 4.30 A)
 &rst
  ixpk= 446, nxpk= 20, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   61 TRP  HA           51 VAL  MGX         5.50    (#    447:20  Unique         5.18, 6.87 A)
 &rst
  ixpk= 447, nxpk= 20, iat= 924,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#    0 AMB  20-2:449     51 VAL  MGX         5.50    (#    449:20  Single Ambig)
 &rst
  ixpk= 449, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 976, 995,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   51 VAL  HN           51 VAL  MGX         4.50    (#    450:20  Unique         2.18, 3.64 A)
 &rst
  ixpk= 450, nxpk= 20, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   62 VAL  MGY          51 VAL  MGY         3.50    (#    451:20  Unique         2.47, 6.60 A)
 &rst
  ixpk= 451, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 952, 953, 954, 956, 957, 958,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   51 VAL  HB           51 VAL  MGY         3.50    (#    452:20  Unique         2.32, 2.64 A)
 &rst
  ixpk= 452, nxpk= 20, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   52 PRO  HD+          51 VAL  MGY         4.50    (#    453:20  Unique         2.05, 4.47 A)
 &rst
  ixpk= 453, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 783, 784,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   64 LEU  HA           51 VAL  MGY         4.50    (#    454:20  Unique         2.23, 4.30 A)
 &rst
  ixpk= 454, nxpk= 20, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   51 VAL  HA           51 VAL  MGY         4.50    (#    455:20  Unique         2.30, 3.48 A)
 &rst
  ixpk= 455, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   52 PRO  HG-          52 PRO  HB-         4.50    (#    456:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 456, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 786, 787,
 igr2= 789, 790,
 &end
#
#   52 PRO  HG+          52 PRO  HB+         4.50    (#    457:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 457, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 786, 787,
 igr2= 789, 790,
 &end
#
#    0 AMB  20-2:458     54 LYS  HB-         3.50    (#    458:20  Single Ambig)
 &rst
  ixpk= 458, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 810, 811, 810, 811,
 igr2= 807, 808,
 &end
#
#    0 AMB  20-2:459      0 AMB  20-1:459    3.50    (#    459:20  Double Ambig)
 &rst
  ixpk= 459, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 810, 811, 810, 811,
 igr2= 807, 808, 807, 808,
 &end
#
#   54 LYS  HA           54 LYS  HB-         3.50    (#    460:20  Unique         2.37, 2.74 A)
 &rst
  ixpk= 460, nxpk= 20, iat= 805,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 807, 808,
 &end
#
#   54 LYS  HA           54 LYS  HB+         4.50    (#    461:20  Unique         2.37, 2.74 A)
 &rst
  ixpk= 461, nxpk= 20, iat= 805,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 807, 808,
 &end
#
#   56 PRO  HA           56 PRO  HB+         2.80    (#    468:20  Unique         2.27, 2.53 A)
 &rst
  ixpk= 468, nxpk= 20, iat= 849,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 846, 847,
 &end
#
#   37 PRO  HB-          37 PRO  HG+         2.80    (#    473:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 473, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 552, 553,
 igr2= 549, 550,
 &end
#
#   57 SER  HA           57 SER  HB-         3.50    (#    474:20  Unique         2.44, 2.75 A)
 &rst
  ixpk= 474, nxpk= 20, iat= 855,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 857, 858,
 &end
#
#   57 SER  HA           57 SER  HB+         4.50    (#    475:20  Unique         2.44, 2.75 A)
 &rst
  ixpk= 475, nxpk= 20, iat= 855,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 857, 858,
 &end
#
#   59 TRP  HN           58 ALA  MB          3.50    (#    476:20  Unique         2.09, 3.48 A)
 &rst
  ixpk= 476, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 868, 869, 870,
 &end
#
#   58 ALA  HA           58 ALA  MB          3.50    (#    477:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 477, nxpk= 20, iat= 866,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 868, 869, 870,
 &end
#
#   59 TRP  HA           59 TRP  HB-         4.50    (#    478:20  Unique         2.17, 2.66 A)
 &rst
  ixpk= 478, nxpk= 20, iat= 876,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 878, 879,
 &end
#
#   59 TRP  HA           59 TRP  HB+         4.50    (#    479:20  Unique         2.17, 2.66 A)
 &rst
  ixpk= 479, nxpk= 20, iat= 876,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 878, 879,
 &end
#
#  111 LEU  MDX         120 PRO  HB+         4.50    (#    481:20  Unique         2.17, 4.25 A)
 &rst
  ixpk= 481, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=1808,1809,
 &end
#
#  111 LEU  MDY         120 PRO  HB+         4.50    (#    482:20  Unique         2.17, 4.25 A)
 &rst
  ixpk= 482, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=1808,1809,
 &end
#
#    0 AMB  20-2:483      0 AMB  20-1:483    6.50    (#    483:20  Double Ambig)
 &rst
  ixpk= 483, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=13.26, r4=13.76,
 igr1= 772, 773, 774, 776, 777, 778, 565, 566, 567, 569,
       570, 571,
 igr2= 902, 903, 902, 903, 902, 903,
 &end
#
#  137 ALA  MB          120 PRO  HB+         3.50    (#    484:20  Unique         2.34, 4.36 A)
 &rst
  ixpk= 484, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2065,2066,2067,
 igr2=1808,1809,
 &end
#
#    0 AMB  20-2:485     97 VAL  HA          4.50    (#    485:20  Single Ambig)
 &rst
  ixpk= 485, nxpk= 20, iat=  -1,1477, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1475,1646,1654,
 &end
#
#   98 VAL  HB           97 VAL  HA          4.50    (#    486:20  Unique         4.51, 4.54 A)
 &rst
  ixpk= 486, nxpk= 20, iat=1495,1477, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 VAL  MGX          97 VAL  HA          3.50    (#    487:20  Unique         2.37, 3.16 A)
 &rst
  ixpk= 487, nxpk= 20, iat=  -1,1477, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   97 VAL  MGY          97 VAL  HA          3.50    (#    488:20  Unique         2.37, 3.16 A)
 &rst
  ixpk= 488, nxpk= 20, iat=  -1,1477, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   97 VAL  MGY          97 VAL  HB          3.50    (#    489:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 489, nxpk= 20, iat=  -1,1479, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   97 VAL  MGX          97 VAL  HB          2.80    (#    490:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 490, nxpk= 20, iat=  -1,1479, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   40 ILE  HB           97 VAL  HB          3.50    (#    491:20  Unique         2.20, 2.29 A)
 &rst
  ixpk= 491, nxpk= 20, iat= 586,1479, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   97 VAL  HA           97 VAL  HB          4.50    (#    492:20  Unique         3.02, 3.04 A)
 &rst
  ixpk= 492, nxpk= 20, iat=1477,1479, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 PHE  HE           97 VAL  HB          4.50    (#    493:20  Unique         2.36, 4.89 A)
 &rst
  ixpk= 493, nxpk= 20, iat=  -1,1479, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 628, 632,
 &end
#
#   97 VAL  HN           97 VAL  HB          4.50    (#    494:20  Unique         2.25, 2.41 A)
 &rst
  ixpk= 494, nxpk= 20, iat=1475,1479, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   98 VAL  HN           97 VAL  MGY         4.50    (#    495:20  Unique         2.72, 4.14 A)
 &rst
  ixpk= 495, nxpk= 20, iat=1491,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#  109 SER  HN           97 VAL  MGY         6.50    (#    496:20  Unique         5.69, 7.62 A)
 &rst
  ixpk= 496, nxpk= 20, iat=1658,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#    0 AMB  20-2:497     97 VAL  MGY         4.50    (#    497:20  Single Ambig)
 &rst
  ixpk= 497, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1475,1646,1654,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#  108 PHE  HE           97 VAL  MGY         4.50    (#    499:20  Unique         2.32, 4.24 A)
 &rst
  ixpk= 499, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1648,1652,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   42 PHE  HD           97 VAL  MGY         4.50    (#    500:20  Unique         2.52, 6.39 A)
 &rst
  ixpk= 500, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 626, 634,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#  108 PHE  HB-          97 VAL  MGY         4.50    (#    503:20  Unique         2.74, 5.24 A)
 &rst
  ixpk= 503, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1642,1643,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#  108 PHE  HB+          97 VAL  MGY         5.50    (#    504:20  Unique         2.74, 5.24 A)
 &rst
  ixpk= 504, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1642,1643,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   97 VAL  HB           97 VAL  MGY         3.50    (#    505:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 505, nxpk= 20, iat=1479,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   40 ILE  HB           97 VAL  MGY         4.50    (#    506:20  Unique         3.25, 4.24 A)
 &rst
  ixpk= 506, nxpk= 20, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   96 GLN  HB+          97 VAL  MGX         3.50    (#    509:20  Unique         2.86, 5.58 A)
 &rst
  ixpk= 509, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1462,1463,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#    8 VAL  HB            8 VAL  MGY         3.50    (#    510:20  Unique         2.37, 2.66 A)
 &rst
  ixpk= 510, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    8 VAL  HB            8 VAL  MGY         3.50    (#    511:20  Unique         2.37, 2.66 A)
 &rst
  ixpk= 511, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    8 VAL  HA            8 VAL  MGY         3.50    (#    513:20  Unique         2.37, 3.15 A)
 &rst
  ixpk= 513, nxpk= 20, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#  108 PHE  HE           97 VAL  MGX         4.50    (#    514:20  Unique         2.32, 4.24 A)
 &rst
  ixpk= 514, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1648,1652,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#    0 AMB  20-2:515     97 VAL  MGX         4.50    (#    515:20  Single Ambig)
 &rst
  ixpk= 515, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1475,1646,1654,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   98 VAL  HN           97 VAL  MGX         4.50    (#    516:20  Unique         2.72, 4.14 A)
 &rst
  ixpk= 516, nxpk= 20, iat=1491,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   64 LEU  HN           63 PRO  HA          5.50    (#    517:20  Unique         2.18, 2.26 A)
 &rst
  ixpk= 517, nxpk= 20, iat= 976, 972, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:518      0 AMB  20-1:518    5.50    (#    518:20  Double Ambig)
 &rst
  ixpk= 518, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 535, 536, 535, 536,1530,1531,1002,1003,1019,1020,
      
 igr2= 555, 972,
 &end
#
#    0 AMB  20-2:519      0 AMB  20-1:519    5.50    (#    519:20  Double Ambig)
 &rst
  ixpk= 519, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 471, 472, 473, 753, 754,
 igr2= 555, 972,
 &end
#
#    0 AMB  20-2:520     63 PRO  HB-         5.50    (#    520:20  Single Ambig)
 &rst
  ixpk= 520, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 995, 976,
 igr2= 969, 970,
 &end
#
#   63 PRO  HA           63 PRO  HB-         4.50    (#    521:20  Unique         2.29, 2.59 A)
 &rst
  ixpk= 521, nxpk= 20, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 969, 970,
 &end
#
#   63 PRO  HD+          63 PRO  HB-         4.50    (#    522:20  Unique         2.77, 3.67 A)
 &rst
  ixpk= 522, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 963, 964,
 igr2= 969, 970,
 &end
#
#   51 VAL  HA           52 PRO  HD-         4.50    (#    523:20  Unique         2.00, 2.57 A)
 &rst
  ixpk= 523, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 783, 784,
 &end
#
#   51 VAL  HA           52 PRO  HD+         4.50    (#    524:20  Unique         2.00, 2.57 A)
 &rst
  ixpk= 524, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 783, 784,
 &end
#
#   51 VAL  HB           52 PRO  HD-         4.50    (#    525:20  Unique         2.08, 3.02 A)
 &rst
  ixpk= 525, nxpk= 20, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 783, 784,
 &end
#
#   51 VAL  HB           52 PRO  HD+         4.50    (#    526:20  Unique         2.08, 3.02 A)
 &rst
  ixpk= 526, nxpk= 20, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 783, 784,
 &end
#
#    0 AMB  20-2:527      0 AMB  20-1:527    4.50    (#    527:20  Double Ambig)
 &rst
  ixpk= 527, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 772, 773, 774, 776, 777, 778, 565, 566, 567, 569,
       570, 571,
 igr2= 783, 784, 783, 784,
 &end
#
#    0 AMB  20-2:528     52 PRO  HD-         4.50    (#    528:20  Single Ambig)
 &rst
  ixpk= 528, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 772, 773, 774, 776, 777, 778, 565, 566, 567, 569,
       570, 571,
 igr2= 783, 784,
 &end
#
#    0 AMB  20-2:529     52 PRO  HD-         4.50    (#    529:20  Single Ambig)
 &rst
  ixpk= 529, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 985, 986, 987, 989, 990, 991, 952, 953, 954, 956,
       957, 958,
 igr2= 783, 784,
 &end
#
#    0 AMB  20-2:530      0 AMB  20-1:530    4.50    (#    530:20  Double Ambig)
 &rst
  ixpk= 530, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 985, 986, 987, 989, 990, 991, 952, 953, 954, 956,
       957, 958,
 igr2= 783, 784, 783, 784,
 &end
#
#    0 AMB  20-2:531     64 LEU  HA          3.50    (#    531:20  Single Ambig)
 &rst
  ixpk= 531, nxpk= 20, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 995, 976,
 &end
#
#   73 GLN  HB-          73 GLN  HA          3.50    (#    532:20  Unique         2.30, 2.43 A)
 &rst
  ixpk= 532, nxpk= 20, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1101,1102,
 &end
#
#    0 AMB  20-2:533      0 AMB  20-1:533    3.50    (#    533:20  Double Ambig)
 &rst
  ixpk= 533, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 983,1118,1119,
 igr2= 978,1099,
 &end
#
#   64 LEU  HB+          64 LEU  HA          4.50    (#    534:20  Unique         2.33, 2.74 A)
 &rst
  ixpk= 534, nxpk= 20, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#   51 VAL  MGY          64 LEU  HA          4.50    (#    535:20  Unique         2.23, 4.30 A)
 &rst
  ixpk= 535, nxpk= 20, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 772, 773, 774, 776, 777, 778,
 &end
#
#   62 VAL  MGY          64 LEU  HA          4.50    (#    536:20  Unique         3.53, 6.26 A)
 &rst
  ixpk= 536, nxpk= 20, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 952, 953, 954, 956, 957, 958,
 &end
#
#   64 LEU  MDX          64 LEU  HA          3.50    (#    537:20  Unique         2.22, 3.90 A)
 &rst
  ixpk= 537, nxpk= 20, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 985, 986, 987, 989, 990, 991,
 &end
#
#  133 ASP  HN          132 LEU  HB+         4.50    (#    538:20  Unique         2.28, 3.21 A)
 &rst
  ixpk= 538, nxpk= 20, iat=1999,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1984,1985,
 &end
#
#  132 LEU  HN          132 LEU  HB+         5.50    (#    539:20  Unique         2.27, 3.42 A)
 &rst
  ixpk= 539, nxpk= 20, iat=1980,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1984,1985,
 &end
#
#  132 LEU  HA          132 LEU  HB+         4.50    (#    540:20  Unique         2.16, 2.79 A)
 &rst
  ixpk= 540, nxpk= 20, iat=1982,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1984,1985,
 &end
#
#    0 AMB  20-2:541      0 AMB  20-1:541    3.50    (#    541:20  Double Ambig)
 &rst
  ixpk= 541, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1989,1990,1991,1993,1994,1995, 985, 986, 987, 989,
       990, 991,
 igr2=1984,1985, 980, 981,
 &end
#
#   65 GLN  HB+          65 GLN  HA          4.50    (#    545:20  Unique         2.35, 2.73 A)
 &rst
  ixpk= 545, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 999,1000,
 &end
#
#   65 GLN  HB-          65 GLN  HA          4.50    (#    546:20  Unique         2.35, 2.73 A)
 &rst
  ixpk= 546, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 999,1000,
 &end
#
#   65 GLN  HG+          65 GLN  HA          3.50    (#    547:20  Unique         2.15, 3.09 A)
 &rst
  ixpk= 547, nxpk= 20, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1002,1003,
 &end
#
#   65 GLN  HN           65 GLN  HA          4.50    (#    548:20  Unique         2.19, 2.84 A)
 &rst
  ixpk= 548, nxpk= 20, iat= 995, 997, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 GLN  HA           65 GLN  HB+         3.50    (#    549:20  Unique         2.35, 2.73 A)
 &rst
  ixpk= 549, nxpk= 20, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 999,1000,
 &end
#
#   65 GLN  HE2-         65 GLN  HG+         4.50    (#    550:20  Unique         2.21, 3.28 A)
 &rst
  ixpk= 550, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1007,1008,
 igr2=1002,1003,
 &end
#
#   66 GLU  HN            0 AMB  20-1:551    4.50    (#    551:20  Single Ambig)
 &rst
  ixpk= 551, nxpk= 20, iat=1012,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1019,1020,1019,1020,
 &end
#
#    0 AMB  20-2:552      0 AMB  20-1:552    3.50    (#    552:20  Double Ambig)
 &rst
  ixpk= 552, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1073,1014,
 igr2=1078,1079,1078,1079,1019,1020,1019,1020,
 &end
#
#   68 ALA  HN           67 ASP  HA          4.50    (#    553:20  Unique         3.07, 3.46 A)
 &rst
  ixpk= 553, nxpk= 20, iat=1039,1029, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   67 ASP  HB+          67 ASP  HA          3.50    (#    554:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 554, nxpk= 20, iat=  -1,1029, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1031,1032,
 &end
#
#   67 ASP  HB-          67 ASP  HA          3.50    (#    555:20  Unique         2.35, 2.71 A)
 &rst
  ixpk= 555, nxpk= 20, iat=  -1,1029, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1031,1032,
 &end
#
#    0 AMB  20-2:556      0 AMB  20-1:556    5.50    (#    556:20  Double Ambig)
 &rst
  ixpk= 556, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1043,1044,1045,1053,1054,1055,
 igr2=1063,1064,1031,1032,
 &end
#
#    0 AMB  20-2:557      0 AMB  20-1:557    5.50    (#    557:20  Double Ambig)
 &rst
  ixpk= 557, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1043,1044,1045,1053,1054,1055,
 igr2=1063,1064,1063,1064,1031,1032,
 &end
#
#   68 ALA  HN           68 ALA  HA          3.50    (#    559:20  Unique         2.88, 2.94 A)
 &rst
  ixpk= 559, nxpk= 20, iat=1039,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   69 ALA  HN           68 ALA  HA          3.50    (#    560:20  Unique         2.35, 3.16 A)
 &rst
  ixpk= 560, nxpk= 20, iat=1049,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 ALA  MB           68 ALA  HA          2.80    (#    561:20  Unique         2.40, 2.65 A)
 &rst
  ixpk= 561, nxpk= 20, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1043,1044,1045,
 &end
#
#   71 GLU  HN            0 AMB  20-1:562    5.50    (#    562:20  Single Ambig)
 &rst
  ixpk= 562, nxpk= 20, iat=1071,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1043,1044,1045,1053,1054,1055,
 &end
#
#   68 ALA  HN           68 ALA  MB          3.50    (#    563:20  Unique         2.39, 2.98 A)
 &rst
  ixpk= 563, nxpk= 20, iat=1039,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1043,1044,1045,
 &end
#
#   68 ALA  HA           68 ALA  MB          3.50    (#    565:20  Unique         2.40, 2.65 A)
 &rst
  ixpk= 565, nxpk= 20, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1043,1044,1045,
 &end
#
#    0 AMB  20-2:567     69 ALA  HA          3.50    (#    567:20  Single Ambig)
 &rst
  ixpk= 567, nxpk= 20, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1049,1059,
 &end
#
#   69 ALA  MB           69 ALA  HA          2.80    (#    568:20  Unique         2.39, 2.65 A)
 &rst
  ixpk= 568, nxpk= 20, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1053,1054,1055,
 &end
#
#   71 GLU  HN           70 ASP  HA          4.50    (#    570:20  Unique         2.14, 3.01 A)
 &rst
  ixpk= 570, nxpk= 20, iat=1071,1061, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   70 ASP  HN           70 ASP  HA          5.50    (#    571:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 571, nxpk= 20, iat=1059,1061, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:572    141 ARG  HA          5.50    (#    572:20  Single Ambig)
 &rst
  ixpk= 572, nxpk= 20, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1662,1663,1662,1663,
 &end
#
#   70 ASP  HB-          70 ASP  HA          4.50    (#    573:20  Unique         2.44, 2.76 A)
 &rst
  ixpk= 573, nxpk= 20, iat=  -1,1061, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1063,1064,
 &end
#
#   70 ASP  HB+          70 ASP  HA          4.50    (#    574:20  Unique         2.44, 2.76 A)
 &rst
  ixpk= 574, nxpk= 20, iat=  -1,1061, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1063,1064,
 &end
#
#    0 AMB  20-2:575      0 AMB  20-1:575    5.50    (#    575:20  Double Ambig)
 &rst
  ixpk= 575, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 999,1000,2125,2126,
 igr2=1061,2123,
 &end
#
#   71 GLU  HA            0 AMB  20-1:576    3.50    (#    576:20  Single Ambig)
 &rst
  ixpk= 576, nxpk= 20, iat=1073,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 999,1000,1075,1076,
 &end
#
#   71 GLU  HN            0 AMB  20-1:577    4.50    (#    577:20  Single Ambig)
 &rst
  ixpk= 577, nxpk= 20, iat=1071,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1075,1076, 999,1000,
 &end
#
#   69 ALA  MB            0 AMB  20-1:578    5.50    (#    578:20  Single Ambig)
 &rst
  ixpk= 578, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1053,1054,1055,
 igr2=1078,1079,1078,1079,
 &end
#
#    0 AMB  20-2:579      0 AMB  20-1:579    2.80    (#    579:20  Double Ambig)
 &rst
  ixpk= 579, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1790,1791,1790,1791,
 igr2=1793,1794,1793,1794,
 &end
#
#   78 GLU  HN           78 GLU  HA          3.50    (#    580:20  Unique         2.81, 2.93 A)
 &rst
  ixpk= 580, nxpk= 20, iat=1176,1178, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 GLU  HN           78 GLU  HA          3.50    (#    581:20  Unique         3.04, 3.43 A)
 &rst
  ixpk= 581, nxpk= 20, iat=1191,1178, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 SER  HN           72 SER  HA          4.50    (#    582:20  Unique         2.21, 2.81 A)
 &rst
  ixpk= 582, nxpk= 20, iat=1086,1088, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 GLN  HN           72 SER  HA          3.50    (#    583:20  Unique         2.68, 3.30 A)
 &rst
  ixpk= 583, nxpk= 20, iat=1097,1088, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 SER  HB-          72 SER  HA          3.50    (#    584:20  Unique         2.36, 2.50 A)
 &rst
  ixpk= 584, nxpk= 20, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1090,1091,
 &end
#
#    0 AMB  20-2:585     78 GLU  HA          2.80    (#    585:20  Single Ambig)
 &rst
  ixpk= 585, nxpk= 20, iat=  -1,1178, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1180,1181,1180,1181,
 &end
#
#   73 GLN  HA           73 GLN  HB-         4.50    (#    586:20  Unique         2.30, 2.43 A)
 &rst
  ixpk= 586, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1101,1102,
 &end
#
#   78 GLU  HN           77 ASP  HA          3.50    (#    587:20  Unique         2.20, 2.31 A)
 &rst
  ixpk= 587, nxpk= 20, iat=1176,1166, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 GLU  HN           77 ASP  HB+         5.50    (#    588:20  Unique         2.48, 3.76 A)
 &rst
  ixpk= 588, nxpk= 20, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1168,1169,
 &end
#
#   76 TRP  HA           77 ASP  HB+         5.50    (#    590:20  Unique         3.95, 5.26 A)
 &rst
  ixpk= 590, nxpk= 20, iat=1142,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1168,1169,
 &end
#
#   77 ASP  HA           77 ASP  HB+         3.50    (#    591:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 591, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1168,1169,
 &end
#
#   80 LEU  HG           77 ASP  HB+         4.50    (#    593:20  Unique         2.13, 3.11 A)
 &rst
  ixpk= 593, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1168,1169,
 &end
#
#   80 LEU  HG           77 ASP  HB-         4.50    (#    594:20  Unique         2.13, 3.11 A)
 &rst
  ixpk= 594, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1168,1169,
 &end
#
#    0 AMB  20-2:595     78 GLU  HA          3.50    (#    595:20  Single Ambig)
 &rst
  ixpk= 595, nxpk= 20, iat=  -1,1178, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1183,1184,1198,1199,
 &end
#
#    0 AMB  20-2:596     78 GLU  HA          3.50    (#    596:20  Single Ambig)
 &rst
  ixpk= 596, nxpk= 20, iat=  -1,1178, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1183,1184,1198,1199,
 &end
#
#   79 GLU  HN           78 GLU  HG+         4.50    (#    597:20  Unique         2.39, 3.18 A)
 &rst
  ixpk= 597, nxpk= 20, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1183,1184,
 &end
#
#   79 GLU  HN           78 GLU  HG-         4.50    (#    598:20  Unique         2.39, 3.18 A)
 &rst
  ixpk= 598, nxpk= 20, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1183,1184,
 &end
#
#   78 GLU  HN           78 GLU  HG+         4.50    (#    599:20  Unique         2.00, 2.84 A)
 &rst
  ixpk= 599, nxpk= 20, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1183,1184,
 &end
#
#   78 GLU  HN           78 GLU  HG-         4.50    (#    600:20  Unique         2.00, 2.84 A)
 &rst
  ixpk= 600, nxpk= 20, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1183,1184,
 &end
#
#    0 AMB  20-2:601      0 AMB  20-1:601    3.50    (#    601:20  Double Ambig)
 &rst
  ixpk= 601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1178,1193,
 igr2=1183,1184,1183,1184,
 &end
#
#   79 GLU  HN           79 GLU  HB-         4.50    (#    602:20  Unique         2.33, 3.21 A)
 &rst
  ixpk= 602, nxpk= 20, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1195,1196,
 &end
#
#    9 ALA  MB           79 GLU  HB-         4.50    (#    605:20  Unique         2.18, 4.18 A)
 &rst
  ixpk= 605, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 130, 131, 132,
 igr2=1195,1196,
 &end
#
#   81 SER  HN           80 LEU  HA          3.50    (#    606:20  Unique         2.06, 2.15 A)
 &rst
  ixpk= 606, nxpk= 20, iat=1225,1208, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 LEU  HN           80 LEU  HA          4.50    (#    607:20  Unique         2.98, 2.99 A)
 &rst
  ixpk= 607, nxpk= 20, iat=1206,1208, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  114 ASN  HA           80 LEU  HA          4.50    (#    608:20  Unique         2.98, 3.21 A)
 &rst
  ixpk= 608, nxpk= 20, iat=1736,1208, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 LEU  HB-          80 LEU  HA          4.50    (#    609:20  Unique         2.40, 2.78 A)
 &rst
  ixpk= 609, nxpk= 20, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1210,1211,
 &end
#
#    9 ALA  MB           80 LEU  HA          4.50    (#    610:20  Unique         3.72, 4.88 A)
 &rst
  ixpk= 610, nxpk= 20, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 130, 131, 132,
 &end
#
#   80 LEU  MDX          80 LEU  HA          3.50    (#    613:20  Unique         2.12, 3.65 A)
 &rst
  ixpk= 613, nxpk= 20, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#   80 LEU  HN           80 LEU  HB-         4.50    (#    614:20  Unique         2.29, 3.15 A)
 &rst
  ixpk= 614, nxpk= 20, iat=1206,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1210,1211,
 &end
#
#   80 LEU  HN           80 LEU  HB+         5.50    (#    615:20  Unique         2.29, 3.15 A)
 &rst
  ixpk= 615, nxpk= 20, iat=1206,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1210,1211,
 &end
#
#   80 LEU  HA           80 LEU  HB-         5.50    (#    616:20  Unique         2.40, 2.78 A)
 &rst
  ixpk= 616, nxpk= 20, iat=1208,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1210,1211,
 &end
#
#   80 LEU  HA           80 LEU  HB+         5.50    (#    617:20  Unique         2.40, 2.78 A)
 &rst
  ixpk= 617, nxpk= 20, iat=1208,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1210,1211,
 &end
#
#   80 LEU  MDX          80 LEU  HB+         4.50    (#    618:20  Unique         2.31, 3.38 A)
 &rst
  ixpk= 618, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1215,1216,1217,1219,1220,1221,
 igr2=1210,1211,
 &end
#
#   80 LEU  MDX          80 LEU  HB-         4.50    (#    619:20  Unique         2.31, 3.38 A)
 &rst
  ixpk= 619, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1215,1216,1217,1219,1220,1221,
 igr2=1210,1211,
 &end
#
#   82 ILE  QD1          80 LEU  HB+         5.50    (#    620:20  Unique         2.52, 3.48 A)
 &rst
  ixpk= 620, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1249,1250,1251,
 igr2=1210,1211,
 &end
#
#   82 ILE  QD1          80 LEU  HB-         5.50    (#    621:20  Unique         2.52, 3.48 A)
 &rst
  ixpk= 621, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1249,1250,1251,
 igr2=1210,1211,
 &end
#
#    0 AMB  20-2:622     80 LEU  MDX         3.50    (#    622:20  Single Ambig)
 &rst
  ixpk= 622, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 188,1748,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#   80 LEU  HN           80 LEU  MDX         4.50    (#    623:20  Unique         3.07, 4.83 A)
 &rst
  ixpk= 623, nxpk= 20, iat=1206,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#   80 LEU  HA           80 LEU  MDX         3.50    (#    624:20  Unique         2.12, 3.65 A)
 &rst
  ixpk= 624, nxpk= 20, iat=1208,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#  114 ASN  HA           80 LEU  MDX         4.50    (#    625:20  Unique         2.43, 5.01 A)
 &rst
  ixpk= 625, nxpk= 20, iat=1736,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#   13 ALA  HA           80 LEU  MDX         4.50    (#    626:20  Unique         2.13, 3.55 A)
 &rst
  ixpk= 626, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#    0 AMB  20-2:627     80 LEU  MDX         3.50    (#    627:20  Single Ambig)
 &rst
  ixpk= 627, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 168, 169,1210,1211,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#    9 ALA  MB           80 LEU  MDX         3.50    (#    628:20  Unique         2.30, 5.34 A)
 &rst
  ixpk= 628, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 130, 131, 132,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#   80 LEU  HB+          80 LEU  MDX         3.50    (#    629:20  Unique         2.31, 3.38 A)
 &rst
  ixpk= 629, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1210,1211,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#   80 LEU  HG           80 LEU  MDX         3.50    (#    630:20  Unique         2.36, 2.65 A)
 &rst
  ixpk= 630, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#  121 LEU  HG           80 LEU  MDX         4.50    (#    631:20  Unique         2.84, 5.33 A)
 &rst
  ixpk= 631, nxpk= 20, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#    0 AMB  20-2:632     80 LEU  MDY         4.50    (#    632:20  Single Ambig)
 &rst
  ixpk= 632, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 188,1748,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#    0 AMB  20-2:633      0 AMB  20-1:633    3.50    (#    633:20  Double Ambig)
 &rst
  ixpk= 633, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1208,2013,
 igr2=1215,1216,1217,1219,1220,1221,1876,1877,1878,1880,
      1881,1882,
 &end
#
#  124 LEU  HA          124 LEU  MDX         3.50    (#    634:20  Unique         2.26, 4.10 A)
 &rst
  ixpk= 634, nxpk= 20, iat=1869,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#  110 LEU  HB+         124 LEU  MDX         4.50    (#    636:20  Unique         3.67, 5.78 A)
 &rst
  ixpk= 636, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1673,1674,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#   83 HIS  HN           82 ILE  HA          4.50    (#    637:20  Unique         2.09, 2.13 A)
 &rst
  ixpk= 637, nxpk= 20, iat=1255,1238, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  112 MET  HA           82 ILE  HA          5.50    (#    638:20  Unique         2.56, 2.71 A)
 &rst
  ixpk= 638, nxpk= 20, iat=1709,1238, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ILE  HN           82 ILE  HB          4.50    (#    640:20  Unique         2.26, 2.36 A)
 &rst
  ixpk= 640, nxpk= 20, iat=1236,1240, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  110 LEU  MDY          82 ILE  HB          4.50    (#    642:20  Unique         4.56, 6.31 A)
 &rst
  ixpk= 642, nxpk= 20, iat=  -1,1240, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:643     82 ILE  HB          4.50    (#    643:20  Single Ambig)
 &rst
  ixpk= 643, nxpk= 20, iat=  -1,1240, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1246,1247,1246,1247,
 &end
#
#   82 ILE  QG2          82 ILE  HB          3.50    (#    644:20  Unique         2.40, 2.65 A)
 &rst
  ixpk= 644, nxpk= 20, iat=  -1,1240, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1242,1243,1244,
 &end
#
#   82 ILE  HG1-         82 ILE  QD1         3.50    (#    647:20  Unique         2.34, 2.66 A)
 &rst
  ixpk= 647, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1246,1247,
 igr2=1249,1250,1251,
 &end
#
#  110 LEU  MDX          82 ILE  QD1         3.50    (#    648:20  Unique         4.22, 6.43 A)
 &rst
  ixpk= 648, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1678,1679,1680,1682,1683,1684,
 igr2=1249,1250,1251,
 &end
#
#   80 LEU  MDX          82 ILE  QD1         5.50    (#    649:20  Unique         2.53, 5.06 A)
 &rst
  ixpk= 649, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1215,1216,1217,1219,1220,1221,
 igr2=1249,1250,1251,
 &end
#
#   80 LEU  HG           82 ILE  QD1         4.50    (#    650:20  Unique         4.04, 5.15 A)
 &rst
  ixpk= 650, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1249,1250,1251,
 &end
#
#    0 AMB  20-2:651     82 ILE  QD1         3.50    (#    651:20  Single Ambig)
 &rst
  ixpk= 651, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1240,1210,1211,
 igr2=1249,1250,1251,
 &end
#
#   16 THR  MG2          82 ILE  QD1         4.50    (#    652:20  Unique         2.56, 4.71 A)
 &rst
  ixpk= 652, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 243, 244, 245,
 igr2=1249,1250,1251,
 &end
#
#  112 MET  ME           82 ILE  QD1         4.50    (#    653:20  Unique         2.29, 4.85 A)
 &rst
  ixpk= 653, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1718,1719,1720,
 igr2=1249,1250,1251,
 &end
#
#   80 LEU  HB-          82 ILE  QD1         4.50    (#    654:20  Unique         2.52, 3.48 A)
 &rst
  ixpk= 654, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1210,1211,
 igr2=1249,1250,1251,
 &end
#
#  112 MET  HG-          82 ILE  QD1         4.50    (#    655:20  Unique         2.34, 4.01 A)
 &rst
  ixpk= 655, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1714,1715,
 igr2=1249,1250,1251,
 &end
#
#   76 TRP  HB+          82 ILE  QD1         5.50    (#    656:20  Unique         2.57, 6.17 A)
 &rst
  ixpk= 656, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1144,1145,
 igr2=1249,1250,1251,
 &end
#
#   82 ILE  HA           82 ILE  QD1         4.50    (#    657:20  Unique         2.38, 3.30 A)
 &rst
  ixpk= 657, nxpk= 20, iat=1238,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1249,1250,1251,
 &end
#
#  112 MET  HA           82 ILE  QD1         4.50    (#    658:20  Unique         2.31, 3.71 A)
 &rst
  ixpk= 658, nxpk= 20, iat=1709,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1249,1250,1251,
 &end
#
#   83 HIS  HN           82 ILE  QG2         4.50    (#    659:20  Unique         2.42, 3.58 A)
 &rst
  ixpk= 659, nxpk= 20, iat=1255,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1242,1243,1244,
 &end
#
#   82 ILE  HN           82 ILE  QG2         5.50    (#    660:20  Unique         3.81, 4.36 A)
 &rst
  ixpk= 660, nxpk= 20, iat=1236,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1242,1243,1244,
 &end
#
#   82 ILE  HA           82 ILE  QG2         4.50    (#    661:20  Unique         2.91, 3.53 A)
 &rst
  ixpk= 661, nxpk= 20, iat=1238,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1242,1243,1244,
 &end
#
#    0 AMB  20-2:662     82 ILE  QG2         3.50    (#    662:20  Single Ambig)
 &rst
  ixpk= 662, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1240,1279,
 igr2=1242,1243,1244,
 &end
#
#  110 LEU  MDY          82 ILE  QG2         3.50    (#    663:20  Unique         2.38, 4.75 A)
 &rst
  ixpk= 663, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1678,1679,1680,1682,1683,1684,
 igr2=1242,1243,1244,
 &end
#
#    0 AMB  20-2:664     82 ILE  QG2         3.50    (#    664:20  Single Ambig)
 &rst
  ixpk= 664, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1246,1247,1281,1282,1283,1285,1286,1287,
 igr2=1242,1243,1244,
 &end
#
#   84 LEU  MDX          84 LEU  HB-         4.50    (#    666:20  Unique         2.26, 3.43 A)
 &rst
  ixpk= 666, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1276,1277,
 &end
#
#   84 LEU  MDY          84 LEU  HB-         3.50    (#    667:20  Unique         2.26, 3.43 A)
 &rst
  ixpk= 667, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1276,1277,
 &end
#
#   84 LEU  HA           84 LEU  HB+         4.50    (#    668:20  Unique         2.28, 2.76 A)
 &rst
  ixpk= 668, nxpk= 20, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1276,1277,
 &end
#
#   84 LEU  HA           84 LEU  HB-         4.50    (#    669:20  Unique         2.28, 2.76 A)
 &rst
  ixpk= 669, nxpk= 20, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1276,1277,
 &end
#
#   85 GLN  HN           84 LEU  HB-         5.50    (#    670:20  Unique         2.20, 3.78 A)
 &rst
  ixpk= 670, nxpk= 20, iat=1291,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1276,1277,
 &end
#
#   84 LEU  HN           84 LEU  HB-         4.50    (#    671:20  Unique         2.23, 2.92 A)
 &rst
  ixpk= 671, nxpk= 20, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1276,1277,
 &end
#
#   84 LEU  HN           84 LEU  HG          5.50    (#    672:20  Unique         3.14, 4.32 A)
 &rst
  ixpk= 672, nxpk= 20, iat=1272,1279, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 LEU  HA           84 LEU  HG          4.50    (#    673:20  Unique         2.23, 3.24 A)
 &rst
  ixpk= 673, nxpk= 20, iat=1274,1279, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 LEU  HB-          84 LEU  HG          3.50    (#    674:20  Unique         2.20, 2.57 A)
 &rst
  ixpk= 674, nxpk= 20, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1276,1277,
 &end
#
#   84 LEU  MDX          84 LEU  HG          3.50    (#    675:20  Unique         2.34, 2.65 A)
 &rst
  ixpk= 675, nxpk= 20, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  MDY          84 LEU  HG          3.50    (#    676:20  Unique         2.34, 2.65 A)
 &rst
  ixpk= 676, nxpk= 20, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1281,1282,1283,1285,1286,1287,
 &end
#
#   82 ILE  QG2          84 LEU  HG          4.50    (#    677:20  Unique         3.28, 5.34 A)
 &rst
  ixpk= 677, nxpk= 20, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1242,1243,1244,
 &end
#
#   85 GLN  HN           85 GLN  HA          3.50    (#    678:20  Unique         2.82, 2.95 A)
 &rst
  ixpk= 678, nxpk= 20, iat=1291,1293, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   87 PHE  HN           85 GLN  HA          4.50    (#    679:20  Unique         2.82, 3.26 A)
 &rst
  ixpk= 679, nxpk= 20, iat=1322,1293, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   86 PRO  HA           85 GLN  HA          4.50    (#    680:20  Unique         2.30, 2.53 A)
 &rst
  ixpk= 680, nxpk= 20, iat=1318,1293, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:681     85 GLN  HA          3.50    (#    681:20  Single Ambig)
 &rst
  ixpk= 681, nxpk= 20, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1298,1299,1298,1299,
 &end
#
#   85 GLN  HB+          85 GLN  HA          2.80    (#    682:20  Unique         2.19, 2.72 A)
 &rst
  ixpk= 682, nxpk= 20, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1295,1296,
 &end
#
#   85 GLN  HB-          85 GLN  HA          3.50    (#    683:20  Unique         2.19, 2.72 A)
 &rst
  ixpk= 683, nxpk= 20, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1295,1296,
 &end
#
#   96 GLN  HE2+         89 PRO  HA          4.50    (#    686:20  Unique         3.03, 4.18 A)
 &rst
  ixpk= 686, nxpk= 20, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1470,1471,
 &end
#
#   43 SER  HA           89 PRO  HA          5.50    (#    687:20  Unique         2.72, 3.41 A)
 &rst
  ixpk= 687, nxpk= 20, iat= 640,1374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:688     89 PRO  HA          4.50    (#    688:20  Single Ambig)
 &rst
  ixpk= 688, nxpk= 20, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1465,1466,1465,1466, 622, 623,
 &end
#
#   89 PRO  HB-          89 PRO  HA          3.50    (#    690:20  Unique         2.29, 2.52 A)
 &rst
  ixpk= 690, nxpk= 20, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1371,1372,
 &end
#
#   89 PRO  HB+          89 PRO  HA          3.50    (#    691:20  Unique         2.29, 2.52 A)
 &rst
  ixpk= 691, nxpk= 20, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1371,1372,
 &end
#
#   84 LEU  MDY          89 PRO  HA          5.50    (#    692:20  Unique         2.57, 5.79 A)
 &rst
  ixpk= 692, nxpk= 20, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1281,1282,1283,1285,1286,1287,
 &end
#
#   37 PRO  HD-          37 PRO  HG+         4.50    (#    693:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 693, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 546, 547,
 igr2= 549, 550,
 &end
#
#   91 ASP  HN           90 ASP  HB+         5.50    (#    696:20  Unique         2.46, 3.89 A)
 &rst
  ixpk= 696, nxpk= 20, iat=1390,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   92 SER  HN           91 ASP  HA          3.50    (#    697:20  Unique         2.12, 2.23 A)
 &rst
  ixpk= 697, nxpk= 20, iat=1402,1392, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 ASP  HN           91 ASP  HA          3.50    (#    698:20  Unique         2.87, 2.91 A)
 &rst
  ixpk= 698, nxpk= 20, iat=1390,1392, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 ASP  HB-          91 ASP  HA          3.50    (#    700:20  Unique         2.38, 2.72 A)
 &rst
  ixpk= 700, nxpk= 20, iat=  -1,1392, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1394,1395,
 &end
#
#   91 ASP  HB+          91 ASP  HA          3.50    (#    701:20  Unique         2.38, 2.72 A)
 &rst
  ixpk= 701, nxpk= 20, iat=  -1,1392, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1394,1395,
 &end
#
#   91 ASP  HN           91 ASP  HB-         4.50    (#    702:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 702, nxpk= 20, iat=1390,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1394,1395,
 &end
#
#   91 ASP  HA           91 ASP  HB-         3.50    (#    703:20  Unique         2.38, 2.72 A)
 &rst
  ixpk= 703, nxpk= 20, iat=1392,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1394,1395,
 &end
#
#   91 ASP  HA           91 ASP  HB+         4.50    (#    704:20  Unique         2.38, 2.72 A)
 &rst
  ixpk= 704, nxpk= 20, iat=1392,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1394,1395,
 &end
#
#   95 PRO  HG-          95 PRO  HB+         4.50    (#    705:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 705, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1448,1449,
 igr2=1451,1452,
 &end
#
#   95 PRO  HG-          95 PRO  HB-         5.50    (#    706:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 706, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1448,1449,
 igr2=1451,1452,
 &end
#
#   95 PRO  HG+          95 PRO  HB+         4.50    (#    707:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 707, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1448,1449,
 igr2=1451,1452,
 &end
#
#   95 PRO  HG+          95 PRO  HB-         5.50    (#    708:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 708, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1448,1449,
 igr2=1451,1452,
 &end
#
#   95 PRO  HA           95 PRO  HB-         4.50    (#    711:20  Unique         2.28, 2.52 A)
 &rst
  ixpk= 711, nxpk= 20, iat=1454,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1451,1452,
 &end
#
#   61 TRP  HZ2          95 PRO  HB+         5.50    (#    713:20  Unique         5.02, 5.66 A)
 &rst
  ixpk= 713, nxpk= 20, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1451,1452,
 &end
#
#   40 ILE  HN           95 PRO  HB+         4.50    (#    714:20  Unique         2.22, 2.79 A)
 &rst
  ixpk= 714, nxpk= 20, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1451,1452,
 &end
#
#   40 ILE  HN           95 PRO  HB-         5.50    (#    715:20  Unique         2.22, 2.79 A)
 &rst
  ixpk= 715, nxpk= 20, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1451,1452,
 &end
#
#   96 GLN  HB+          96 GLN  HA          3.50    (#    716:20  Unique         2.34, 2.79 A)
 &rst
  ixpk= 716, nxpk= 20, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1462,1463,
 &end
#
#   96 GLN  HB-          96 GLN  HA          3.50    (#    717:20  Unique         2.34, 2.79 A)
 &rst
  ixpk= 717, nxpk= 20, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1462,1463,
 &end
#
#   94 GLN  HG-          96 GLN  HA          5.50    (#    718:20  Unique         3.94, 5.06 A)
 &rst
  ixpk= 718, nxpk= 20, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1434,1435,
 &end
#
#    0 AMB  20-2:719     96 GLN  HA          4.50    (#    719:20  Single Ambig)
 &rst
  ixpk= 719, nxpk= 20, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1465,1466,1465,1466,
 &end
#
#   97 VAL  HN           96 GLN  HA          5.50    (#    720:20  Unique         3.45, 3.56 A)
 &rst
  ixpk= 720, nxpk= 20, iat=1475,1460, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   96 GLN  HN           96 GLN  HA          4.50    (#    721:20  Unique         2.94, 2.98 A)
 &rst
  ixpk= 721, nxpk= 20, iat=1458,1460, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   98 VAL  HN           97 VAL  HA          3.50    (#    722:20  Unique         2.20, 2.22 A)
 &rst
  ixpk= 722, nxpk= 20, iat=1491,1477, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 ALA  HN            8 VAL  MGY         4.50    (#    723:20  Unique         3.32, 4.70 A)
 &rst
  ixpk= 723, nxpk= 20, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    0 AMB  20-2:724     97 VAL  MGX         5.50    (#    724:20  Single Ambig)
 &rst
  ixpk= 724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 603, 620,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   11 THR  HB            8 VAL  MGY         4.50    (#    725:20  Unique         3.03, 5.07 A)
 &rst
  ixpk= 725, nxpk= 20, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#   12 ARG  HD-           8 VAL  MGY         4.50    (#    726:20  Unique         2.44, 5.84 A)
 &rst
  ixpk= 726, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 174, 175,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#   99 ILE  HN           98 VAL  HB          5.50    (#    727:20  Unique         3.96, 4.04 A)
 &rst
  ixpk= 727, nxpk= 20, iat=1507,1495, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 VAL  HN           98 VAL  HB          4.50    (#    728:20  Unique         2.72, 2.78 A)
 &rst
  ixpk= 728, nxpk= 20, iat=1491,1495, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  106 THR  HN           98 VAL  HB          5.50    (#    729:20  Unique         3.76, 4.07 A)
 &rst
  ixpk= 729, nxpk= 20, iat=1610,1495, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 LEU  HA          125 VAL  HB          5.50    (#    730:20  Unique         4.54, 4.62 A)
 &rst
  ixpk= 730, nxpk= 20, iat=1869,1890, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 VAL  HA           98 VAL  HB          4.50    (#    731:20  Unique         3.01, 3.02 A)
 &rst
  ixpk= 731, nxpk= 20, iat=1493,1495, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   98 VAL  MGY          98 VAL  HB          2.80    (#    732:20  Unique         2.45, 2.67 A)
 &rst
  ixpk= 732, nxpk= 20, iat=  -1,1495, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1497,1498,1499,1501,1502,1503,
 &end
#
#  109 SER  HA          125 VAL  MGX         4.50    (#    736:20  Unique         2.68, 4.37 A)
 &rst
  ixpk= 736, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  141 ARG  HA          125 VAL  MGX         4.50    (#    737:20  Unique         2.71, 5.52 A)
 &rst
  ixpk= 737, nxpk= 20, iat=2123,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  133 ASP  HB+         125 VAL  MGX         4.50    (#    738:20  Unique         3.25, 5.18 A)
 &rst
  ixpk= 738, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2003,2004,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  125 VAL  HB          125 VAL  MGX         3.50    (#    739:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 739, nxpk= 20, iat=1890,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  123 THR  MG2         125 VAL  MGX         2.80    (#    740:20  Unique         2.39, 5.25 A)
 &rst
  ixpk= 740, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1859,1860,1861,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#   61 TRP  HZ2          98 VAL  MGY         4.50    (#    741:20  Unique         2.67, 3.86 A)
 &rst
  ixpk= 741, nxpk= 20, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1497,1498,1499,1501,1502,1503,
 &end
#
#   98 VAL  HA           98 VAL  MGY         3.50    (#    743:20  Unique         2.40, 3.13 A)
 &rst
  ixpk= 743, nxpk= 20, iat=1493,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1497,1498,1499,1501,1502,1503,
 &end
#
#   37 PRO  HB-          98 VAL  MGY         3.50    (#    744:20  Unique         2.34, 4.36 A)
 &rst
  ixpk= 744, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 552, 553,
 igr2=1497,1498,1499,1501,1502,1503,
 &end
#
#   37 PRO  HB+          98 VAL  MGY         3.50    (#    745:20  Unique         2.34, 4.36 A)
 &rst
  ixpk= 745, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 552, 553,
 igr2=1497,1498,1499,1501,1502,1503,
 &end
#
#   98 VAL  HB           98 VAL  MGY         2.80    (#    746:20  Unique         2.45, 2.67 A)
 &rst
  ixpk= 746, nxpk= 20, iat=1495,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1497,1498,1499,1501,1502,1503,
 &end
#
#   99 ILE  HG1-         99 ILE  HB          3.50    (#    748:20  Unique         2.56, 2.82 A)
 &rst
  ixpk= 748, nxpk= 20, iat=  -1,1511, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1517,1518,
 &end
#
#   99 ILE  HA           99 ILE  HB          4.50    (#    749:20  Unique         3.04, 3.06 A)
 &rst
  ixpk= 749, nxpk= 20, iat=1509,1511, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:750     99 ILE  HB          4.50    (#    750:20  Single Ambig)
 &rst
  ixpk= 750, nxpk= 20, iat=  -1,1511, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1517,1518, 406, 407, 408,
 &end
#
#   38 VAL  HN           99 ILE  HB          4.50    (#    751:20  Unique         2.79, 2.91 A)
 &rst
  ixpk= 751, nxpk= 20, iat= 559,1511, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 ILE  HN           99 ILE  HB          4.50    (#    752:20  Unique         2.47, 2.56 A)
 &rst
  ixpk= 752, nxpk= 20, iat=1507,1511, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 ILE  HN           99 ILE  HG1+        5.50    (#    753:20  Unique         3.59, 4.00 A)
 &rst
  ixpk= 753, nxpk= 20, iat=1507,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1517,1518,
 &end
#
#   99 ILE  HA           99 ILE  HG1-        5.50    (#    754:20  Unique         2.52, 3.14 A)
 &rst
  ixpk= 754, nxpk= 20, iat=1509,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1517,1518,
 &end
#
#   99 ILE  HA           99 ILE  HG1+        4.50    (#    755:20  Unique         2.52, 3.14 A)
 &rst
  ixpk= 755, nxpk= 20, iat=1509,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1517,1518,
 &end
#
#   99 ILE  HB           99 ILE  HG1+        3.50    (#    756:20  Unique         2.56, 2.82 A)
 &rst
  ixpk= 756, nxpk= 20, iat=1511,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1517,1518,
 &end
#
#   99 ILE  HB           99 ILE  HG1-        3.50    (#    759:20  Unique         2.56, 2.82 A)
 &rst
  ixpk= 759, nxpk= 20, iat=1511,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1517,1518,
 &end
#
#   99 ILE  HB           99 ILE  QG2         3.50    (#    760:20  Unique         2.41, 2.65 A)
 &rst
  ixpk= 760, nxpk= 20, iat=1511,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1513,1514,1515,
 &end
#
#    0 AMB  20-2:761      0 AMB  20-1:761    4.50    (#    761:20  Double Ambig)
 &rst
  ixpk= 761, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1=1517,1518, 192, 193, 194, 406, 407, 408,
 igr2=1513,1514,1515,1824,1825,1826,1828,1829,1830,
 &end
#
#   31 ALA  MB           99 ILE  QG2         4.50    (#    762:20  Unique         2.87, 4.26 A)
 &rst
  ixpk= 762, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 471, 472, 473,
 igr2=1513,1514,1515,
 &end
#
#   99 ILE  HG1-         99 ILE  QG2         2.80    (#    763:20  Unique         2.20, 3.08 A)
 &rst
  ixpk= 763, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1517,1518,
 igr2=1513,1514,1515,
 &end
#
#    0 AMB  20-2:764     99 ILE  QG2         4.50    (#    764:20  Single Ambig)
 &rst
  ixpk= 764, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1601,1602,1601,1602,
 igr2=1513,1514,1515,
 &end
#
#   28 ILE  HA           99 ILE  QG2         3.50    (#    766:20  Unique         2.11, 2.88 A)
 &rst
  ixpk= 766, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1513,1514,1515,
 &end
#
#   99 ILE  HA           99 ILE  QG2         4.50    (#    767:20  Unique         2.47, 3.12 A)
 &rst
  ixpk= 767, nxpk= 20, iat=1509,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1513,1514,1515,
 &end
#
#  113 ALA  HA          121 LEU  MDX         4.50    (#    768:20  Unique         2.09, 4.68 A)
 &rst
  ixpk= 768, nxpk= 20, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  103 GLY  HN           99 ILE  QG2         5.50    (#    769:20  Unique         4.07, 4.85 A)
 &rst
  ixpk= 769, nxpk= 20, iat=1567,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1513,1514,1515,
 &end
#
#  100 LEU  HN           99 ILE  QG2         4.50    (#    770:20  Unique         2.81, 3.59 A)
 &rst
  ixpk= 770, nxpk= 20, iat=1526,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1513,1514,1515,
 &end
#
#   38 VAL  HN           99 ILE  QG2         5.50    (#    771:20  Unique         3.90, 4.81 A)
 &rst
  ixpk= 771, nxpk= 20, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1513,1514,1515,
 &end
#
#   38 VAL  MGX          99 ILE  QD1         3.50    (#    772:20  Unique         2.11, 5.95 A)
 &rst
  ixpk= 772, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 565, 566, 567, 569, 570, 571,
 igr2=1520,1521,1522,
 &end
#
#    0 AMB  20-2:773     99 ILE  QD1         3.50    (#    773:20  Single Ambig)
 &rst
  ixpk= 773, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 406, 407, 408,1517,1518,
 igr2=1520,1521,1522,
 &end
#
#   99 ILE  HB           99 ILE  QD1         3.50    (#    774:20  Unique         2.38, 3.07 A)
 &rst
  ixpk= 774, nxpk= 20, iat=1511,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1520,1521,1522,
 &end
#
#   99 ILE  HN           99 ILE  QD1         4.50    (#    776:20  Unique         2.37, 3.32 A)
 &rst
  ixpk= 776, nxpk= 20, iat=1507,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1520,1521,1522,
 &end
#
#  124 LEU  HB+         124 LEU  MDY         3.50    (#    777:20  Unique         2.33, 3.32 A)
 &rst
  ixpk= 777, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1871,1872,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#   17 ALA  HA          124 LEU  MDY         4.50    (#    778:20  Unique         2.33, 4.12 A)
 &rst
  ixpk= 778, nxpk= 20, iat= 253,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#  101 ALA  MB          101 ALA  HA          2.80    (#    779:20  Unique         2.45, 2.67 A)
 &rst
  ixpk= 779, nxpk= 20, iat=  -1,1547, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1549,1550,1551,
 &end
#
#  101 ALA  HN          101 ALA  HA          4.50    (#    780:20  Unique         2.81, 2.86 A)
 &rst
  ixpk= 780, nxpk= 20, iat=1545,1547, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  101 ALA  HA          101 ALA  MB          3.50    (#    781:20  Unique         2.45, 2.67 A)
 &rst
  ixpk= 781, nxpk= 20, iat=1547,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:783    137 ALA  MB          3.50    (#    783:20  Single Ambig)
 &rst
  ixpk= 783, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1808,1809,2075,2076,
 igr2=2065,2066,2067,
 &end
#
#    0 AMB  20-2:785      0 AMB  20-1:785    3.50    (#    785:20  Double Ambig)
 &rst
  ixpk= 785, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 479,2063,
 igr2=1549,1550,1551,2065,2066,2067,
 &end
#
#   31 ALA  HA          101 ALA  MB          4.50    (#    786:20  Unique         4.26, 5.50 A)
 &rst
  ixpk= 786, nxpk= 20, iat= 469,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1549,1550,1551,
 &end
#
#  137 ALA  HN          137 ALA  MB          4.50    (#    787:20  Unique         2.40, 3.32 A)
 &rst
  ixpk= 787, nxpk= 20, iat=2061,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2065,2066,2067,
 &end
#
#  101 ALA  HN          101 ALA  MB          3.50    (#    788:20  Unique         2.40, 2.84 A)
 &rst
  ixpk= 788, nxpk= 20, iat=1545,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1549,1550,1551,
 &end
#
#  102 ASP  HN          102 ASP  HB-         4.50    (#    789:20  Unique         2.25, 2.84 A)
 &rst
  ixpk= 789, nxpk= 20, iat=1555,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1559,1560,
 &end
#
#  102 ASP  HN          102 ASP  HB+         4.50    (#    790:20  Unique         2.25, 2.84 A)
 &rst
  ixpk= 790, nxpk= 20, iat=1555,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1559,1560,
 &end
#
#  102 ASP  HA          102 ASP  HB+         3.50    (#    791:20  Unique         2.31, 2.64 A)
 &rst
  ixpk= 791, nxpk= 20, iat=1557,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1559,1560,
 &end
#
#  102 ASP  HA          102 ASP  HB-         3.50    (#    792:20  Unique         2.31, 2.64 A)
 &rst
  ixpk= 792, nxpk= 20, iat=1557,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1559,1560,
 &end
#
#    0 AMB  20-2:799    104 GLN  HA          3.50    (#    799:20  Single Ambig)
 &rst
  ixpk= 799, nxpk= 20, iat=  -1,1576, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1578,1579,1578,1579,
 &end
#
#  100 LEU  HG            0 AMB  20-1:800    4.50    (#    800:20  Single Ambig)
 &rst
  ixpk= 800, nxpk= 20, iat=1533,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1578,1579,1578,1579,
 &end
#
#  104 GLN  HN            0 AMB  20-1:801    4.50    (#    801:20  Single Ambig)
 &rst
  ixpk= 801, nxpk= 20, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1578,1579,1578,1579,
 &end
#
#  105 ILE  HN            0 AMB  20-1:802    4.50    (#    802:20  Single Ambig)
 &rst
  ixpk= 802, nxpk= 20, iat=1591,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1578,1579,1578,1579,
 &end
#
#  104 GLN  HE2+        104 GLN  HG+         3.50    (#    803:20  Unique         2.12, 3.36 A)
 &rst
  ixpk= 803, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1586,1587,
 igr2=1581,1582,
 &end
#
#  104 GLN  HE2+        104 GLN  HG-         4.50    (#    804:20  Unique         2.12, 3.36 A)
 &rst
  ixpk= 804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1586,1587,
 igr2=1581,1582,
 &end
#
#  105 ILE  HN          104 GLN  HG+         5.50    (#    805:20  Unique         4.01, 4.61 A)
 &rst
  ixpk= 805, nxpk= 20, iat=1591,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1581,1582,
 &end
#
#  105 ILE  HN          104 GLN  HG-         4.50    (#    806:20  Unique         4.01, 4.61 A)
 &rst
  ixpk= 806, nxpk= 20, iat=1591,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1581,1582,
 &end
#
#  104 GLN  HN          104 GLN  HG-         3.50    (#    807:20  Unique         2.01, 3.12 A)
 &rst
  ixpk= 807, nxpk= 20, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1581,1582,
 &end
#
#  104 GLN  HN          104 GLN  HG+         4.50    (#    808:20  Unique         2.01, 3.12 A)
 &rst
  ixpk= 808, nxpk= 20, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1581,1582,
 &end
#
#  104 GLN  HE2-        104 GLN  HG+         4.50    (#    809:20  Unique         2.12, 3.36 A)
 &rst
  ixpk= 809, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1586,1587,
 igr2=1581,1582,
 &end
#
#  104 GLN  HA          104 GLN  HG-         3.50    (#    810:20  Unique         2.53, 2.94 A)
 &rst
  ixpk= 810, nxpk= 20, iat=1576,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1581,1582,
 &end
#
#  104 GLN  HA          104 GLN  HG+         4.50    (#    811:20  Unique         2.53, 2.94 A)
 &rst
  ixpk= 811, nxpk= 20, iat=1576,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1581,1582,
 &end
#
#  100 LEU  HG          104 GLN  HG+         4.50    (#    812:20  Unique         2.62, 4.90 A)
 &rst
  ixpk= 812, nxpk= 20, iat=1533,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1581,1582,
 &end
#
#  100 LEU  HG          104 GLN  HG-         4.50    (#    813:20  Unique         2.62, 4.90 A)
 &rst
  ixpk= 813, nxpk= 20, iat=1533,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1581,1582,
 &end
#
#  106 THR  HN          105 ILE  HA          4.50    (#    814:20  Unique         2.22, 2.31 A)
 &rst
  ixpk= 814, nxpk= 20, iat=1610,1593, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 ILE  HA          105 ILE  HA          5.50    (#    815:20  Unique         2.31, 2.49 A)
 &rst
  ixpk= 815, nxpk= 20, iat=1509,1593, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 ILE  QG2         105 ILE  HA          4.50    (#    816:20  Unique         2.31, 3.03 A)
 &rst
  ixpk= 816, nxpk= 20, iat=  -1,1593, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1597,1598,1599,
 &end
#
#  105 ILE  HN          105 ILE  HB          4.50    (#    817:20  Unique         2.77, 2.91 A)
 &rst
  ixpk= 817, nxpk= 20, iat=1591,1595, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  105 ILE  HA          105 ILE  HB          4.50    (#    818:20  Unique         3.00, 3.02 A)
 &rst
  ixpk= 818, nxpk= 20, iat=1593,1595, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  130 TRP  HA          105 ILE  HB          5.50    (#    819:20  Unique         4.05, 4.89 A)
 &rst
  ixpk= 819, nxpk= 20, iat=1944,1595, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:820    105 ILE  HB          4.50    (#    820:20  Single Ambig)
 &rst
  ixpk= 820, nxpk= 20, iat=  -1,1595, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1601,1602,1601,1602,
 &end
#
#  130 TRP  HE3         105 ILE  QD1         5.50    (#    821:20  Unique         3.19, 4.53 A)
 &rst
  ixpk= 821, nxpk= 20, iat=1961,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1604,1605,1606,
 &end
#
#  105 ILE  HN          105 ILE  QD1         5.50    (#    822:20  Unique         2.95, 4.26 A)
 &rst
  ixpk= 822, nxpk= 20, iat=1591,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1604,1605,1606,
 &end
#
#  130 TRP  HN          105 ILE  QD1         5.50    (#    823:20  Unique         2.23, 3.76 A)
 &rst
  ixpk= 823, nxpk= 20, iat=1942,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1604,1605,1606,
 &end
#
#    0 AMB  20-2:824    105 ILE  QD1         4.50    (#    824:20  Single Ambig)
 &rst
  ixpk= 824, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1933,1593,
 igr2=1604,1605,1606,
 &end
#
#    0 AMB  20-2:825    105 ILE  QD1         4.50    (#    825:20  Single Ambig)
 &rst
  ixpk= 825, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1946,1947,1946,1947,
 igr2=1604,1605,1606,
 &end
#
#    0 AMB  20-2:826    105 ILE  QD1         3.50    (#    826:20  Single Ambig)
 &rst
  ixpk= 826, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1601,1602,1601,1602,
 igr2=1604,1605,1606,
 &end
#
#   99 ILE  HG1+        105 ILE  QD1         4.50    (#    827:20  Unique         2.32, 4.08 A)
 &rst
  ixpk= 827, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1517,1518,
 igr2=1604,1605,1606,
 &end
#
#   28 ILE  QD1         105 ILE  QD1         4.50    (#    828:20  Unique         2.29, 4.03 A)
 &rst
  ixpk= 828, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 425, 426, 427,
 igr2=1604,1605,1606,
 &end
#
#  115 ALA  HN          115 ALA  MB          3.50    (#    829:20  Unique         2.40, 2.86 A)
 &rst
  ixpk= 829, nxpk= 20, iat=1748,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1752,1753,1754,
 &end
#
#   79 GLU  HA          115 ALA  MB          4.50    (#    830:20  Unique         2.18, 3.29 A)
 &rst
  ixpk= 830, nxpk= 20, iat=1193,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1752,1753,1754,
 &end
#
#  115 ALA  HA          115 ALA  MB          3.50    (#    831:20  Unique         2.42, 2.65 A)
 &rst
  ixpk= 831, nxpk= 20, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1752,1753,1754,
 &end
#
#    0 AMB  20-2:832    115 ALA  MB          4.50    (#    832:20  Single Ambig)
 &rst
  ixpk= 832, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1229,1230,1229,1230,
 igr2=1752,1753,1754,
 &end
#
#  126 CYS  HB-         105 ILE  QG2         4.50    (#    833:20  Unique         3.88, 5.28 A)
 &rst
  ixpk= 833, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1906,1907,
 igr2=1597,1598,1599,
 &end
#
#    0 AMB  20-2:835    105 ILE  QG2         2.80    (#    835:20  Single Ambig)
 &rst
  ixpk= 835, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1=1604,1605,1606,1481,1482,1483,1485,1486,1487,
 igr2=1597,1598,1599,
 &end
#
#  106 THR  HN          106 THR  HA          4.50    (#    836:20  Unique         2.77, 2.83 A)
 &rst
  ixpk= 836, nxpk= 20, iat=1610,1612, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  107 PRO  HG+         106 THR  HA          5.50    (#    837:20  Unique         4.17, 4.48 A)
 &rst
  ixpk= 837, nxpk= 20, iat=  -1,1612, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1628,1629,
 &end
#
#  106 THR  MG2         106 THR  HA          3.50    (#    838:20  Unique         2.45, 3.06 A)
 &rst
  ixpk= 838, nxpk= 20, iat=  -1,1612, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1616,1617,1618,
 &end
#
#   97 VAL  MGY         106 THR  HB          4.50    (#    839:20  Unique         3.98, 5.66 A)
 &rst
  ixpk= 839, nxpk= 20, iat=  -1,1614, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   97 VAL  MGX         106 THR  HB          4.50    (#    840:20  Unique         3.98, 5.66 A)
 &rst
  ixpk= 840, nxpk= 20, iat=  -1,1614, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#  105 ILE  QG2         106 THR  HB          5.50    (#    841:20  Unique         3.79, 5.58 A)
 &rst
  ixpk= 841, nxpk= 20, iat=  -1,1614, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1597,1598,1599,
 &end
#
#  106 THR  MG2         106 THR  HB          3.50    (#    842:20  Unique         2.39, 2.64 A)
 &rst
  ixpk= 842, nxpk= 20, iat=  -1,1614, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1616,1617,1618,
 &end
#
#  106 THR  HN          106 THR  HB          4.50    (#    843:20  Unique         2.31, 3.37 A)
 &rst
  ixpk= 843, nxpk= 20, iat=1610,1614, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   98 VAL  HN          106 THR  HB          4.50    (#    844:20  Unique         2.31, 3.43 A)
 &rst
  ixpk= 844, nxpk= 20, iat=1491,1614, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   98 VAL  HN          106 THR  MG2         4.50    (#    845:20  Unique         1.90, 3.14 A)
 &rst
  ixpk= 845, nxpk= 20, iat=1491,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1616,1617,1618,
 &end
#
#  106 THR  HN          106 THR  MG2         4.50    (#    846:20  Unique         2.36, 3.41 A)
 &rst
  ixpk= 846, nxpk= 20, iat=1610,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1616,1617,1618,
 &end
#
#   87 PHE  HZ          106 THR  MG2         4.50    (#    847:20  Unique         2.80, 4.26 A)
 &rst
  ixpk= 847, nxpk= 20, iat=1334,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1616,1617,1618,
 &end
#
#  106 THR  HA          106 THR  MG2         3.50    (#    848:20  Unique         2.45, 3.06 A)
 &rst
  ixpk= 848, nxpk= 20, iat=1612,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1616,1617,1618,
 &end
#
#  106 THR  HB          106 THR  MG2         3.50    (#    849:20  Unique         2.39, 2.64 A)
 &rst
  ixpk= 849, nxpk= 20, iat=1614,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1616,1617,1618,
 &end
#
#   97 VAL  MGY         106 THR  MG2         4.50    (#    851:20  Unique         2.39, 6.52 A)
 &rst
  ixpk= 851, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1481,1482,1483,1485,1486,1487,
 igr2=1616,1617,1618,
 &end
#
#  108 PHE  HN          107 PRO  HA          3.50    (#    852:20  Unique         2.14, 2.19 A)
 &rst
  ixpk= 852, nxpk= 20, iat=1638,1634, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  128 GLY  HN          107 PRO  HA          5.50    (#    853:20  Unique         2.75, 3.53 A)
 &rst
  ixpk= 853, nxpk= 20, iat=1924,1634, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  108 PHE  HD          107 PRO  HA          5.50    (#    854:20  Unique         3.29, 5.31 A)
 &rst
  ixpk= 854, nxpk= 20, iat=  -1,1634, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1646,1654,
 &end
#
#  126 CYS  HB-         107 PRO  HA          3.50    (#    855:20  Unique         2.18, 3.23 A)
 &rst
  ixpk= 855, nxpk= 20, iat=  -1,1634, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1906,1907,
 &end
#
#  107 PRO  HB+         107 PRO  HA          3.50    (#    856:20  Unique         2.27, 2.63 A)
 &rst
  ixpk= 856, nxpk= 20, iat=  -1,1634, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1631,1632,
 &end
#
#  107 PRO  HG-         107 PRO  HA          4.50    (#    857:20  Unique         2.75, 3.56 A)
 &rst
  ixpk= 857, nxpk= 20, iat=  -1,1634, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1628,1629,
 &end
#
#  107 PRO  HA          107 PRO  HB+         3.50    (#    860:20  Unique         2.27, 2.63 A)
 &rst
  ixpk= 860, nxpk= 20, iat=1634,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1631,1632,
 &end
#
#  107 PRO  HA          107 PRO  HB-         3.50    (#    861:20  Unique         2.27, 2.63 A)
 &rst
  ixpk= 861, nxpk= 20, iat=1634,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1631,1632,
 &end
#
#  127 SER  HA          107 PRO  HB+         4.50    (#    862:20  Unique         2.55, 4.60 A)
 &rst
  ixpk= 862, nxpk= 20, iat=1915,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1631,1632,
 &end
#
#  108 PHE  HN          107 PRO  HB-         5.50    (#    864:20  Unique         3.30, 3.85 A)
 &rst
  ixpk= 864, nxpk= 20, iat=1638,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1631,1632,
 &end
#
#  108 PHE  HN          107 PRO  HB+         5.50    (#    865:20  Unique         3.30, 3.85 A)
 &rst
  ixpk= 865, nxpk= 20, iat=1638,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1631,1632,
 &end
#
#  109 SER  HN          108 PHE  HA          3.50    (#    866:20  Unique         2.29, 2.39 A)
 &rst
  ixpk= 866, nxpk= 20, iat=1658,1640, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  108 PHE  HN          108 PHE  HA          4.50    (#    867:20  Unique         2.86, 2.90 A)
 &rst
  ixpk= 867, nxpk= 20, iat=1638,1640, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  108 PHE  HD          108 PHE  HA          4.50    (#    868:20  Unique         4.12, 4.23 A)
 &rst
  ixpk= 868, nxpk= 20, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1646,1654,
 &end
#
#  108 PHE  HB-         108 PHE  HA          3.50    (#    870:20  Unique         2.31, 2.45 A)
 &rst
  ixpk= 870, nxpk= 20, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1642,1643,
 &end
#
#   86 PRO  HD-         108 PHE  HA          5.50    (#    871:20  Unique         2.00, 2.67 A)
 &rst
  ixpk= 871, nxpk= 20, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1309,1310,
 &end
#
#  108 PHE  HB+         108 PHE  HA          4.50    (#    872:20  Unique         2.31, 2.45 A)
 &rst
  ixpk= 872, nxpk= 20, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1642,1643,
 &end
#
#  109 SER  HN          108 PHE  HB-         5.50    (#    873:20  Unique         2.35, 3.12 A)
 &rst
  ixpk= 873, nxpk= 20, iat=1658,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1642,1643,
 &end
#
#  109 SER  HN          108 PHE  HB+         4.50    (#    874:20  Unique         2.35, 3.12 A)
 &rst
  ixpk= 874, nxpk= 20, iat=1658,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1642,1643,
 &end
#
#  108 PHE  HD          108 PHE  HB-         4.50    (#    875:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 875, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1646,1654,
 igr2=1642,1643,
 &end
#
#  108 PHE  HD          108 PHE  HB+         4.50    (#    876:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1646,1654,
 igr2=1642,1643,
 &end
#
#  108 PHE  HA          108 PHE  HB-         4.50    (#    877:20  Unique         2.31, 2.45 A)
 &rst
  ixpk= 877, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1642,1643,
 &end
#
#  108 PHE  HA          108 PHE  HB+         4.50    (#    878:20  Unique         2.31, 2.45 A)
 &rst
  ixpk= 878, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1642,1643,
 &end
#
#  110 LEU  HN          109 SER  HA          3.50    (#    879:20  Unique         2.06, 2.13 A)
 &rst
  ixpk= 879, nxpk= 20, iat=1669,1660, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  109 SER  HN          109 SER  HA          3.50    (#    880:20  Unique         2.95, 2.97 A)
 &rst
  ixpk= 880, nxpk= 20, iat=1658,1660, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:881    109 SER  HA          3.50    (#    881:20  Single Ambig)
 &rst
  ixpk= 881, nxpk= 20, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1662,1663,1662,1663,
 &end
#
#  125 VAL  MGY         109 SER  HA          4.50    (#    882:20  Unique         2.68, 4.37 A)
 &rst
  ixpk= 882, nxpk= 20, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#  110 LEU  HN            0 AMB  20-1:883    4.50    (#    883:20  Single Ambig)
 &rst
  ixpk= 883, nxpk= 20, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1662,1663,1662,1663,
 &end
#
#  109 SER  HN            0 AMB  20-1:884    4.50    (#    884:20  Single Ambig)
 &rst
  ixpk= 884, nxpk= 20, iat=1658,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1662,1663,1662,1663,
 &end
#
#  109 SER  HA            0 AMB  20-1:885    3.50    (#    885:20  Single Ambig)
 &rst
  ixpk= 885, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1662,1663,1662,1663,
 &end
#
#  108 PHE  HA            0 AMB  20-1:886    5.50    (#    886:20  Single Ambig)
 &rst
  ixpk= 886, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1662,1663,1662,1663,
 &end
#
#  125 VAL  HA            0 AMB  20-1:887    4.50    (#    887:20  Single Ambig)
 &rst
  ixpk= 887, nxpk= 20, iat=1888,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1662,1663,1662,1663,
 &end
#
#    0 AMB  20-2:888      0 AMB  20-1:888    6.50    (#    888:20  Double Ambig)
 &rst
  ixpk= 888, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.81, r4=12.31,
 igr1=1298,1299,1298,1299,1298,1299,
 igr2=1662,1663,1662,1663,1662,1663,
 &end
#
#    0 AMB  20-2:889      0 AMB  20-1:889    6.50    (#    889:20  Double Ambig)
 &rst
  ixpk= 889, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.32, r4=10.82,
 igr1=1295,1296,1295,1296,
 igr2=1662,1663,1662,1663,
 &end
#
#  123 THR  MG2           0 AMB  20-1:890    4.50    (#    890:20  Single Ambig)
 &rst
  ixpk= 890, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1859,1860,1861,
 igr2=1662,1663,1662,1663,
 &end
#
#  125 VAL  MGY           0 AMB  20-1:891    3.50    (#    891:20  Single Ambig)
 &rst
  ixpk= 891, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1892,1893,1894,1896,1897,1898,
 igr2=1662,1663,1662,1663,
 &end
#
#   84 LEU  MDX         110 LEU  HB-         5.50    (#    892:20  Unique         2.32, 5.18 A)
 &rst
  ixpk= 892, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1673,1674,
 &end
#
#   84 LEU  MDX         110 LEU  HB+         5.50    (#    893:20  Unique         2.32, 5.18 A)
 &rst
  ixpk= 893, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1673,1674,
 &end
#
#    0 AMB  20-2:894      0 AMB  20-1:894    4.50    (#    894:20  Double Ambig)
 &rst
  ixpk= 894, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 igr2=1673,1674,1673,1674,
 &end
#
#    0 AMB  20-2:895    110 LEU  HB-         4.50    (#    895:20  Single Ambig)
 &rst
  ixpk= 895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 igr2=1673,1674,
 &end
#
#  110 LEU  HN          110 LEU  HB-         4.50    (#    898:20  Unique         2.09, 2.84 A)
 &rst
  ixpk= 898, nxpk= 20, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1673,1674,
 &end
#
#  110 LEU  HN          110 LEU  HB+         5.50    (#    899:20  Unique         2.09, 2.84 A)
 &rst
  ixpk= 899, nxpk= 20, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1673,1674,
 &end
#
#   82 ILE  QG2         110 LEU  MDX         3.50    (#    903:20  Unique         2.38, 4.75 A)
 &rst
  ixpk= 903, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1242,1243,1244,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  132 LEU  MDX         110 LEU  MDX         5.50    (#    904:20  Unique         3.08, 7.29 A)
 &rst
  ixpk= 904, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1989,1990,1991,1993,1994,1995,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  110 LEU  HG          110 LEU  MDX         3.50    (#    905:20  Unique         2.44, 2.67 A)
 &rst
  ixpk= 905, nxpk= 20, iat=1676,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:906    110 LEU  MDX         3.50    (#    906:20  Single Ambig)
 &rst
  ixpk= 906, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1673,1674,1871,1872,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  110 LEU  HB-         110 LEU  MDX         3.50    (#    907:20  Unique         2.36, 3.32 A)
 &rst
  ixpk= 907, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1673,1674,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  112 MET  ME          110 LEU  MDX         4.50    (#    908:20  Unique         2.69, 5.55 A)
 &rst
  ixpk= 908, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1718,1719,1720,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:910    110 LEU  MDX         4.50    (#    910:20  Single Ambig)
 &rst
  ixpk= 910, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1690,1709,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:911    110 LEU  MDX         4.50    (#    911:20  Single Ambig)
 &rst
  ixpk= 911, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 628, 632,1650,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  111 LEU  HN          110 LEU  MDX         4.50    (#    912:20  Unique         2.17, 4.92 A)
 &rst
  ixpk= 912, nxpk= 20, iat=1688,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  108 PHE  HE          110 LEU  MDY         4.50    (#    916:20  Unique         2.51, 6.15 A)
 &rst
  ixpk= 916, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1648,1652,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:917    110 LEU  MDY         4.50    (#    917:20  Single Ambig)
 &rst
  ixpk= 917, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 628, 632,1650,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  112 MET  ME          110 LEU  MDY         4.50    (#    920:20  Unique         2.69, 5.55 A)
 &rst
  ixpk= 920, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1718,1719,1720,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  110 LEU  HB-         110 LEU  MDY         3.50    (#    921:20  Unique         2.36, 3.32 A)
 &rst
  ixpk= 921, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1673,1674,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:922    110 LEU  MDY         3.50    (#    922:20  Single Ambig)
 &rst
  ixpk= 922, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1673,1674,1871,1872,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  110 LEU  HG          110 LEU  MDY         3.50    (#    923:20  Unique         2.44, 2.67 A)
 &rst
  ixpk= 923, nxpk= 20, iat=1676,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  124 LEU  MDX         110 LEU  MDY         4.50    (#    924:20  Unique         2.30, 5.69 A)
 &rst
  ixpk= 924, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1876,1877,1878,1880,1881,1882,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#   82 ILE  QG2         110 LEU  MDY         3.50    (#    925:20  Unique         2.38, 4.75 A)
 &rst
  ixpk= 925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1242,1243,1244,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  112 MET  HN            0 AMB  20-1:926    4.50    (#    926:20  Single Ambig)
 &rst
  ixpk= 926, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1690,1709,
 &end
#
#  123 THR  HA          111 LEU  HA          4.50    (#    927:20  Unique         2.06, 2.21 A)
 &rst
  ixpk= 927, nxpk= 20, iat=1855,1690, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  111 LEU  HB-         111 LEU  HA          6.50    (#    928:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 928, nxpk= 20, iat=  -1,1690, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1692,1693,
 &end
#
#  111 LEU  HB+         111 LEU  HA          4.50    (#    929:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 929, nxpk= 20, iat=  -1,1690, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1692,1693,
 &end
#
#    0 AMB  20-2:930      0 AMB  20-1:930    4.50    (#    930:20  Double Ambig)
 &rst
  ixpk= 930, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1697,1698,1699,1701,1702,1703,1215,1216,1217,1219,
      1220,1221,
 igr2=1690,1709,
 &end
#
#  123 THR  MG2         111 LEU  HA          5.50    (#    931:20  Unique         2.50, 3.90 A)
 &rst
  ixpk= 931, nxpk= 20, iat=  -1,1690, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1859,1860,1861,
 &end
#
#  111 LEU  HN          111 LEU  HB+         4.50    (#    932:20  Unique         2.28, 2.69 A)
 &rst
  ixpk= 932, nxpk= 20, iat=1688,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1692,1693,
 &end
#
#  111 LEU  HN          111 LEU  HB-         4.50    (#    933:20  Unique         2.28, 2.69 A)
 &rst
  ixpk= 933, nxpk= 20, iat=1688,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1692,1693,
 &end
#
#  111 LEU  HA          111 LEU  HB-         4.50    (#    934:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 934, nxpk= 20, iat=1690,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1692,1693,
 &end
#
#  111 LEU  HA          111 LEU  HB+         4.50    (#    935:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 935, nxpk= 20, iat=1690,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1692,1693,
 &end
#
#  111 LEU  MDY         111 LEU  HB+         3.50    (#    936:20  Unique         2.26, 3.28 A)
 &rst
  ixpk= 936, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=1692,1693,
 &end
#
#  111 LEU  MDX         111 LEU  HB+         3.50    (#    937:20  Unique         2.26, 3.28 A)
 &rst
  ixpk= 937, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=1692,1693,
 &end
#
#  111 LEU  MDY         111 LEU  HB-         4.50    (#    938:20  Unique         2.26, 3.28 A)
 &rst
  ixpk= 938, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=1692,1693,
 &end
#
#  112 MET  HN          111 LEU  HG          5.50    (#    940:20  Unique         2.12, 2.57 A)
 &rst
  ixpk= 940, nxpk= 20, iat=1707,1695, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 LEU  HN          111 LEU  HG          4.50    (#    941:20  Unique         4.26, 4.50 A)
 &rst
  ixpk= 941, nxpk= 20, iat=1688,1695, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  111 LEU  HA          111 LEU  HG          4.50    (#    942:20  Unique         2.32, 2.42 A)
 &rst
  ixpk= 942, nxpk= 20, iat=1690,1695, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:943    111 LEU  HG          3.50    (#    943:20  Single Ambig)
 &rst
  ixpk= 943, nxpk= 20, iat=  -1,1695, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1692,1693,1808,1809,
 &end
#
#  111 LEU  HB+         111 LEU  HG          2.80    (#    944:20  Unique         2.37, 2.83 A)
 &rst
  ixpk= 944, nxpk= 20, iat=  -1,1695, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1692,1693,
 &end
#
#  111 LEU  MDX         111 LEU  HG          3.50    (#    945:20  Unique         2.32, 2.65 A)
 &rst
  ixpk= 945, nxpk= 20, iat=  -1,1695, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1697,1698,1699,1701,1702,1703,
 &end
#
#  111 LEU  MDY         111 LEU  HG          3.50    (#    946:20  Unique         2.32, 2.65 A)
 &rst
  ixpk= 946, nxpk= 20, iat=  -1,1695, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1697,1698,1699,1701,1702,1703,
 &end
#
#  112 MET  HN          111 LEU  MDX         4.50    (#    947:20  Unique         1.84, 4.28 A)
 &rst
  ixpk= 947, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  121 LEU  HN          111 LEU  MDX         4.50    (#    948:20  Unique         3.70, 5.73 A)
 &rst
  ixpk= 948, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  122 LEU  HN          111 LEU  MDX         4.50    (#    949:20  Unique         3.84, 6.02 A)
 &rst
  ixpk= 949, nxpk= 20, iat=1834,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  123 THR  HA          111 LEU  MDX         4.50    (#    950:20  Unique         3.72, 5.38 A)
 &rst
  ixpk= 950, nxpk= 20, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#    0 AMB  20-2:951    111 LEU  MDX         3.50    (#    951:20  Single Ambig)
 &rst
  ixpk= 951, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1690,1709,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#    0 AMB  20-2:952    111 LEU  MDX         4.50    (#    952:20  Single Ambig)
 &rst
  ixpk= 952, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1811,2063,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  120 PRO  HB-         111 LEU  MDX         3.50    (#    953:20  Unique         2.17, 4.25 A)
 &rst
  ixpk= 953, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1808,1809,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#    0 AMB  20-2:954    111 LEU  MDX         3.50    (#    954:20  Single Ambig)
 &rst
  ixpk= 954, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1808,1809,1692,1693,2075,2076,2075,2076,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  120 PRO  HG+         111 LEU  MDX         3.50    (#    955:20  Unique         2.31, 4.62 A)
 &rst
  ixpk= 955, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1805,1806,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  111 LEU  HB+         111 LEU  MDX         3.50    (#    956:20  Unique         2.26, 3.28 A)
 &rst
  ixpk= 956, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1692,1693,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  111 LEU  HG          111 LEU  MDX         3.50    (#    957:20  Unique         2.32, 2.65 A)
 &rst
  ixpk= 957, nxpk= 20, iat=1695,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#    0 AMB  20-2:960    111 LEU  MDY         4.50    (#    960:20  Single Ambig)
 &rst
  ixpk= 960, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1690,1709,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#    0 AMB  20-2:961    111 LEU  MDY         5.50    (#    961:20  Single Ambig)
 &rst
  ixpk= 961, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1811,2063,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#   83 HIS  HB+         111 LEU  MDY         4.50    (#    962:20  Unique         2.54, 5.15 A)
 &rst
  ixpk= 962, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1259,1260,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#   83 HIS  HB-         111 LEU  MDY         4.50    (#    963:20  Unique         2.54, 5.15 A)
 &rst
  ixpk= 963, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1259,1260,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  120 PRO  HG+         111 LEU  MDY         4.50    (#    965:20  Unique         2.31, 4.62 A)
 &rst
  ixpk= 965, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1805,1806,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#    0 AMB  20-2:966    111 LEU  MDY         3.50    (#    966:20  Single Ambig)
 &rst
  ixpk= 966, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1808,1809,1692,1693,2075,2076,2075,2076,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  111 LEU  HB+         111 LEU  MDY         4.50    (#    967:20  Unique         2.26, 3.28 A)
 &rst
  ixpk= 967, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1692,1693,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  111 LEU  HG          111 LEU  MDY         3.50    (#    968:20  Unique         2.32, 2.65 A)
 &rst
  ixpk= 968, nxpk= 20, iat=1695,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  113 ALA  MB          111 LEU  MDY         4.50    (#    969:20  Unique         2.90, 5.91 A)
 &rst
  ixpk= 969, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1728,1729,1730,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  112 MET  HA            0 AMB  20-1:970    4.50    (#    970:20  Single Ambig)
 &rst
  ixpk= 970, nxpk= 20, iat=1709,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1711,1712,1711,1712,
 &end
#
#    0 AMB  20-2:973      0 AMB  20-1:973    4.50    (#    973:20  Double Ambig)
 &rst
  ixpk= 973, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1=1215,1216,1217,1219,1220,1221,1824,1825,1826,1828,
      1829,1830,
 igr2=1711,1712,1711,1712,1711,1712,
 &end
#
#  121 LEU  HN          113 ALA  HA          5.50    (#    974:20  Unique         2.06, 2.64 A)
 &rst
  ixpk= 974, nxpk= 20, iat=1815,1726, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  114 ASN  HN          113 ALA  HA          4.50    (#    975:20  Unique         2.23, 2.26 A)
 &rst
  ixpk= 975, nxpk= 20, iat=1734,1726, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  120 PRO  HA          113 ALA  HA          6.50    (#    976:20  Unique         2.02, 2.24 A)
 &rst
  ixpk= 976, nxpk= 20, iat=1811,1726, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  122 LEU  HB-         113 ALA  HA          6.50    (#    977:20  Unique         5.92, 6.78 A)
 &rst
  ixpk= 977, nxpk= 20, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1838,1839,
 &end
#
#  113 ALA  MB          113 ALA  HA          4.50    (#    978:20  Unique         2.43, 2.65 A)
 &rst
  ixpk= 978, nxpk= 20, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1728,1729,1730,
 &end
#
#  113 ALA  HN          113 ALA  MB          4.50    (#    979:20  Unique         2.46, 3.10 A)
 &rst
  ixpk= 979, nxpk= 20, iat=1724,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1728,1729,1730,
 &end
#
#  119 GLU  HN          113 ALA  MB          5.50    (#    980:20  Unique         3.04, 4.83 A)
 &rst
  ixpk= 980, nxpk= 20, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1728,1729,1730,
 &end
#
#   83 HIS  HD2         113 ALA  MB          4.50    (#    981:20  Unique         2.86, 3.94 A)
 &rst
  ixpk= 981, nxpk= 20, iat=1268,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1728,1729,1730,
 &end
#
#   80 LEU  HA            0 AMB  20-1:982    5.50    (#    982:20  Single Ambig)
 &rst
  ixpk= 982, nxpk= 20, iat=1208,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr2=1728,1729,1730, 116, 117, 118, 120, 121, 122,
 &end
#
#   11 THR  HB            8 VAL  MGX         4.50    (#    983:20  Unique         3.03, 5.07 A)
 &rst
  ixpk= 983, nxpk= 20, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#  120 PRO  HA          113 ALA  MB          3.50    (#    984:20  Unique         2.54, 3.63 A)
 &rst
  ixpk= 984, nxpk= 20, iat=1811,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1728,1729,1730,
 &end
#
#  118 GLY  HA+         113 ALA  MB          4.50    (#    985:20  Unique         4.25,10.67 A)
 &rst
  ixpk= 985, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1781,1782,
 igr2=1728,1729,1730,
 &end
#
#  115 ALA  HN          114 ASN  HA          3.50    (#    986:20  Unique         2.16, 2.21 A)
 &rst
  ixpk= 986, nxpk= 20, iat=1748,1736, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:987    114 ASN  HA          5.50    (#    987:20  Single Ambig)
 &rst
  ixpk= 987, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1758,1779,
 &end
#
#   80 LEU  HA          114 ASN  HA          5.50    (#    988:20  Unique         2.98, 3.21 A)
 &rst
  ixpk= 988, nxpk= 20, iat=1208,1736, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  114 ASN  HB-         114 ASN  HA          4.50    (#    989:20  Unique         2.31, 2.71 A)
 &rst
  ixpk= 989, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1738,1739,
 &end
#
#  114 ASN  HB+         114 ASN  HA          4.50    (#    990:20  Unique         2.31, 2.71 A)
 &rst
  ixpk= 990, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1738,1739,
 &end
#
#    9 ALA  MB          114 ASN  HA          4.50    (#    991:20  Unique         2.20, 2.97 A)
 &rst
  ixpk= 991, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 130, 131, 132,
 &end
#
#   80 LEU  HB+         114 ASN  HA          5.50    (#    992:20  Unique         4.56, 5.69 A)
 &rst
  ixpk= 992, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1210,1211,
 &end
#
#    0 AMB  20-2:993    114 ASN  HA          4.50    (#    993:20  Single Ambig)
 &rst
  ixpk= 993, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1215,1216,1217,1219,1220,1221,1824,1825,1826,1828,
      1829,1830,
 &end
#
#  121 LEU  HG          114 ASN  HA          4.50    (#    994:20  Unique         3.87, 4.39 A)
 &rst
  ixpk= 994, nxpk= 20, iat=1822,1736, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  114 ASN  HN          114 ASN  HB-         4.50    (#    995:20  Unique         2.14, 2.46 A)
 &rst
  ixpk= 995, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1738,1739,
 &end
#
#  114 ASN  HN          114 ASN  HB+         4.50    (#    996:20  Unique         2.14, 2.46 A)
 &rst
  ixpk= 996, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1738,1739,
 &end
#
#  114 ASN  HD2-        114 ASN  HB+         4.50    (#    997:20  Unique         2.21, 3.14 A)
 &rst
  ixpk= 997, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1743,1744,
 igr2=1738,1739,
 &end
#
#  114 ASN  HD2-        114 ASN  HB-         5.50    (#    998:20  Unique         2.21, 3.14 A)
 &rst
  ixpk= 998, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1743,1744,
 igr2=1738,1739,
 &end
#
#  119 GLU  HN          114 ASN  HB-         5.50    (#    999:20  Unique         2.74, 3.83 A)
 &rst
  ixpk= 999, nxpk= 20, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1738,1739,
 &end
#
#  114 ASN  HD2+        114 ASN  HB+         5.50    (#   1000:20  Unique         2.21, 3.14 A)
 &rst
  ixpk= 1000, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1743,1744,
 igr2=1738,1739,
 &end
#
#  114 ASN  HA          114 ASN  HB+         4.50    (#   1001:20  Unique         2.31, 2.71 A)
 &rst
  ixpk= 1001, nxpk= 20, iat=1736,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1738,1739,
 &end
#
#    0 AMB  20-2:1002   114 ASN  HB-         4.50    (#   1002:20  Single Ambig)
 &rst
  ixpk= 1002, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1736,1769,
 igr2=1738,1739,
 &end
#
#  119 GLU  HB-         114 ASN  HB-         4.50    (#   1003:20  Unique         2.92, 4.74 A)
 &rst
  ixpk= 1003, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1790,1791,
 igr2=1738,1739,
 &end
#
#    0 AMB  20-2:1004     0 AMB  20-1:1004   5.50    (#   1004:20  Double Ambig)
 &rst
  ixpk= 1004, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1824,1825,1826,1828,1829,1830,1824,1825,1826,1828,
      1829,1830,
 igr2=1738,1739,1738,1739,
 &end
#
#  121 LEU  MDY         114 ASN  HB-         5.50    (#   1005:20  Unique         2.07, 4.24 A)
 &rst
  ixpk= 1005, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1824,1825,1826,1828,1829,1830,
 igr2=1738,1739,
 &end
#
#  121 LEU  HG          114 ASN  HB+         5.50    (#   1006:20  Unique         2.80, 4.24 A)
 &rst
  ixpk= 1006, nxpk= 20, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1738,1739,
 &end
#
#  116 GLY  HN          115 ALA  MB          4.50    (#   1007:20  Unique         3.06, 3.88 A)
 &rst
  ixpk= 1007, nxpk= 20, iat=1758,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1752,1753,1754,
 &end
#
#  108 PHE  HD          105 ILE  QG2         4.50    (#   1008:20  Unique         3.24, 6.17 A)
 &rst
  ixpk= 1008, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1646,1654,
 igr2=1597,1598,1599,
 &end
#
#   80 LEU  HA          115 ALA  MB          4.50    (#   1009:20  Unique         2.87, 4.15 A)
 &rst
  ixpk= 1009, nxpk= 20, iat=1208,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1752,1753,1754,
 &end
#
#  114 ASN  HA          115 ALA  MB          4.50    (#   1010:20  Unique         4.42, 4.97 A)
 &rst
  ixpk= 1010, nxpk= 20, iat=1736,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1752,1753,1754,
 &end
#
#    0 AMB  20-2:1011     0 AMB  20-1:1011   4.50    (#   1011:20  Double Ambig)
 &rst
  ixpk= 1011, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.75, r4= 9.25,
 igr1=1513,1514,1515,1215,1216,1217,1219,1220,1221,
 igr2=1597,1598,1599,1752,1753,1754,
 &end
#
#  116 GLY  HN          116 GLY  HA-         4.50    (#   1012:20  Unique         2.28, 7.32 A)
 &rst
  ixpk= 1012, nxpk= 20, iat=1758,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1760,1761,
 &end
#
#  116 GLY  HN          116 GLY  HA+         4.50    (#   1013:20  Unique         2.28, 7.32 A)
 &rst
  ixpk= 1013, nxpk= 20, iat=1758,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1760,1761,
 &end
#
#  117 THR  HN          116 GLY  HA-         5.50    (#   1014:20  Unique         2.61, 6.62 A)
 &rst
  ixpk= 1014, nxpk= 20, iat=1765,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1760,1761,
 &end
#
#  117 THR  HN          116 GLY  HA+         5.50    (#   1015:20  Unique         2.61, 6.62 A)
 &rst
  ixpk= 1015, nxpk= 20, iat=1765,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1760,1761,
 &end
#
#  135 THR  HN          135 THR  HA          4.50    (#   1016:20  Unique         2.94, 2.98 A)
 &rst
  ixpk= 1016, nxpk= 20, iat=2028,2030, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  117 THR  HN          117 THR  HA          5.50    (#   1017:20  Unique         2.90, 2.94 A)
 &rst
  ixpk= 1017, nxpk= 20, iat=1765,1767, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  135 THR  HB          135 THR  HA          5.50    (#   1018:20  Unique         2.45, 2.52 A)
 &rst
  ixpk= 1018, nxpk= 20, iat=2032,2030, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1019   117 THR  MG2         4.50    (#   1019:20  Single Ambig)
 &rst
  ixpk= 1019, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1758,1779,
 igr2=1771,1772,1773,
 &end
#
#  114 ASN  HD2-        117 THR  MG2         5.50    (#   1020:20  Unique         2.46, 4.37 A)
 &rst
  ixpk= 1020, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1743,1744,
 igr2=1771,1772,1773,
 &end
#
#  119 GLU  HN          117 THR  MG2         5.50    (#   1021:20  Unique         3.91, 4.86 A)
 &rst
  ixpk= 1021, nxpk= 20, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1771,1772,1773,
 &end
#
#  117 THR  HN          117 THR  MG2         6.50    (#   1022:20  Unique         2.33, 3.58 A)
 &rst
  ixpk= 1022, nxpk= 20, iat=1765,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1771,1772,1773,
 &end
#
#  114 ASN  HD2+        117 THR  MG2         5.50    (#   1023:20  Unique         2.46, 4.37 A)
 &rst
  ixpk= 1023, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1743,1744,
 igr2=1771,1772,1773,
 &end
#
#  117 THR  HA          117 THR  MG2         3.50    (#   1024:20  Unique         2.38, 3.09 A)
 &rst
  ixpk= 1024, nxpk= 20, iat=1767,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1771,1772,1773,
 &end
#
#  117 THR  HB          117 THR  MG2         3.50    (#   1025:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 1025, nxpk= 20, iat=1769,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1771,1772,1773,
 &end
#
#  118 GLY  HN          118 GLY  HA-         4.50    (#   1026:20  Unique         2.91, 6.95 A)
 &rst
  ixpk= 1026, nxpk= 20, iat=1779,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1781,1782,
 &end
#
#  118 GLY  HN          118 GLY  HA+         4.50    (#   1027:20  Unique         2.91, 6.95 A)
 &rst
  ixpk= 1027, nxpk= 20, iat=1779,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1781,1782,
 &end
#
#  113 ALA  MB          118 GLY  HA-         4.50    (#   1028:20  Unique         4.25,10.67 A)
 &rst
  ixpk= 1028, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1728,1729,1730,
 igr2=1781,1782,
 &end
#
#  119 GLU  HB+         119 GLU  HA          3.50    (#   1029:20  Unique         2.28, 2.75 A)
 &rst
  ixpk= 1029, nxpk= 20, iat=  -1,1788, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1790,1791,
 &end
#
#  120 PRO  HG-         119 GLU  HA          4.50    (#   1030:20  Unique         4.21, 4.48 A)
 &rst
  ixpk= 1030, nxpk= 20, iat=  -1,1788, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1805,1806,
 &end
#
#    0 AMB  20-2:1031   119 GLU  HA          3.50    (#   1031:20  Single Ambig)
 &rst
  ixpk= 1031, nxpk= 20, iat=  -1,1788, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1793,1794,1793,1794,
 &end
#
#  118 GLY  HA+         119 GLU  HA          4.50    (#   1032:20  Unique         4.46, 8.53 A)
 &rst
  ixpk= 1032, nxpk= 20, iat=  -1,1788, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1781,1782,
 &end
#
#    0 AMB  20-2:1033   119 GLU  HA          3.50    (#   1033:20  Single Ambig)
 &rst
  ixpk= 1033, nxpk= 20, iat=  -1,1788, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1802,1803,1802,1803,
 &end
#
#  119 GLU  HN          119 GLU  HA          4.50    (#   1034:20  Unique         2.90, 2.94 A)
 &rst
  ixpk= 1034, nxpk= 20, iat=1786,1788, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  133 ASP  HN          132 LEU  HA          3.50    (#   1035:20  Unique         2.13, 2.29 A)
 &rst
  ixpk= 1035, nxpk= 20, iat=1999,1982, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1036     5 ARG  HB-         4.50    (#   1036:20  Single Ambig)
 &rst
  ixpk= 1036, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  69,  70,  69,  70,
 igr2=  63,  64,
 &end
#
#  118 GLY  HA+         119 GLU  HB-         6.50    (#   1037:20  Unique         4.65, 8.68 A)
 &rst
  ixpk= 1037, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1781,1782,
 igr2=1790,1791,
 &end
#
#  118 GLY  HA+         119 GLU  HB+         5.50    (#   1038:20  Unique         4.65, 8.68 A)
 &rst
  ixpk= 1038, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1781,1782,
 igr2=1790,1791,
 &end
#
#  119 GLU  HN            0 AMB  20-1:1039   3.50    (#   1039:20  Single Ambig)
 &rst
  ixpk= 1039, nxpk= 20, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1793,1794,1793,1794,
 &end
#
#  119 GLU  HA            0 AMB  20-1:1040   3.50    (#   1040:20  Single Ambig)
 &rst
  ixpk= 1040, nxpk= 20, iat=1788,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1793,1794,1793,1794,
 &end
#
#    0 AMB  20-2:1041     0 AMB  20-1:1041   4.50    (#   1041:20  Double Ambig)
 &rst
  ixpk= 1041, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1802,1803,1802,1803,1802,1803,
 igr2=1793,1794,1793,1794,1793,1794,
 &end
#
#  121 LEU  MDY           0 AMB  20-1:1043   4.50    (#   1043:20  Single Ambig)
 &rst
  ixpk= 1043, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1824,1825,1826,1828,1829,1830,
 igr2=1793,1794,1793,1794,
 &end
#
#  121 LEU  HN          120 PRO  HA          3.50    (#   1044:20  Unique         2.09, 2.17 A)
 &rst
  ixpk= 1044, nxpk= 20, iat=1815,1811, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  122 LEU  HN          120 PRO  HA          6.50    (#   1045:20  Unique         3.47, 3.96 A)
 &rst
  ixpk= 1045, nxpk= 20, iat=1834,1811, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  113 ALA  HA          120 PRO  HA          5.50    (#   1046:20  Unique         2.02, 2.24 A)
 &rst
  ixpk= 1046, nxpk= 20, iat=1726,1811, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 LEU  HA          120 PRO  HA          5.50    (#   1047:20  Unique         4.44, 4.50 A)
 &rst
  ixpk= 1047, nxpk= 20, iat=1817,1811, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  120 PRO  HB-         120 PRO  HA          3.50    (#   1049:20  Unique         2.28, 2.64 A)
 &rst
  ixpk= 1049, nxpk= 20, iat=  -1,1811, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1808,1809,
 &end
#
#  120 PRO  HG+         120 PRO  HA          4.50    (#   1050:20  Unique         2.75, 3.53 A)
 &rst
  ixpk= 1050, nxpk= 20, iat=  -1,1811, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1805,1806,
 &end
#
#  120 PRO  HB+         120 PRO  HA          3.50    (#   1051:20  Unique         2.28, 2.64 A)
 &rst
  ixpk= 1051, nxpk= 20, iat=  -1,1811, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1808,1809,
 &end
#
#  113 ALA  MB          120 PRO  HA          3.50    (#   1052:20  Unique         2.54, 3.63 A)
 &rst
  ixpk= 1052, nxpk= 20, iat=  -1,1811, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1728,1729,1730,
 &end
#
#  121 LEU  HN          120 PRO  HB-         5.50    (#   1053:20  Unique         3.15, 3.67 A)
 &rst
  ixpk= 1053, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1808,1809,
 &end
#
#  121 LEU  HN          120 PRO  HB+         5.50    (#   1054:20  Unique         3.15, 3.67 A)
 &rst
  ixpk= 1054, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1808,1809,
 &end
#
#  137 ALA  HA          120 PRO  HB-         3.50    (#   1055:20  Unique         2.45, 3.29 A)
 &rst
  ixpk= 1055, nxpk= 20, iat=2063,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1808,1809,
 &end
#
#    0 AMB  20-2:1056     0 AMB  20-1:1056   3.50    (#   1056:20  Double Ambig)
 &rst
  ixpk= 1056, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1811,2063,
 igr2=1808,1809,1808,1809,
 &end
#
#    0 AMB  20-2:1057     0 AMB  20-1:1057   4.50    (#   1057:20  Double Ambig)
 &rst
  ixpk= 1057, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1802,1803,1802,1803,
 igr2=1808,1809,1808,1809,
 &end
#
#  111 LEU  MDX         120 PRO  HB-         3.50    (#   1060:20  Unique         2.17, 4.25 A)
 &rst
  ixpk= 1060, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=1808,1809,
 &end
#
#  111 LEU  MDY         120 PRO  HB-         4.50    (#   1061:20  Unique         2.17, 4.25 A)
 &rst
  ixpk= 1061, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=1808,1809,
 &end
#
#  137 ALA  MB          120 PRO  HB-         4.50    (#   1062:20  Unique         2.34, 4.36 A)
 &rst
  ixpk= 1062, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2065,2066,2067,
 igr2=1808,1809,
 &end
#
#    0 AMB  20-2:1063   120 PRO  HG-         4.50    (#   1063:20  Single Ambig)
 &rst
  ixpk= 1063, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1811,2063,
 igr2=1805,1806,
 &end
#
#    0 AMB  20-2:1064     0 AMB  20-1:1064   4.50    (#   1064:20  Double Ambig)
 &rst
  ixpk= 1064, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1811,2063,
 igr2=1805,1806,1805,1806,
 &end
#
#    0 AMB  20-2:1065   120 PRO  HG-         3.50    (#   1065:20  Single Ambig)
 &rst
  ixpk= 1065, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1802,1803,1802,1803,
 igr2=1805,1806,
 &end
#
#    0 AMB  20-2:1067     0 AMB  20-1:1067   3.50    (#   1067:20  Double Ambig)
 &rst
  ixpk= 1067, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1802,1803,1802,1803,
 igr2=1805,1806,1805,1806,
 &end
#
#  119 GLU  HA            0 AMB  20-1:1068   3.50    (#   1068:20  Single Ambig)
 &rst
  ixpk= 1068, nxpk= 20, iat=1788,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1802,1803,1802,1803,
 &end
#
#  120 PRO  HA            0 AMB  20-1:1069   4.50    (#   1069:20  Single Ambig)
 &rst
  ixpk= 1069, nxpk= 20, iat=1811,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1802,1803,1802,1803,
 &end
#
#    0 AMB  20-2:1072     0 AMB  20-1:1072   3.50    (#   1072:20  Double Ambig)
 &rst
  ixpk= 1072, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1805,1806,1805,1806,1790,1791,1790,1791,
 igr2=1802,1803,1802,1803,1802,1803,
 &end
#
#    0 AMB  20-2:1073     0 AMB  20-1:1073   4.50    (#   1073:20  Double Ambig)
 &rst
  ixpk= 1073, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1808,1809,1808,1809,
 igr2=1802,1803,1802,1803,
 &end
#
#  121 LEU  HG          121 LEU  HB-         4.50    (#   1074:20  Unique         2.31, 2.39 A)
 &rst
  ixpk= 1074, nxpk= 20, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1819,1820,
 &end
#
#  121 LEU  HG          121 LEU  HB+         4.50    (#   1075:20  Unique         2.31, 2.39 A)
 &rst
  ixpk= 1075, nxpk= 20, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1819,1820,
 &end
#
#  121 LEU  HA          121 LEU  HB+         4.50    (#   1076:20  Unique         2.27, 2.73 A)
 &rst
  ixpk= 1076, nxpk= 20, iat=1817,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1819,1820,
 &end
#
#  114 ASN  HN          121 LEU  HG          4.50    (#   1077:20  Unique         3.93, 4.45 A)
 &rst
  ixpk= 1077, nxpk= 20, iat=1734,1822, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  113 ALA  HA          121 LEU  HG          5.50    (#   1078:20  Unique         4.55, 4.98 A)
 &rst
  ixpk= 1078, nxpk= 20, iat=1726,1822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 LEU  HA          121 LEU  HG          5.50    (#   1079:20  Unique         3.67, 3.86 A)
 &rst
  ixpk= 1079, nxpk= 20, iat=1817,1822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  114 ASN  HA          121 LEU  HG          4.50    (#   1080:20  Unique         3.87, 4.39 A)
 &rst
  ixpk= 1080, nxpk= 20, iat=1736,1822, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 ASN  HA          121 LEU  HG          4.50    (#   1081:20  Unique         2.10, 2.42 A)
 &rst
  ixpk= 1081, nxpk= 20, iat= 138,1822, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  122 LEU  HB-         121 LEU  HG          5.50    (#   1084:20  Unique         4.37, 5.60 A)
 &rst
  ixpk= 1084, nxpk= 20, iat=  -1,1822, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1838,1839,
 &end
#
#    0 AMB  20-2:1085   121 LEU  HG          3.50    (#   1085:20  Single Ambig)
 &rst
  ixpk= 1085, nxpk= 20, iat=  -1,1822, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 192, 193, 194, 130, 131, 132,
 &end
#
#  121 LEU  HB+         121 LEU  HG          4.50    (#   1086:20  Unique         2.31, 2.39 A)
 &rst
  ixpk= 1086, nxpk= 20, iat=  -1,1822, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1819,1820,
 &end
#
#    0 AMB  20-2:1087   121 LEU  HG          4.50    (#   1087:20  Single Ambig)
 &rst
  ixpk= 1087, nxpk= 20, iat=  -1,1822, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1824,1825,1826,1828,1829,1830,1215,1216,1217,1219,
      1220,1221,
 &end
#
#  123 THR  HN          122 LEU  HA          5.50    (#   1088:20  Unique         2.16, 2.22 A)
 &rst
  ixpk= 1088, nxpk= 20, iat=1853,1836, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1089   122 LEU  HA          6.50    (#   1089:20  Single Ambig)
 &rst
  ixpk= 1089, nxpk= 20, iat=  -1,1836, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1711,1712,1711,1712, 205, 206,2078,2079,
 &end
#
#  123 THR  HN          122 LEU  HB-         6.50    (#   1090:20  Unique         2.78, 3.92 A)
 &rst
  ixpk= 1090, nxpk= 20, iat=1853,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1838,1839,
 &end
#
#  123 THR  HN          122 LEU  HB+         6.50    (#   1091:20  Unique         2.78, 3.92 A)
 &rst
  ixpk= 1091, nxpk= 20, iat=1853,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1838,1839,
 &end
#
#  122 LEU  HN          122 LEU  HB-         5.50    (#   1092:20  Unique         2.58, 2.99 A)
 &rst
  ixpk= 1092, nxpk= 20, iat=1834,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1838,1839,
 &end
#
#  122 LEU  HN          122 LEU  HB+         5.50    (#   1093:20  Unique         2.58, 2.99 A)
 &rst
  ixpk= 1093, nxpk= 20, iat=1834,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1838,1839,
 &end
#
#  122 LEU  HA          122 LEU  HB+         4.50    (#   1094:20  Unique         2.57, 2.88 A)
 &rst
  ixpk= 1094, nxpk= 20, iat=1836,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1838,1839,
 &end
#
#  122 LEU  HA          122 LEU  HB-         4.50    (#   1095:20  Unique         2.57, 2.88 A)
 &rst
  ixpk= 1095, nxpk= 20, iat=1836,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1838,1839,
 &end
#
#  122 LEU  MDX         122 LEU  HB-         3.50    (#   1096:20  Unique         2.26, 3.26 A)
 &rst
  ixpk= 1096, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1843,1844,1845,1847,1848,1849,
 igr2=1838,1839,
 &end
#
#  122 LEU  MDX         122 LEU  HB+         3.50    (#   1097:20  Unique         2.26, 3.26 A)
 &rst
  ixpk= 1097, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1843,1844,1845,1847,1848,1849,
 igr2=1838,1839,
 &end
#
#  122 LEU  HN          122 LEU  HG          5.50    (#   1098:20  Unique         3.54, 4.41 A)
 &rst
  ixpk= 1098, nxpk= 20, iat=1834,1841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ALA  HN          122 LEU  MDX         5.50    (#   1099:20  Unique         3.87, 5.66 A)
 &rst
  ixpk= 1099, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#    0 AMB  20-2:1100   122 LEU  MDX         4.50    (#   1100:20  Single Ambig)
 &rst
  ixpk= 1100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 188,1886,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#   14 ARG  HN          122 LEU  MDX         5.50    (#   1101:20  Unique         3.23, 5.20 A)
 &rst
  ixpk= 1101, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#  122 LEU  HN          122 LEU  MDX         5.50    (#   1102:20  Unique         3.87, 5.47 A)
 &rst
  ixpk= 1102, nxpk= 20, iat=1834,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#  122 LEU  HA          122 LEU  MDX         4.50    (#   1103:20  Unique         2.23, 3.98 A)
 &rst
  ixpk= 1103, nxpk= 20, iat=1836,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#   14 ARG  HA          122 LEU  MDX         3.50    (#   1104:20  Unique         2.36, 3.91 A)
 &rst
  ixpk= 1104, nxpk= 20, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#   17 ALA  HA          122 LEU  MDX         5.50    (#   1105:20  Unique         4.62, 6.37 A)
 &rst
  ixpk= 1105, nxpk= 20, iat= 253,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#    0 AMB  20-2:1106   122 LEU  MDX         5.50    (#   1106:20  Single Ambig)
 &rst
  ixpk= 1106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 208, 209, 208, 209,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#  112 MET  HG+         122 LEU  MDX         4.50    (#   1107:20  Unique         3.58, 6.73 A)
 &rst
  ixpk= 1107, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1714,1715,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#    0 AMB  20-2:1108   122 LEU  MDX         3.50    (#   1108:20  Single Ambig)
 &rst
  ixpk= 1108, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 202, 203, 202, 203,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#    0 AMB  20-2:1109   122 LEU  MDX         2.80    (#   1109:20  Single Ambig)
 &rst
  ixpk= 1109, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=2015,2016,1718,1719,1720,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#  122 LEU  HB-         122 LEU  MDX         2.80    (#   1110:20  Unique         2.26, 3.26 A)
 &rst
  ixpk= 1110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1838,1839,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#    0 AMB  20-2:1111   122 LEU  MDX         2.80    (#   1111:20  Single Ambig)
 &rst
  ixpk= 1111, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1=2051,2052,2053,2055,2056,2057,1876,1877,1878,1880,
      1881,1882,1876,1877,1878,1880,1881,1882,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#  123 THR  HB          123 THR  HA          4.50    (#   1112:20  Unique         3.00, 3.02 A)
 &rst
  ixpk= 1112, nxpk= 20, iat=1857,1855, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  123 THR  HN          123 THR  HB          4.50    (#   1113:20  Unique         2.79, 2.87 A)
 &rst
  ixpk= 1113, nxpk= 20, iat=1853,1857, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  124 LEU  HN          123 THR  HB          5.50    (#   1114:20  Unique         3.86, 4.05 A)
 &rst
  ixpk= 1114, nxpk= 20, iat=1867,1857, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 THR  HA          123 THR  HB          4.50    (#   1115:20  Unique         3.00, 3.02 A)
 &rst
  ixpk= 1115, nxpk= 20, iat=1855,1857, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  122 LEU  HA          123 THR  HB          5.50    (#   1116:20  Unique         4.52, 4.74 A)
 &rst
  ixpk= 1116, nxpk= 20, iat=1836,1857, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 THR  MG2         123 THR  HB          3.50    (#   1117:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 1117, nxpk= 20, iat=  -1,1857, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1859,1860,1861,
 &end
#
#    0 AMB  20-2:1118   123 THR  HB          4.50    (#   1118:20  Single Ambig)
 &rst
  ixpk= 1118, nxpk= 20, iat=  -1,1857, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1892,1893,1894,1896,1897,1898,1697,1698,1699,1701,
      1702,1703,
 &end
#
#    0 AMB  20-2:1119   123 THR  HB          5.50    (#   1119:20  Single Ambig)
 &rst
  ixpk= 1119, nxpk= 20, iat=  -1,1857, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1841,1838,1839,1874,
 &end
#
#  124 LEU  HN          123 THR  MG2         4.50    (#   1121:20  Unique         2.55, 3.38 A)
 &rst
  ixpk= 1121, nxpk= 20, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1859,1860,1861,
 &end
#
#  110 LEU  HN          123 THR  MG2         5.50    (#   1122:20  Unique         3.17, 4.34 A)
 &rst
  ixpk= 1122, nxpk= 20, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1859,1860,1861,
 &end
#
#  111 LEU  HA          123 THR  MG2         3.50    (#   1124:20  Unique         2.50, 3.90 A)
 &rst
  ixpk= 1124, nxpk= 20, iat=1690,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1859,1860,1861,
 &end
#
#  123 THR  HB          123 THR  MG2         3.50    (#   1125:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 1125, nxpk= 20, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:1126   123 THR  MG2         4.50    (#   1126:20  Single Ambig)
 &rst
  ixpk= 1126, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1662,1663,1662,1663,
 igr2=1859,1860,1861,
 &end
#
#  125 VAL  HN          124 LEU  HA          3.50    (#   1129:20  Unique         2.12, 2.24 A)
 &rst
  ixpk= 1129, nxpk= 20, iat=1886,1869, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1130   124 LEU  HA          5.50    (#   1130:20  Single Ambig)
 &rst
  ixpk= 1130, nxpk= 20, iat=  -1,1869, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2015,2016,2018,2019,
 &end
#
#    0 AMB  20-2:1131   124 LEU  HA          6.50    (#   1131:20  Single Ambig)
 &rst
  ixpk= 1131, nxpk= 20, iat=  -1,1869, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=2125,2126,2075,2076,2075,2076,
 &end
#
#  124 LEU  HG          124 LEU  HA          4.50    (#   1132:20  Unique         2.41, 2.63 A)
 &rst
  ixpk= 1132, nxpk= 20, iat=1874,1869, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  124 LEU  HB+         124 LEU  HA          3.50    (#   1133:20  Unique         2.39, 2.80 A)
 &rst
  ixpk= 1133, nxpk= 20, iat=  -1,1869, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1871,1872,
 &end
#
#  124 LEU  MDX         124 LEU  HA          3.50    (#   1134:20  Unique         2.26, 4.10 A)
 &rst
  ixpk= 1134, nxpk= 20, iat=  -1,1869, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1876,1877,1878,1880,1881,1882,
 &end
#
#  125 VAL  MGY         124 LEU  HA          4.50    (#   1135:20  Unique         3.26, 5.53 A)
 &rst
  ixpk= 1135, nxpk= 20, iat=  -1,1869, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#  124 LEU  HN          124 LEU  HB-         4.50    (#   1136:20  Unique         2.31, 3.09 A)
 &rst
  ixpk= 1136, nxpk= 20, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1871,1872,
 &end
#
#  124 LEU  HN          124 LEU  HB+         5.50    (#   1137:20  Unique         2.31, 3.09 A)
 &rst
  ixpk= 1137, nxpk= 20, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1871,1872,
 &end
#
#  125 VAL  HN          124 LEU  HB+         4.50    (#   1138:20  Unique         2.71, 3.57 A)
 &rst
  ixpk= 1138, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1871,1872,
 &end
#
#  124 LEU  HA          124 LEU  HB-         4.50    (#   1139:20  Unique         2.39, 2.80 A)
 &rst
  ixpk= 1139, nxpk= 20, iat=1869,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1871,1872,
 &end
#
#  124 LEU  HA          124 LEU  HB+         4.50    (#   1140:20  Unique         2.39, 2.80 A)
 &rst
  ixpk= 1140, nxpk= 20, iat=1869,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1871,1872,
 &end
#
#    0 AMB  20-2:1141   124 LEU  HB-         5.50    (#   1141:20  Single Ambig)
 &rst
  ixpk= 1141, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 igr2=1871,1872,
 &end
#
#  125 VAL  HN          125 VAL  HA          3.50    (#   1142:20  Unique         2.97, 2.99 A)
 &rst
  ixpk= 1142, nxpk= 20, iat=1886,1888, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  110 LEU  HN          125 VAL  HA          4.50    (#   1143:20  Unique         3.33, 3.52 A)
 &rst
  ixpk= 1143, nxpk= 20, iat=1669,1888, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  109 SER  HA          125 VAL  HA          3.50    (#   1144:20  Unique         2.30, 2.37 A)
 &rst
  ixpk= 1144, nxpk= 20, iat=1660,1888, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  126 CYS  HB-         125 VAL  HA          4.50    (#   1145:20  Unique         4.24, 4.57 A)
 &rst
  ixpk= 1145, nxpk= 20, iat=  -1,1888, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1906,1907,
 &end
#
#  125 VAL  HB          125 VAL  HA          4.50    (#   1146:20  Unique         3.03, 3.04 A)
 &rst
  ixpk= 1146, nxpk= 20, iat=1890,1888, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  125 VAL  MGY         125 VAL  HA          3.50    (#   1147:20  Unique         2.43, 3.16 A)
 &rst
  ixpk= 1147, nxpk= 20, iat=  -1,1888, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#  125 VAL  HN          125 VAL  HB          3.50    (#   1148:20  Unique         2.70, 2.92 A)
 &rst
  ixpk= 1148, nxpk= 20, iat=1886,1890, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  126 CYS  HN          125 VAL  MGY         4.50    (#   1149:20  Unique         2.67, 4.16 A)
 &rst
  ixpk= 1149, nxpk= 20, iat=1902,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  125 VAL  HN          125 VAL  MGY         3.50    (#   1150:20  Unique         2.69, 4.35 A)
 &rst
  ixpk= 1150, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#    0 AMB  20-2:1151   125 VAL  MGY         4.50    (#   1151:20  Single Ambig)
 &rst
  ixpk= 1151, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1660,1904,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  132 LEU  HA          125 VAL  MGY         6.50    (#   1152:20  Unique         5.66, 7.23 A)
 &rst
  ixpk= 1152, nxpk= 20, iat=1982,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#    0 AMB  20-2:1153   125 VAL  MGY         4.50    (#   1153:20  Single Ambig)
 &rst
  ixpk= 1153, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1662,1663,1662,1663,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  133 ASP  HB+         125 VAL  MGY         4.50    (#   1154:20  Unique         3.25, 5.18 A)
 &rst
  ixpk= 1154, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2003,2004,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  125 VAL  HB          125 VAL  MGY         3.50    (#   1155:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 1155, nxpk= 20, iat=1890,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  123 THR  MG2         125 VAL  MGY         2.80    (#   1156:20  Unique         2.39, 5.25 A)
 &rst
  ixpk= 1156, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1859,1860,1861,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  127 SER  HN          126 CYS  HA          4.50    (#   1157:20  Unique         2.11, 2.14 A)
 &rst
  ixpk= 1157, nxpk= 20, iat=1913,1904, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  126 CYS  HB-         126 CYS  HA          4.50    (#   1158:20  Unique         2.37, 2.77 A)
 &rst
  ixpk= 1158, nxpk= 20, iat=  -1,1904, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1906,1907,
 &end
#
#  126 CYS  HB+         126 CYS  HA          4.50    (#   1159:20  Unique         2.37, 2.77 A)
 &rst
  ixpk= 1159, nxpk= 20, iat=  -1,1904, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1906,1907,
 &end
#
#  132 LEU  HG          126 CYS  HA          5.50    (#   1160:20  Unique         2.13, 2.51 A)
 &rst
  ixpk= 1160, nxpk= 20, iat=1987,1904, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  132 LEU  MDY         126 CYS  HA          4.50    (#   1161:20  Unique         3.73, 4.52 A)
 &rst
  ixpk= 1161, nxpk= 20, iat=  -1,1904, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#  126 CYS  HN          126 CYS  HB-         6.50    (#   1162:20  Unique         2.51, 2.77 A)
 &rst
  ixpk= 1162, nxpk= 20, iat=1902,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1906,1907,
 &end
#
#  126 CYS  HN          126 CYS  HB+         4.50    (#   1163:20  Unique         2.51, 2.77 A)
 &rst
  ixpk= 1163, nxpk= 20, iat=1902,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1906,1907,
 &end
#
#  132 LEU  MDY         126 CYS  HB-         5.50    (#   1164:20  Unique         2.15, 4.14 A)
 &rst
  ixpk= 1164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1989,1990,1991,1993,1994,1995,
 igr2=1906,1907,
 &end
#
#  127 SER  HN          127 SER  HB+         5.50    (#   1166:20  Unique         2.55, 3.20 A)
 &rst
  ixpk= 1166, nxpk= 20, iat=1913,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1917,1918,
 &end
#
#  127 SER  HA          127 SER  HB+         3.50    (#   1167:20  Unique         2.41, 2.51 A)
 &rst
  ixpk= 1167, nxpk= 20, iat=1915,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1917,1918,
 &end
#
#  130 TRP  HN          129 SER  HA          4.50    (#   1170:20  Unique         2.17, 2.23 A)
 &rst
  ixpk= 1170, nxpk= 20, iat=1942,1933, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  130 TRP  HN            0 AMB  20-1:1172   4.50    (#   1172:20  Single Ambig)
 &rst
  ixpk= 1172, nxpk= 20, iat=1942,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1935,1936,1935,1936,
 &end
#
#  129 SER  HN            0 AMB  20-1:1173   4.50    (#   1173:20  Single Ambig)
 &rst
  ixpk= 1173, nxpk= 20, iat=1931,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1935,1936,1935,1936,
 &end
#
#  129 SER  HA            0 AMB  20-1:1174   3.50    (#   1174:20  Single Ambig)
 &rst
  ixpk= 1174, nxpk= 20, iat=1933,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1935,1936,1935,1936,
 &end
#
#  130 TRP  HA            0 AMB  20-1:1175   4.50    (#   1175:20  Single Ambig)
 &rst
  ixpk= 1175, nxpk= 20, iat=1944,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1935,1936,1935,1936,
 &end
#
#    0 AMB  20-2:1176     0 AMB  20-1:1176   4.50    (#   1176:20  Double Ambig)
 &rst
  ixpk= 1176, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1946,1947,1946,1947,1946,1947,
 igr2=1935,1936,1935,1936,1935,1936,
 &end
#
#  130 TRP  HN          130 TRP  HA          5.50    (#   1177:20  Unique         2.76, 2.80 A)
 &rst
  ixpk= 1177, nxpk= 20, iat=1942,1944, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1179   130 TRP  HA          3.50    (#   1179:20  Single Ambig)
 &rst
  ixpk= 1179, nxpk= 20, iat=  -1,1944, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1946,1947,1946,1947,
 &end
#
#  131 PRO  HB-         131 PRO  HA          3.50    (#   1180:20  Unique         2.28, 2.54 A)
 &rst
  ixpk= 1180, nxpk= 20, iat=  -1,1976, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1973,1974,
 &end
#
#  131 PRO  HD+         131 PRO  HG-         3.50    (#   1181:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 1181, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1967,1968,
 igr2=1970,1971,
 &end
#
#  131 PRO  HD+         131 PRO  HG+         3.50    (#   1182:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 1182, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1967,1968,
 igr2=1970,1971,
 &end
#
#  131 PRO  HB+         131 PRO  HG+         4.50    (#   1183:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1183, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1973,1974,
 igr2=1970,1971,
 &end
#
#  131 PRO  HB+         131 PRO  HG-         3.50    (#   1184:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 1184, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1973,1974,
 igr2=1970,1971,
 &end
#
#  131 PRO  HB+         131 PRO  HD+         4.50    (#   1185:20  Unique         2.82, 3.72 A)
 &rst
  ixpk= 1185, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1973,1974,
 igr2=1967,1968,
 &end
#
#  131 PRO  HB+         131 PRO  HD-         4.50    (#   1186:20  Unique         2.82, 3.72 A)
 &rst
  ixpk= 1186, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1973,1974,
 igr2=1967,1968,
 &end
#
#  131 PRO  HG-         131 PRO  HD+         3.50    (#   1187:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 1187, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1970,1971,
 igr2=1967,1968,
 &end
#
#  131 PRO  HG+         131 PRO  HD+         3.50    (#   1188:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 1188, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1970,1971,
 igr2=1967,1968,
 &end
#
#  131 PRO  HG-         131 PRO  HD-         3.50    (#   1189:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 1189, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1970,1971,
 igr2=1967,1968,
 &end
#
#  131 PRO  HG+         131 PRO  HD-         3.50    (#   1190:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 1190, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1970,1971,
 igr2=1967,1968,
 &end
#
#  132 LEU  MDY         132 LEU  HB-         3.50    (#   1191:20  Unique         2.26, 3.30 A)
 &rst
  ixpk= 1191, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1989,1990,1991,1993,1994,1995,
 igr2=1984,1985,
 &end
#
#  132 LEU  MDX         132 LEU  HB-         3.50    (#   1192:20  Unique         2.26, 3.30 A)
 &rst
  ixpk= 1192, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1989,1990,1991,1993,1994,1995,
 igr2=1984,1985,
 &end
#
#   30 ARG  HD+          64 LEU  HB+         6.50    (#   1193:20  Unique         5.33, 7.51 A)
 &rst
  ixpk= 1193, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 453, 454,
 igr2= 980, 981,
 &end
#
#  132 LEU  HA          132 LEU  HB-         4.50    (#   1194:20  Unique         2.16, 2.79 A)
 &rst
  ixpk= 1194, nxpk= 20, iat=1982,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1984,1985,
 &end
#
#  132 LEU  HN          132 LEU  HB-         4.50    (#   1195:20  Unique         2.27, 3.42 A)
 &rst
  ixpk= 1195, nxpk= 20, iat=1980,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1984,1985,
 &end
#
#  133 ASP  HN          132 LEU  HB-         4.50    (#   1196:20  Unique         2.28, 3.21 A)
 &rst
  ixpk= 1196, nxpk= 20, iat=1999,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1984,1985,
 &end
#
#  133 ASP  HN          133 ASP  HB-         4.50    (#   1197:20  Unique         2.33, 2.56 A)
 &rst
  ixpk= 1197, nxpk= 20, iat=1999,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2003,2004,
 &end
#
#  133 ASP  HN          133 ASP  HB+         3.50    (#   1198:20  Unique         2.33, 2.56 A)
 &rst
  ixpk= 1198, nxpk= 20, iat=1999,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2003,2004,
 &end
#
#  134 GLN  HN          133 ASP  HB-         4.50    (#   1199:20  Unique         2.53, 3.91 A)
 &rst
  ixpk= 1199, nxpk= 20, iat=2011,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2003,2004,
 &end
#
#  134 GLN  HN          133 ASP  HB+         4.50    (#   1200:20  Unique         2.53, 3.91 A)
 &rst
  ixpk= 1200, nxpk= 20, iat=2011,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2003,2004,
 &end
#
#  125 VAL  HN          133 ASP  HB-         4.50    (#   1201:20  Unique         2.36, 3.46 A)
 &rst
  ixpk= 1201, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2003,2004,
 &end
#
#  125 VAL  HN          133 ASP  HB+         4.50    (#   1202:20  Unique         2.36, 3.46 A)
 &rst
  ixpk= 1202, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2003,2004,
 &end
#
#  132 LEU  HA          133 ASP  HB-         5.50    (#   1205:20  Unique         4.22, 4.56 A)
 &rst
  ixpk= 1205, nxpk= 20, iat=1982,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2003,2004,
 &end
#
#  132 LEU  HA          133 ASP  HB+         5.50    (#   1206:20  Unique         4.22, 4.56 A)
 &rst
  ixpk= 1206, nxpk= 20, iat=1982,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2003,2004,
 &end
#
#  125 VAL  HB          133 ASP  HB-         4.50    (#   1207:20  Unique         2.23, 2.96 A)
 &rst
  ixpk= 1207, nxpk= 20, iat=1890,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2003,2004,
 &end
#
#  125 VAL  HB          133 ASP  HB+         4.50    (#   1208:20  Unique         2.23, 2.96 A)
 &rst
  ixpk= 1208, nxpk= 20, iat=1890,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2003,2004,
 &end
#
#  125 VAL  MGY         133 ASP  HB-         4.50    (#   1209:20  Unique         3.25, 5.18 A)
 &rst
  ixpk= 1209, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1892,1893,1894,1896,1897,1898,
 igr2=2003,2004,
 &end
#
#  125 VAL  MGY         133 ASP  HB+         4.50    (#   1210:20  Unique         3.25, 5.18 A)
 &rst
  ixpk= 1210, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1892,1893,1894,1896,1897,1898,
 igr2=2003,2004,
 &end
#
#  125 VAL  HN          134 GLN  HA          4.50    (#   1211:20  Unique         3.68, 4.08 A)
 &rst
  ixpk= 1211, nxpk= 20, iat=1886,2013, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  134 GLN  HN          134 GLN  HA          4.50    (#   1212:20  Unique         2.89, 2.96 A)
 &rst
  ixpk= 1212, nxpk= 20, iat=2011,2013, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  134 GLN  HG+         134 GLN  HA          3.50    (#   1213:20  Unique         2.46, 2.92 A)
 &rst
  ixpk= 1213, nxpk= 20, iat=  -1,2013, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2018,2019,
 &end
#
#  134 GLN  HB+         134 GLN  HA          3.50    (#   1214:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1214, nxpk= 20, iat=  -1,2013, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2015,2016,
 &end
#
#  124 LEU  HG          134 GLN  HA          4.50    (#   1215:20  Unique         2.20, 3.15 A)
 &rst
  ixpk= 1215, nxpk= 20, iat=1874,2013, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  124 LEU  MDX         134 GLN  HA          3.50    (#   1216:20  Unique         2.15, 4.62 A)
 &rst
  ixpk= 1216, nxpk= 20, iat=  -1,2013, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1876,1877,1878,1880,1881,1882,
 &end
#
#  122 LEU  MDX         134 GLN  HA          4.50    (#   1217:20  Unique         3.54, 5.57 A)
 &rst
  ixpk= 1217, nxpk= 20, iat=  -1,2013, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1843,1844,1845,1847,1848,1849,
 &end
#
#  134 GLN  HN          134 GLN  HB+         4.50    (#   1218:20  Unique         2.39, 3.19 A)
 &rst
  ixpk= 1218, nxpk= 20, iat=2011,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2015,2016,
 &end
#
#  134 GLN  HN          134 GLN  HB-         4.50    (#   1219:20  Unique         2.39, 3.19 A)
 &rst
  ixpk= 1219, nxpk= 20, iat=2011,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2015,2016,
 &end
#
#  134 GLN  HA          134 GLN  HB-         4.50    (#   1220:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1220, nxpk= 20, iat=2013,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2015,2016,
 &end
#
#  134 GLN  HA          134 GLN  HB+         4.50    (#   1221:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1221, nxpk= 20, iat=2013,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2015,2016,
 &end
#
#  124 LEU  MDX         134 GLN  HG-         3.50    (#   1222:20  Unique         2.30, 4.62 A)
 &rst
  ixpk= 1222, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1876,1877,1878,1880,1881,1882,
 igr2=2018,2019,
 &end
#
#  124 LEU  MDX         134 GLN  HG+         3.50    (#   1223:20  Unique         2.30, 4.62 A)
 &rst
  ixpk= 1223, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1876,1877,1878,1880,1881,1882,
 igr2=2018,2019,
 &end
#
#  134 GLN  HA          134 GLN  HG-         4.50    (#   1224:20  Unique         2.46, 2.92 A)
 &rst
  ixpk= 1224, nxpk= 20, iat=2013,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2018,2019,
 &end
#
#  134 GLN  HA          134 GLN  HG+         4.50    (#   1225:20  Unique         2.46, 2.92 A)
 &rst
  ixpk= 1225, nxpk= 20, iat=2013,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2018,2019,
 &end
#
#  134 GLN  HE2+        134 GLN  HG-         4.50    (#   1226:20  Unique         2.35, 3.35 A)
 &rst
  ixpk= 1226, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2023,2024,
 igr2=2018,2019,
 &end
#
#  134 GLN  HE2+        134 GLN  HG+         4.50    (#   1227:20  Unique         2.35, 3.35 A)
 &rst
  ixpk= 1227, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2023,2024,
 igr2=2018,2019,
 &end
#
#  135 THR  HN          134 GLN  HG+         5.50    (#   1228:20  Unique         2.90, 4.09 A)
 &rst
  ixpk= 1228, nxpk= 20, iat=2028,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#  135 THR  HN          135 THR  HB          3.50    (#   1229:20  Unique         2.61, 3.16 A)
 &rst
  ixpk= 1229, nxpk= 20, iat=2028,2032, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  134 GLN  HA          135 THR  HB          5.50    (#   1230:20  Unique         4.15, 4.43 A)
 &rst
  ixpk= 1230, nxpk= 20, iat=2013,2032, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  135 THR  HA          135 THR  HB          4.50    (#   1231:20  Unique         2.45, 2.52 A)
 &rst
  ixpk= 1231, nxpk= 20, iat=2030,2032, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  135 THR  MG2         135 THR  HB          3.50    (#   1232:20  Unique         2.38, 2.65 A)
 &rst
  ixpk= 1232, nxpk= 20, iat=  -1,2032, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2034,2035,2036,
 &end
#
#    0 AMB  20-2:1233   135 THR  HB          6.50    (#   1233:20  Single Ambig)
 &rst
  ixpk= 1233, nxpk= 20, iat=  -1,2032, r1= 1.30, r2= 1.80, r3= 8.99, r4= 9.49,
 igr1=1876,1877,1878,1880,1881,1882,2049,
 &end
#
#    0 AMB  20-2:1234   135 THR  HB          5.50    (#   1234:20  Single Ambig)
 &rst
  ixpk= 1234, nxpk= 20, iat=  -1,2032, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1892,1893,1894,1896,1897,1898,1843,1844,1845,1847,
      1848,1849,
 &end
#
#   60 ARG  HB+          55 THR  MG2         3.50    (#   1235:20  Unique         3.33, 4.71 A)
 &rst
  ixpk= 1235, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 902, 903,
 igr2= 831, 832, 833,
 &end
#
#  136 LEU  HN          136 LEU  HB-         4.50    (#   1237:20  Unique         2.30, 2.98 A)
 &rst
  ixpk= 1237, nxpk= 20, iat=2042,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2046,2047,
 &end
#
#  136 LEU  HN          136 LEU  HB+         5.50    (#   1238:20  Unique         2.30, 2.98 A)
 &rst
  ixpk= 1238, nxpk= 20, iat=2042,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2046,2047,
 &end
#
#  137 ALA  HN          136 LEU  HB+         6.50    (#   1239:20  Unique         2.59, 3.68 A)
 &rst
  ixpk= 1239, nxpk= 20, iat=2061,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=2046,2047,
 &end
#
#  137 ALA  HN          136 LEU  HB-         6.50    (#   1240:20  Unique         2.59, 3.68 A)
 &rst
  ixpk= 1240, nxpk= 20, iat=2061,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=2046,2047,
 &end
#
#  136 LEU  HA          136 LEU  HB-         4.50    (#   1241:20  Unique         2.47, 2.81 A)
 &rst
  ixpk= 1241, nxpk= 20, iat=2044,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2046,2047,
 &end
#
#  136 LEU  HA          136 LEU  HB+         4.50    (#   1242:20  Unique         2.47, 2.81 A)
 &rst
  ixpk= 1242, nxpk= 20, iat=2044,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2046,2047,
 &end
#
#   14 ARG  HG-         136 LEU  MDX         4.50    (#   1246:20  Unique         2.72, 6.18 A)
 &rst
  ixpk= 1246, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 205, 206,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#  134 GLN  HE2+        136 LEU  MDX         5.50    (#   1247:20  Unique         4.36, 7.91 A)
 &rst
  ixpk= 1247, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2023,2024,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#  137 ALA  HN          136 LEU  MDX         5.50    (#   1248:20  Unique         3.36, 5.39 A)
 &rst
  ixpk= 1248, nxpk= 20, iat=2061,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#  136 LEU  HN          136 LEU  MDX         5.50    (#   1249:20  Unique         2.64, 4.30 A)
 &rst
  ixpk= 1249, nxpk= 20, iat=2042,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#  138 ARG  HN          137 ALA  HA          4.50    (#   1250:20  Unique         2.06, 2.69 A)
 &rst
  ixpk= 1250, nxpk= 20, iat=2071,2063, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  137 ALA  HN          137 ALA  HA          3.50    (#   1251:20  Unique         2.22, 2.31 A)
 &rst
  ixpk= 1251, nxpk= 20, iat=2061,2063, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  122 LEU  HA          137 ALA  HA          6.50    (#   1252:20  Unique         3.50, 4.07 A)
 &rst
  ixpk= 1252, nxpk= 20, iat=1836,2063, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  137 ALA  MB          137 ALA  HA          3.50    (#   1254:20  Unique         2.41, 2.65 A)
 &rst
  ixpk= 1254, nxpk= 20, iat=  -1,2063, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2065,2066,2067,
 &end
#
#  102 ASP  HN          101 ALA  MB          4.50    (#   1256:20  Unique         2.95, 3.77 A)
 &rst
  ixpk= 1256, nxpk= 20, iat=1555,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1549,1550,1551,
 &end
#
#  102 ASP  HB-         101 ALA  MB          5.50    (#   1257:20  Unique         3.83, 5.58 A)
 &rst
  ixpk= 1257, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1559,1560,
 igr2=1549,1550,1551,
 &end
#
#  102 ASP  HB+         101 ALA  MB          5.50    (#   1258:20  Unique         3.83, 5.58 A)
 &rst
  ixpk= 1258, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1559,1560,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:1259   138 ARG  HA          3.50    (#   1259:20  Single Ambig)
 &rst
  ixpk= 1259, nxpk= 20, iat=  -1,2073, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2071,2095,2121,
 &end
#
#    0 AMB  20-2:1261   138 ARG  HA          4.50    (#   1261:20  Single Ambig)
 &rst
  ixpk= 1261, nxpk= 20, iat=  -1,2073, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2081,2082,2081,2082,
 &end
#
#  141 ARG  HB-         138 ARG  HA          3.50    (#   1262:20  Unique         2.39, 4.01 A)
 &rst
  ixpk= 1262, nxpk= 20, iat=  -1,2073, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2125,2126,
 &end
#
#  139 ASP  HN          139 ASP  HB-         4.50    (#   1263:20  Unique         2.27, 2.52 A)
 &rst
  ixpk= 1263, nxpk= 20, iat=2095,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2099,2100,
 &end
#
#  141 ARG  HN          140 THR  HA          4.50    (#   1265:20  Unique         3.21, 3.39 A)
 &rst
  ixpk= 1265, nxpk= 20, iat=2121,2109, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  140 THR  MG2         140 THR  HA          3.50    (#   1266:20  Unique         2.47, 3.70 A)
 &rst
  ixpk= 1266, nxpk= 20, iat=  -1,2109, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2113,2114,2115,
 &end
#
#  140 THR  HN          140 THR  MG2         5.50    (#   1268:20  Unique         2.12, 3.48 A)
 &rst
  ixpk= 1268, nxpk= 20, iat=2107,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2113,2114,2115,
 &end
#
#  140 THR  HB          140 THR  MG2         3.50    (#   1269:20  Unique         2.36, 2.66 A)
 &rst
  ixpk= 1269, nxpk= 20, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2113,2114,2115,
 &end
#
#  135 THR  HB          140 THR  MG2         4.50    (#   1270:20  Unique         2.31, 3.68 A)
 &rst
  ixpk= 1270, nxpk= 20, iat=2032,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2113,2114,2115,
 &end
#
#  141 ARG  HA          141 ARG  HB+         3.50    (#   1271:20  Unique         2.34, 2.76 A)
 &rst
  ixpk= 1271, nxpk= 20, iat=2123,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2125,2126,
 &end
#
#  141 ARG  HA          141 ARG  HB-         4.50    (#   1272:20  Unique         2.34, 2.76 A)
 &rst
  ixpk= 1272, nxpk= 20, iat=2123,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2125,2126,
 &end
#
#    0 AMB  20-2:1274     0 AMB  20-1:1274   2.80    (#   1274:20  Double Ambig)
 &rst
  ixpk= 1274, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=2078,2079,2078,2079,2078,2079,
 igr2=2081,2082,2081,2082,2081,2082,
 &end
#
#    0 AMB  20-2:1275     0 AMB  20-1:1275   2.80    (#   1275:20  Double Ambig)
 &rst
  ixpk= 1275, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1=2125,2126,2075,2076,2075,2076,2075,2076,
 igr2=2081,2082,2081,2082,2081,2082,2081,2082,
 &end
#
#  117 THR  HA          117 THR  HB          3.50    (#   1276:20  Unique         2.44, 2.60 A)
 &rst
  ixpk= 1276, nxpk= 20, iat=1767,1769, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1277   117 THR  HB          4.50    (#   1277:20  Single Ambig)
 &rst
  ixpk= 1277, nxpk= 20, iat=  -1,1769, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1793,1794,1793,1794,
 &end
#
#  117 THR  MG2         117 THR  HB          3.50    (#   1278:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 1278, nxpk= 20, iat=  -1,1769, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1771,1772,1773,
 &end
#
#   92 SER  HN           92 SER  HB+         6.50    (#   1279:20  Unique         2.42, 2.76 A)
 &rst
  ixpk= 1279, nxpk= 20, iat=1402,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1406,1407,
 &end
#
#   92 SER  HN           92 SER  HB-         5.50    (#   1280:20  Unique         2.42, 2.76 A)
 &rst
  ixpk= 1280, nxpk= 20, iat=1402,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1406,1407,
 &end
#
#    0 AMB  20-2:1285    86 PRO  HA          6.50    (#   1285:20  Single Ambig)
 &rst
  ixpk= 1285, nxpk= 20, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1298,1299,1298,1299,
 &end
#
#    0 AMB  20-2:1286    86 PRO  HA          5.50    (#   1286:20  Single Ambig)
 &rst
  ixpk= 1286, nxpk= 20, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1295,1296,1312,1313,
 &end
#
#   76 TRP  HB+          76 TRP  HA          4.50    (#   1287:20  Unique         2.38, 2.77 A)
 &rst
  ixpk= 1287, nxpk= 20, iat=  -1,1142, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1144,1145,
 &end
#
#    0 AMB  20-2:1288    76 TRP  HA          5.50    (#   1288:20  Single Ambig)
 &rst
  ixpk= 1288, nxpk= 20, iat=  -1,1142, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1168,1169,1168,1169, 686, 687,
 &end
#
#   16 THR  MG2          76 TRP  HA          5.50    (#   1289:20  Unique         2.33, 5.60 A)
 &rst
  ixpk= 1289, nxpk= 20, iat=  -1,1142, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 243, 244, 245,
 &end
#
#   93 ASN  HB+          93 ASN  HA          4.50    (#   1309:20  Unique         2.38, 2.72 A)
 &rst
  ixpk= 1309, nxpk= 20, iat=  -1,1415, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1417,1418,
 &end
#
#   94 GLN  HG+          94 GLN  HA          4.50    (#   1315:20  Unique         3.70, 3.83 A)
 &rst
  ixpk= 1315, nxpk= 20, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1434,1435,
 &end
#
#   76 TRP  HZ2           0 AMB  20-1:1316   5.50    (#   1316:20  Single Ambig)
 &rst
  ixpk= 1316, nxpk= 20, iat=1153,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 281, 282, 281, 282,
 &end
#
#   88 LYS  HN           87 PHE  HB-         4.50    (#   1317:20  Unique         2.60, 3.52 A)
 &rst
  ixpk= 1317, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1326,1327,
 &end
#
#   88 LYS  HN           87 PHE  HB+         4.50    (#   1318:20  Unique         2.60, 3.52 A)
 &rst
  ixpk= 1318, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1326,1327,
 &end
#
#   87 PHE  HD           87 PHE  HB-         4.50    (#   1319:20  Unique         2.32, 3.08 A)
 &rst
  ixpk= 1319, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1330,1338,
 igr2=1326,1327,
 &end
#
#   87 PHE  HD           87 PHE  HB+         4.50    (#   1320:20  Unique         2.32, 3.08 A)
 &rst
  ixpk= 1320, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1330,1338,
 igr2=1326,1327,
 &end
#
#   87 PHE  HN           87 PHE  HB-         5.50    (#   1321:20  Unique         2.38, 3.16 A)
 &rst
  ixpk= 1321, nxpk= 20, iat=1322,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1326,1327,
 &end
#
#   87 PHE  HN           87 PHE  HB+         5.50    (#   1322:20  Unique         2.38, 3.16 A)
 &rst
  ixpk= 1322, nxpk= 20, iat=1322,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1326,1327,
 &end
#
#   87 PHE  HA           87 PHE  HB-         4.50    (#   1323:20  Unique         2.26, 2.67 A)
 &rst
  ixpk= 1323, nxpk= 20, iat=1324,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1326,1327,
 &end
#
#   87 PHE  HA           87 PHE  HB+         4.50    (#   1324:20  Unique         2.26, 2.67 A)
 &rst
  ixpk= 1324, nxpk= 20, iat=1324,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1326,1327,
 &end
#
#    0 AMB  20-2:1325     0 AMB  20-1:1325   5.50    (#   1325:20  Double Ambig)
 &rst
  ixpk= 1325, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 760, 761, 762, 171, 172,
 igr2=1417,1418, 140, 141,
 &end
#
#    0 AMB  20-2:1326    10 ASN  HB-         4.50    (#   1326:20  Single Ambig)
 &rst
  ixpk= 1326, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 130, 131, 132, 192, 193, 194,
 igr2= 140, 141,
 &end
#
#    0 AMB  20-2:1327     0 AMB  20-1:1327   4.50    (#   1327:20  Double Ambig)
 &rst
  ixpk= 1327, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 130, 131, 132, 192, 193, 194,
 igr2= 140, 141, 140, 141,
 &end
#
#  121 LEU  MDY          10 ASN  HB+         5.50    (#   1328:20  Unique         2.28, 5.14 A)
 &rst
  ixpk= 1328, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1824,1825,1826,1828,1829,1830,
 igr2= 140, 141,
 &end
#
#  130 TRP  HN            0 AMB  20-1:1330   4.50    (#   1330:20  Single Ambig)
 &rst
  ixpk= 1330, nxpk= 20, iat=1942,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1946,1947,1946,1947,
 &end
#
#  130 TRP  HE3           0 AMB  20-1:1331   4.50    (#   1331:20  Single Ambig)
 &rst
  ixpk= 1331, nxpk= 20, iat=1961,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1946,1947,1946,1947,
 &end
#
#   76 TRP  HA           76 TRP  HB+         4.50    (#   1332:20  Unique         2.38, 2.77 A)
 &rst
  ixpk= 1332, nxpk= 20, iat=1142,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1144,1145,
 &end
#
#  130 TRP  HA            0 AMB  20-1:1333   4.50    (#   1333:20  Single Ambig)
 &rst
  ixpk= 1333, nxpk= 20, iat=1944,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1946,1947,1946,1947,
 &end
#
#  105 ILE  QD1           0 AMB  20-1:1334   4.50    (#   1334:20  Single Ambig)
 &rst
  ixpk= 1334, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1604,1605,1606,
 igr2=1946,1947,1946,1947,
 &end
#
#   28 ILE  QD1           0 AMB  20-1:1335   4.50    (#   1335:20  Single Ambig)
 &rst
  ixpk= 1335, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 425, 426, 427,
 igr2=1946,1947,1946,1947,
 &end
#
#  107 PRO  HA          107 PRO  HG+         3.50    (#   1337:20  Unique         2.75, 3.56 A)
 &rst
  ixpk= 1337, nxpk= 20, iat=1634,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1628,1629,
 &end
#
#   27 ALA  HN           26 LEU  HG          4.50    (#   1341:20  Unique         2.88, 3.07 A)
 &rst
  ixpk= 1341, nxpk= 20, iat= 402, 390, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  105 ILE  HN            0 AMB  20-1:1344   5.50    (#   1344:20  Single Ambig)
 &rst
  ixpk= 1344, nxpk= 20, iat=1591,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1601,1602,1601,1602,
 &end
#
#   30 ARG  HN           30 ARG  HG-         6.50    (#   1345:20  Unique         2.39, 3.75 A)
 &rst
  ixpk= 1345, nxpk= 20, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 450, 451,
 &end
#
#   24 LEU  HA           24 LEU  MDY         4.50    (#   1349:20  Unique         2.19, 3.89 A)
 &rst
  ixpk= 1349, nxpk= 20, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#    0 AMB  20-2:1350    24 LEU  MDY         4.50    (#   1350:20  Single Ambig)
 &rst
  ixpk= 1350, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 595, 596, 597, 425, 426, 427,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#  130 TRP  HZ3          24 LEU  MDY         4.50    (#   1352:20  Unique         2.43, 4.50 A)
 &rst
  ixpk= 1352, nxpk= 20, iat=1959,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#  130 TRP  HE3          24 LEU  MDY         3.50    (#   1353:20  Unique         2.35, 4.16 A)
 &rst
  ixpk= 1353, nxpk= 20, iat=1961,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#  132 LEU  HN            0 AMB  20-1:1355   4.50    (#   1355:20  Single Ambig)
 &rst
  ixpk= 1355, nxpk= 20, iat=1980,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1989,1990,1991,1993,1994,1995, 358, 359, 360, 362,
       363, 364,
 &end
#
#   95 PRO  HB-          95 PRO  HG+         5.50    (#   1356:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 1356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1451,1452,
 igr2=1448,1449,
 &end
#
#   94 GLN  HG-          95 PRO  HG+         4.50    (#   1357:20  Unique         4.73, 6.13 A)
 &rst
  ixpk= 1357, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1434,1435,
 igr2=1448,1449,
 &end
#
#   95 PRO  HD+          95 PRO  HG+         4.50    (#   1358:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 1358, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1445,1446,
 igr2=1448,1449,
 &end
#
#  111 LEU  HN           84 LEU  MDX         5.50    (#   1359:20  Unique         3.20, 6.28 A)
 &rst
  ixpk= 1359, nxpk= 20, iat=1688,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   85 GLN  HN           84 LEU  MDX         5.50    (#   1360:20  Unique         1.92, 4.04 A)
 &rst
  ixpk= 1360, nxpk= 20, iat=1291,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#  108 PHE  HD           84 LEU  MDX         5.50    (#   1361:20  Unique         2.31, 5.23 A)
 &rst
  ixpk= 1361, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1646,1654,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   42 PHE  HD           84 LEU  MDX         5.50    (#   1362:20  Unique         2.41, 5.05 A)
 &rst
  ixpk= 1362, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 626, 634,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  HA           84 LEU  MDX         4.50    (#   1365:20  Unique         2.18, 3.80 A)
 &rst
  ixpk= 1365, nxpk= 20, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:1366    84 LEU  MDX         5.50    (#   1366:20  Single Ambig)
 &rst
  ixpk= 1366, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1368,1369,1479,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#  110 LEU  HB-          84 LEU  MDX         4.50    (#   1367:20  Unique         2.32, 5.18 A)
 &rst
  ixpk= 1367, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1673,1674,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:1370    84 LEU  MDX         4.50    (#   1370:20  Single Ambig)
 &rst
  ixpk= 1370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1276,1277,1462,1463,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   82 ILE  QG2          84 LEU  MDX         4.50    (#   1373:20  Unique         2.96, 6.27 A)
 &rst
  ixpk= 1373, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1242,1243,1244,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   17 ALA  HN          112 MET  ME          5.50    (#   1376:20  Unique         2.55, 3.98 A)
 &rst
  ixpk= 1376, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1718,1719,1720,
 &end
#
#    0 AMB  20-2:1378   112 MET  ME          6.50    (#   1378:20  Single Ambig)
 &rst
  ixpk= 1378, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1709,1690,
 igr2=1718,1719,1720,
 &end
#
#   16 THR  HB          112 MET  ME          4.50    (#   1379:20  Unique         2.30, 3.47 A)
 &rst
  ixpk= 1379, nxpk= 20, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1718,1719,1720,
 &end
#
#   17 ALA  HA          112 MET  ME          5.50    (#   1381:20  Unique         2.37, 3.78 A)
 &rst
  ixpk= 1381, nxpk= 20, iat= 253,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1718,1719,1720,
 &end
#
#   80 LEU  HB+         112 MET  ME          6.50    (#   1383:20  Unique         4.64, 6.38 A)
 &rst
  ixpk= 1383, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1210,1211,
 igr2=1718,1719,1720,
 &end
#
#    0 AMB  20-2:1384   112 MET  ME          3.50    (#   1384:20  Single Ambig)
 &rst
  ixpk= 1384, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1215,1216,1217,1219,1220,1221,1876,1877,1878,1880,
      1881,1882,
 igr2=1718,1719,1720,
 &end
#
#    0 AMB  20-2:1385   112 MET  ME          3.50    (#   1385:20  Single Ambig)
 &rst
  ixpk= 1385, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1215,1216,1217,1219,1220,1221,1843,1844,1845,1847,
      1848,1849,
 igr2=1718,1719,1720,
 &end
#
#  110 LEU  MDX         112 MET  ME          4.50    (#   1386:20  Unique         2.69, 5.55 A)
 &rst
  ixpk= 1386, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1678,1679,1680,1682,1683,1684,
 igr2=1718,1719,1720,
 &end
#
#   82 ILE  QD1         112 MET  ME          4.50    (#   1387:20  Unique         2.29, 4.85 A)
 &rst
  ixpk= 1387, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1249,1250,1251,
 igr2=1718,1719,1720,
 &end
#
#  114 ASN  HD2+          9 ALA  MB          4.50    (#   1388:20  Unique         2.14, 3.83 A)
 &rst
  ixpk= 1388, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1743,1744,
 igr2= 130, 131, 132,
 &end
#
#   28 ILE  HN           28 ILE  QD1         4.50    (#   1389:20  Unique         2.70, 4.21 A)
 &rst
  ixpk= 1389, nxpk= 20, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 425, 426, 427,
 &end
#
#  130 TRP  HE3          28 ILE  QD1         4.50    (#   1390:20  Unique         2.40, 3.07 A)
 &rst
  ixpk= 1390, nxpk= 20, iat=1961,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 425, 426, 427,
 &end
#
#   28 ILE  HA           28 ILE  QD1         4.50    (#   1391:20  Unique         3.04, 4.62 A)
 &rst
  ixpk= 1391, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 425, 426, 427,
 &end
#
#    0 AMB  20-2:1392    28 ILE  QD1         4.50    (#   1392:20  Single Ambig)
 &rst
  ixpk= 1392, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1946,1947,1946,1947,
 igr2= 425, 426, 427,
 &end
#
#   25 GLU  HA           28 ILE  QD1         4.50    (#   1393:20  Unique         2.28, 3.54 A)
 &rst
  ixpk= 1393, nxpk= 20, iat= 370,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 425, 426, 427,
 &end
#
#   28 ILE  HG1+         28 ILE  QD1         3.50    (#   1394:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 1394, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 422, 423,
 igr2= 425, 426, 427,
 &end
#
#    0 AMB  20-2:1395    28 ILE  QD1         3.50    (#   1395:20  Single Ambig)
 &rst
  ixpk= 1395, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 416, 356,
 igr2= 425, 426, 427,
 &end
#
#   24 LEU  MDX          28 ILE  QD1         4.50    (#   1396:20  Unique         3.59, 5.64 A)
 &rst
  ixpk= 1396, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 358, 359, 360, 362, 363, 364,
 igr2= 425, 426, 427,
 &end
#
#  122 LEU  HA          135 THR  HB          6.50    (#   1397:20  Unique         6.15, 6.51 A)
 &rst
  ixpk= 1397, nxpk= 20, iat=1836,2032, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  135 THR  MG2         123 THR  HB          4.50    (#   1398:20  Unique         2.07, 2.67 A)
 &rst
  ixpk= 1398, nxpk= 20, iat=  -1,1857, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2034,2035,2036,
 &end
#
#   33 LEU  HB-          30 ARG  HA          3.50    (#   1400:20  Unique         2.34, 3.43 A)
 &rst
  ixpk= 1400, nxpk= 20, iat=  -1, 445, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 495, 496,
 &end
#
#   25 GLU  HN           24 LEU  HA          4.50    (#   1401:20  Unique         3.57, 3.58 A)
 &rst
  ixpk= 1401, nxpk= 20, iat= 368, 351, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1402    24 LEU  HA          5.50    (#   1402:20  Single Ambig)
 &rst
  ixpk= 1402, nxpk= 20, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 592, 593,1597,1598,1599,
 &end
#
#   99 ILE  QD1          24 LEU  HA          4.50    (#   1404:20  Unique         3.78, 5.04 A)
 &rst
  ixpk= 1404, nxpk= 20, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1520,1521,1522,
 &end
#
#   13 ALA  HN           10 ASN  HA          4.50    (#   1410:20  Unique         3.23, 3.45 A)
 &rst
  ixpk= 1410, nxpk= 20, iat= 188, 138, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 GLU  HN           65 GLN  HA          4.50    (#   1412:20  Unique         2.30, 3.33 A)
 &rst
  ixpk= 1412, nxpk= 20, iat=1012, 997, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 VAL  MGY          27 ALA  HA          3.50    (#   1413:20  Unique         2.20, 3.90 A)
 &rst
  ixpk= 1413, nxpk= 20, iat=  -1, 404, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#   50 MET  HG-          50 MET  HA          4.50    (#   1414:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 1414, nxpk= 20, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 756, 757,
 &end
#
#   84 LEU  HN           84 LEU  HB+         4.50    (#   1415:20  Unique         2.23, 2.92 A)
 &rst
  ixpk= 1415, nxpk= 20, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1276,1277,
 &end
#
#   84 LEU  MDY          84 LEU  HB+         4.50    (#   1416:20  Unique         2.26, 3.43 A)
 &rst
  ixpk= 1416, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1276,1277,
 &end
#
#   84 LEU  MDX          84 LEU  HB+         4.50    (#   1417:20  Unique         2.26, 3.43 A)
 &rst
  ixpk= 1417, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1276,1277,
 &end
#
#  112 MET  HN          111 LEU  HB+         5.50    (#   1419:20  Unique         3.67, 4.06 A)
 &rst
  ixpk= 1419, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1692,1693,
 &end
#
#   14 ARG  HN            0 AMB  20-1:1420   5.50    (#   1420:20  Single Ambig)
 &rst
  ixpk= 1420, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 208, 209, 208, 209,
 &end
#
#  132 LEU  MDX         132 LEU  HB+         3.50    (#   1425:20  Unique         2.26, 3.30 A)
 &rst
  ixpk= 1425, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1989,1990,1991,1993,1994,1995,
 igr2=1984,1985,
 &end
#
#   12 ARG  HN           12 ARG  HD+         5.50    (#   1428:20  Unique         3.14, 4.41 A)
 &rst
  ixpk= 1428, nxpk= 20, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 174, 175,
 &end
#
#    0 AMB  20-2:1429     0 AMB  20-1:1429   4.50    (#   1429:20  Double Ambig)
 &rst
  ixpk= 1429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1183,1184,1198,1199,
 igr2= 174, 175, 174, 175,
 &end
#
#   80 LEU  HG           12 ARG  HD+         5.50    (#   1430:20  Unique         4.60, 5.99 A)
 &rst
  ixpk= 1430, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 174, 175,
 &end
#
#   80 LEU  HG           12 ARG  HD-         5.50    (#   1431:20  Unique         4.60, 5.99 A)
 &rst
  ixpk= 1431, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 174, 175,
 &end
#
#   10 ASN  HN           10 ASN  HB-         3.50    (#   1432:20  Unique         2.31, 2.54 A)
 &rst
  ixpk= 1432, nxpk= 20, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 140, 141,
 &end
#
#   10 ASN  HN           10 ASN  HB+         3.50    (#   1433:20  Unique         2.31, 2.54 A)
 &rst
  ixpk= 1433, nxpk= 20, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 140, 141,
 &end
#
#    9 ALA  MB           79 GLU  HG+         5.50    (#   1434:20  Unique         2.23, 4.31 A)
 &rst
  ixpk= 1434, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 130, 131, 132,
 igr2=1198,1199,
 &end
#
#  115 ALA  MB           79 GLU  HG-         6.50    (#   1435:20  Unique         2.62, 5.97 A)
 &rst
  ixpk= 1435, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1752,1753,1754,
 igr2=1198,1199,
 &end
#
#    0 AMB  20-2:1436     0 AMB  20-1:1436   4.50    (#   1436:20  Double Ambig)
 &rst
  ixpk= 1436, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 116, 117, 118, 120, 121, 122,1213,
 igr2=1198,1199,1198,1199,
 &end
#
#    0 AMB  20-2:1437    79 GLU  HG-         4.50    (#   1437:20  Single Ambig)
 &rst
  ixpk= 1437, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1= 116, 117, 118, 120, 121, 122,1213,
 igr2=1198,1199,
 &end
#
#  104 GLN  HE2-        104 GLN  HG-         5.50    (#   1438:20  Unique         2.12, 3.36 A)
 &rst
  ixpk= 1438, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1586,1587,
 igr2=1581,1582,
 &end
#
#   82 ILE  QD1           0 AMB  20-1:1439   5.50    (#   1439:20  Single Ambig)
 &rst
  ixpk= 1439, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1249,1250,1251,
 igr2=1711,1712,1711,1712,
 &end
#
#   82 ILE  QD1          76 TRP  HB+         5.50    (#   1440:20  Unique         2.57, 6.17 A)
 &rst
  ixpk= 1440, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1249,1250,1251,
 igr2=1144,1145,
 &end
#
#  105 ILE  QG2           0 AMB  20-1:1444   4.50    (#   1444:20  Single Ambig)
 &rst
  ixpk= 1444, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1597,1598,1599,
 igr2=1601,1602,1601,1602,
 &end
#
#   99 ILE  QG2           0 AMB  20-1:1445   3.50    (#   1445:20  Single Ambig)
 &rst
  ixpk= 1445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1513,1514,1515,
 igr2=1601,1602,1601,1602,
 &end
#
#  111 LEU  HN          110 LEU  MDY         4.50    (#   1447:20  Unique         2.17, 4.92 A)
 &rst
  ixpk= 1447, nxpk= 20, iat=1688,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:1449   110 LEU  MDY         5.50    (#   1449:20  Single Ambig)
 &rst
  ixpk= 1449, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1157,1268,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:1450   110 LEU  MDY         4.50    (#   1450:20  Single Ambig)
 &rst
  ixpk= 1450, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.82, r4=10.32,
 igr1=1697,1698,1699,1701,1702,1703,1215,1216,1217,1219,
      1220,1221,1892,1893,1894,1896,1897,1898,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  133 ASP  HN          132 LEU  MDX         5.50    (#   1451:20  Unique         3.36, 5.05 A)
 &rst
  ixpk= 1451, nxpk= 20, iat=1999,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  108 PHE  HA          132 LEU  MDX         5.50    (#   1455:20  Unique         6.28, 7.96 A)
 &rst
  ixpk= 1455, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  132 LEU  HA          132 LEU  MDX         4.50    (#   1456:20  Unique         2.87, 4.16 A)
 &rst
  ixpk= 1456, nxpk= 20, iat=1982,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#    0 AMB  20-2:1457     0 AMB  20-1:1457   4.50    (#   1457:20  Double Ambig)
 &rst
  ixpk= 1457, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1=1946,1947,1946,1947,1946,1947,
 igr2= 358, 359, 360, 362, 363, 364,1989,1990,1991,1993,
      1994,1995,
 &end
#
#  122 LEU  HN          111 LEU  MDY         6.50    (#   1458:20  Unique         3.84, 6.02 A)
 &rst
  ixpk= 1458, nxpk= 20, iat=1834,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  123 THR  HA          111 LEU  MDY         6.50    (#   1459:20  Unique         3.72, 5.38 A)
 &rst
  ixpk= 1459, nxpk= 20, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#   13 ALA  HA          122 LEU  MDX         5.50    (#   1460:20  Unique         3.80, 5.94 A)
 &rst
  ixpk= 1460, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#    0 AMB  20-2:1461   111 LEU  MDY         6.50    (#   1461:20  Single Ambig)
 &rst
  ixpk= 1461, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1=1676,1752,1753,1754,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#   95 PRO  HB-          95 PRO  HG-         5.50    (#   1462:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 1462, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1451,1452,
 igr2=1448,1449,
 &end
#
#   95 PRO  HB+          95 PRO  HG-         5.50    (#   1463:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 1463, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1451,1452,
 igr2=1448,1449,
 &end
#
#   95 PRO  HD+          95 PRO  HG-         5.50    (#   1464:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 1464, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1445,1446,
 igr2=1448,1449,
 &end
#
#  108 PHE  HE          110 LEU  MDX         5.50    (#   1465:20  Unique         2.51, 6.15 A)
 &rst
  ixpk= 1465, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1648,1652,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:1468    84 LEU  MDY         5.50    (#   1468:20  Single Ambig)
 &rst
  ixpk= 1468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1298,1299,1298,1299,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:1469    84 LEU  MDY         4.50    (#   1469:20  Single Ambig)
 &rst
  ixpk= 1469, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1368,1369,1479,1295,1296,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  HB-          84 LEU  MDY         3.50    (#   1470:20  Unique         2.26, 3.43 A)
 &rst
  ixpk= 1470, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1276,1277,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  HG           84 LEU  MDY         3.50    (#   1471:20  Unique         2.34, 2.65 A)
 &rst
  ixpk= 1471, nxpk= 20, iat=1279,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   97 VAL  MGY          84 LEU  MDY         4.50    (#   1472:20  Unique         2.46, 5.91 A)
 &rst
  ixpk= 1472, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1481,1482,1483,1485,1486,1487,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   82 ILE  QG2          84 LEU  MDY         4.50    (#   1473:20  Unique         2.96, 6.27 A)
 &rst
  ixpk= 1473, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1242,1243,1244,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#  124 LEU  HN          124 LEU  MDX         6.50    (#   1474:20  Unique         2.91, 4.52 A)
 &rst
  ixpk= 1474, nxpk= 20, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#    0 AMB  20-2:1476   132 LEU  MDY         5.50    (#   1476:20  Single Ambig)
 &rst
  ixpk= 1476, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 305, 309,1650,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#   84 LEU  MDY         132 LEU  MDY         5.50    (#   1477:20  Unique         5.81, 8.99 A)
 &rst
  ixpk= 1477, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#   12 ARG  HD-          80 LEU  MDX         5.50    (#   1478:20  Unique         3.70, 7.02 A)
 &rst
  ixpk= 1478, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 174, 175,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#   77 ASP  HB+          80 LEU  MDX         4.50    (#   1479:20  Unique         2.16, 4.58 A)
 &rst
  ixpk= 1479, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1168,1169,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#   79 GLU  HB-          80 LEU  MDX         4.50    (#   1480:20  Unique         2.67, 6.26 A)
 &rst
  ixpk= 1480, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1195,1196,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#    0 AMB  20-2:1481    21 THR  MG2         5.50    (#   1481:20  Single Ambig)
 &rst
  ixpk= 1481, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 349, 261,
 igr2= 321, 322, 323,
 &end
#
#  132 LEU  HN           21 THR  MG2         5.50    (#   1482:20  Unique         3.49, 5.85 A)
 &rst
  ixpk= 1482, nxpk= 20, iat=1980,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 321, 322, 323,
 &end
#
#   95 PRO  HG+          98 VAL  MGY         5.50    (#   1483:20  Unique         2.46, 4.85 A)
 &rst
  ixpk= 1483, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1448,1449,
 igr2=1497,1498,1499,1501,1502,1503,
 &end
#
#  130 TRP  HA          105 ILE  QD1         4.50    (#   1485:20  Unique         2.69, 4.21 A)
 &rst
  ixpk= 1485, nxpk= 20, iat=1944,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1604,1605,1606,
 &end
#
#    0 AMB  20-2:1486   105 ILE  QD1         6.50    (#   1486:20  Single Ambig)
 &rst
  ixpk= 1486, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1935,1936,1935,1936,
 igr2=1604,1605,1606,
 &end
#
#    5 ARG  HA            0 AMB  20-1:1487   4.50    (#   1487:20  Single Ambig)
 &rst
  ixpk= 1487, nxpk= 20, iat=  61,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=  69,  70,  69,  70,
 &end
#
#    0 AMB  20-2:1489     0 AMB  20-1:1489   2.80    (#   1489:20  Double Ambig)
 &rst
  ixpk= 1489, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  87,  88,  87,  88,
 igr2=  90,  91,  90,  91,
 &end
#
#   10 ASN  HB-           0 AMB  20-1:1490   6.50    (#   1490:20  Single Ambig)
 &rst
  ixpk= 1490, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1= 140, 141,
 igr2=  90,  91,  90,  91,
 &end
#
#   10 ASN  HN            0 AMB  20-1:1491   6.50    (#   1491:20  Single Ambig)
 &rst
  ixpk= 1491, nxpk= 20, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr2=  90,  91,  90,  91,
 &end
#
#    6 GLU  HN            0 AMB  20-1:1492   4.50    (#   1492:20  Single Ambig)
 &rst
  ixpk= 1492, nxpk= 20, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=  90,  91,  90,  91,
 &end
#
#    7 ASP  HA            7 ASP  HB-         3.50    (#   1493:20  Unique         2.33, 2.69 A)
 &rst
  ixpk= 1493, nxpk= 20, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 102, 103,
 &end
#
#    8 VAL  HN            7 ASP  HB-         4.50    (#   1494:20  Unique         2.02, 4.13 A)
 &rst
  ixpk= 1494, nxpk= 20, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 102, 103,
 &end
#
#    8 VAL  HA            7 ASP  HB-         5.50    (#   1496:20  Unique         4.41, 5.69 A)
 &rst
  ixpk= 1496, nxpk= 20, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 102, 103,
 &end
#
#   11 THR  MG2           8 VAL  HA          4.50    (#   1498:20  Unique         4.34, 5.47 A)
 &rst
  ixpk= 1498, nxpk= 20, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 156, 157, 158,
 &end
#
#    8 VAL  MGX           8 VAL  HB          2.80    (#   1500:20  Unique         2.37, 2.66 A)
 &rst
  ixpk= 1500, nxpk= 20, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#    9 ALA  MB            8 VAL  HB          4.50    (#   1501:20  Unique         4.23, 5.38 A)
 &rst
  ixpk= 1501, nxpk= 20, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 130, 131, 132,
 &end
#
#    0 AMB  20-2:1502   113 ALA  MB          4.50    (#   1502:20  Single Ambig)
 &rst
  ixpk= 1502, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1229,1230,1229,1230,
 igr2=1728,1729,1730,
 &end
#
#  113 ALA  HA          113 ALA  MB          3.50    (#   1503:20  Unique         2.43, 2.65 A)
 &rst
  ixpk= 1503, nxpk= 20, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1728,1729,1730,
 &end
#
#  114 ASN  HN          113 ALA  MB          3.50    (#   1504:20  Unique         2.74, 3.66 A)
 &rst
  ixpk= 1504, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1728,1729,1730,
 &end
#
#    8 VAL  HA            8 VAL  MGX         3.50    (#   1505:20  Unique         2.37, 3.15 A)
 &rst
  ixpk= 1505, nxpk= 20, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    8 VAL  HB            8 VAL  MGX         3.50    (#   1506:20  Unique         2.37, 2.66 A)
 &rst
  ixpk= 1506, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    0 AMB  20-2:1507     8 VAL  MGX         4.50    (#   1507:20  Single Ambig)
 &rst
  ixpk= 1507, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=  69,  70,  69,  70,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    0 AMB  20-2:1509     8 VAL  MGY         5.50    (#   1509:20  Single Ambig)
 &rst
  ixpk= 1509, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=  59,1743,1744,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#   12 ARG  HN            9 ALA  HA          4.50    (#   1510:20  Unique         3.30, 3.54 A)
 &rst
  ixpk= 1510, nxpk= 20, iat= 164, 128, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1511     9 ALA  HA          5.50    (#   1511:20  Single Ambig)
 &rst
  ixpk= 1511, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 188,1748,
 &end
#
#  121 LEU  HG            9 ALA  MB          3.50    (#   1512:20  Unique         3.06, 4.14 A)
 &rst
  ixpk= 1512, nxpk= 20, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 130, 131, 132,
 &end
#
#  122 LEU  HB-          13 ALA  MB          2.80    (#   1513:20  Unique         2.34, 3.82 A)
 &rst
  ixpk= 1513, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1838,1839,
 igr2= 192, 193, 194,
 &end
#
#   80 LEU  HG            0 AMB  20-1:1514   4.50    (#   1514:20  Single Ambig)
 &rst
  ixpk= 1514, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 192, 193, 194, 130, 131, 132,
 &end
#
#   13 ALA  HA           13 ALA  MB          3.50    (#   1515:20  Unique         2.40, 2.65 A)
 &rst
  ixpk= 1515, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 192, 193, 194,
 &end
#
#   13 ALA  HN           13 ALA  MB          3.50    (#   1516:20  Unique         2.45, 2.89 A)
 &rst
  ixpk= 1516, nxpk= 20, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 192, 193, 194,
 &end
#
#   93 ASN  HA           93 ASN  HB+         4.50    (#   1517:20  Unique         2.38, 2.72 A)
 &rst
  ixpk= 1517, nxpk= 20, iat=1415,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1417,1418,
 &end
#
#  121 LEU  HG           10 ASN  HB+         6.50    (#   1518:20  Unique         3.11, 4.30 A)
 &rst
  ixpk= 1518, nxpk= 20, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 140, 141,
 &end
#
#  121 LEU  MDY          10 ASN  HB-         5.50    (#   1519:20  Unique         2.28, 5.14 A)
 &rst
  ixpk= 1519, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1824,1825,1826,1828,1829,1830,
 igr2= 140, 141,
 &end
#
#   14 ARG  HG+          11 THR  HA          4.50    (#   1520:20  Unique         2.43, 4.58 A)
 &rst
  ixpk= 1520, nxpk= 20, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 205, 206,
 &end
#
#    0 AMB  20-2:1521    11 THR  MG2         4.50    (#   1521:20  Single Ambig)
 &rst
  ixpk= 1521, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 202, 203, 202, 203,
 igr2= 156, 157, 158,
 &end
#
#   79 GLU  HN           79 GLU  HA          3.50    (#   1524:20  Unique         2.82, 2.95 A)
 &rst
  ixpk= 1524, nxpk= 20, iat=1191,1193, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   15 GLU  HG+          12 ARG  HA          3.50    (#   1525:20  Unique         3.41, 4.16 A)
 &rst
  ixpk= 1525, nxpk= 20, iat=  -1, 166, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 229, 230,
 &end
#
#  132 LEU  MDY         126 CYS  HB+         3.50    (#   1526:20  Unique         2.15, 4.14 A)
 &rst
  ixpk= 1526, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1989,1990,1991,1993,1994,1995,
 igr2=1906,1907,
 &end
#
#   79 GLU  HN           79 GLU  HB+         4.50    (#   1527:20  Unique         2.33, 3.21 A)
 &rst
  ixpk= 1527, nxpk= 20, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1195,1196,
 &end
#
#   12 ARG  HN           12 ARG  HB+         5.50    (#   1528:20  Unique         2.21, 3.01 A)
 &rst
  ixpk= 1528, nxpk= 20, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 168, 169,
 &end
#
#   16 THR  HN            0 AMB  20-1:1529   5.50    (#   1529:20  Single Ambig)
 &rst
  ixpk= 1529, nxpk= 20, iat= 237,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 278, 279, 205, 206,
 &end
#
#   13 ALA  HN           14 ARG  HG+         4.50    (#   1530:20  Unique         4.28, 5.42 A)
 &rst
  ixpk= 1530, nxpk= 20, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 205, 206,
 &end
#
#   88 LYS  HA           88 LYS  HD+         4.50    (#   1531:20  Unique         3.98, 4.72 A)
 &rst
  ixpk= 1531, nxpk= 20, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1352,1353,
 &end
#
#   88 LYS  HA           88 LYS  HD-         4.50    (#   1532:20  Unique         3.98, 4.72 A)
 &rst
  ixpk= 1532, nxpk= 20, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1352,1353,
 &end
#
#    0 AMB  20-2:1533   119 GLU  HB-         3.50    (#   1533:20  Single Ambig)
 &rst
  ixpk= 1533, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1802,1803,1802,1803,
 igr2=1790,1791,
 &end
#
#    0 AMB  20-2:1534     0 AMB  20-1:1534   4.50    (#   1534:20  Double Ambig)
 &rst
  ixpk= 1534, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1090,1091,1802,1803,1802,1803,
 igr2= 999,1000,1790,1791,1790,1791,
 &end
#
#   37 PRO  HD-          36 GLN  HB-         4.50    (#   1535:20  Unique         2.29, 4.28 A)
 &rst
  ixpk= 1535, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 546, 547,
 igr2= 532, 533,
 &end
#
#    0 AMB  20-2:1536     0 AMB  20-1:1536   2.80    (#   1536:20  Double Ambig)
 &rst
  ixpk= 1536, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 392, 393, 394, 396, 397, 398,1215,1216,1217,1219,
      1220,1221,
 igr2= 390, 171, 172,
 &end
#
#   33 LEU  MDX          33 LEU  HG          2.80    (#   1537:20  Unique         2.44, 2.66 A)
 &rst
  ixpk= 1537, nxpk= 20, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 500, 501, 502, 504, 505, 506,
 &end
#
#   26 LEU  HN           26 LEU  HG          4.50    (#   1539:20  Unique         4.10, 4.24 A)
 &rst
  ixpk= 1539, nxpk= 20, iat= 383, 390, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1540    33 LEU  HG          4.50    (#   1540:20  Single Ambig)
 &rst
  ixpk= 1540, nxpk= 20, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 491, 510,
 &end
#
#   26 LEU  HA           26 LEU  HG          3.50    (#   1542:20  Unique         3.33, 3.42 A)
 &rst
  ixpk= 1542, nxpk= 20, iat= 385, 390, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 ARG  HA           49 ILE  HG1-        3.50    (#   1544:20  Unique         3.51, 4.39 A)
 &rst
  ixpk= 1544, nxpk= 20, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 740, 741,
 &end
#
#    0 AMB  20-2:1545     0 AMB  20-1:1545   3.50    (#   1545:20  Double Ambig)
 &rst
  ixpk= 1545, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 171, 172,1195,1196,
 igr2= 174, 175, 174, 175,
 &end
#
#    0 AMB  20-2:1546    12 ARG  HD-         3.50    (#   1546:20  Single Ambig)
 &rst
  ixpk= 1546, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 171, 172,1195,1196,
 igr2= 174, 175,
 &end
#
#   17 ALA  HN           13 ALA  MB          5.50    (#   1547:20  Unique         4.85, 5.55 A)
 &rst
  ixpk= 1547, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 192, 193, 194,
 &end
#
#   31 ALA  HN           30 ARG  HB+         4.50    (#   1548:20  Unique         2.76, 3.49 A)
 &rst
  ixpk= 1548, nxpk= 20, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 447, 448,
 &end
#
#    0 AMB  20-2:1551     0 AMB  20-1:1551   3.50    (#   1551:20  Double Ambig)
 &rst
  ixpk= 1551, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1= 447, 448, 202, 203, 202, 203, 202, 203,
 igr2= 453, 454, 208, 209, 208, 209, 208, 209,
 &end
#
#    0 AMB  20-2:1552    15 GLU  HA          4.50    (#   1552:20  Single Ambig)
 &rst
  ixpk= 1552, nxpk= 20, iat=  -1, 224, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 202, 203, 202, 203,
 &end
#
#   12 ARG  HA           15 GLU  HB-         3.50    (#   1553:20  Unique         2.18, 2.98 A)
 &rst
  ixpk= 1553, nxpk= 20, iat= 166,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 226, 227,
 &end
#
#    0 AMB  20-2:1554     0 AMB  20-1:1554   2.80    (#   1554:20  Double Ambig)
 &rst
  ixpk= 1554, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 166,1178,
 igr2= 226, 227,1180,1181,1180,1181,
 &end
#
#   78 GLU  HN            0 AMB  20-1:1555   3.50    (#   1555:20  Single Ambig)
 &rst
  ixpk= 1555, nxpk= 20, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1180,1181,1180,1181,
 &end
#
#   79 GLU  HN            0 AMB  20-1:1556   4.50    (#   1556:20  Single Ambig)
 &rst
  ixpk= 1556, nxpk= 20, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1180,1181,1180,1181,
 &end
#
#   16 THR  MG2          16 THR  HA          3.50    (#   1557:20  Unique         2.56, 3.25 A)
 &rst
  ixpk= 1557, nxpk= 20, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 243, 244, 245,
 &end
#
#   15 GLU  HB-          16 THR  HA          4.50    (#   1558:20  Unique         4.07, 4.65 A)
 &rst
  ixpk= 1558, nxpk= 20, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 226, 227,
 &end
#
#   19 ARG  HG+          16 THR  HA          4.50    (#   1559:20  Unique         2.92, 4.44 A)
 &rst
  ixpk= 1559, nxpk= 20, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 278, 279,
 &end
#
#   19 ARG  HN           16 THR  HA          4.50    (#   1560:20  Unique         3.22, 3.48 A)
 &rst
  ixpk= 1560, nxpk= 20, iat= 271, 239, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 ALA  HN           16 THR  HA          5.50    (#   1561:20  Unique         3.55, 3.57 A)
 &rst
  ixpk= 1561, nxpk= 20, iat= 251, 239, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1562    21 THR  HB          5.50    (#   1562:20  Single Ambig)
 &rst
  ixpk= 1562, nxpk= 20, iat=  -1, 319, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 265, 266, 267,1970,1971,
 &end
#
#   16 THR  HN           16 THR  MG2         4.50    (#   1563:20  Unique         4.35, 4.54 A)
 &rst
  ixpk= 1563, nxpk= 20, iat= 237,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 243, 244, 245,
 &end
#
#   17 ALA  HN           16 THR  MG2         5.50    (#   1564:20  Unique         3.51, 4.49 A)
 &rst
  ixpk= 1564, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 243, 244, 245,
 &end
#
#   76 TRP  HZ3          16 THR  MG2         4.50    (#   1566:20  Unique         3.77, 4.93 A)
 &rst
  ixpk= 1566, nxpk= 20, iat=1157,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 243, 244, 245,
 &end
#
#   16 THR  HB           16 THR  MG2         3.50    (#   1568:20  Unique         2.34, 2.65 A)
 &rst
  ixpk= 1568, nxpk= 20, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 243, 244, 245,
 &end
#
#   16 THR  HA           16 THR  MG2         3.50    (#   1569:20  Unique         2.56, 3.25 A)
 &rst
  ixpk= 1569, nxpk= 20, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 243, 244, 245,
 &end
#
#    0 AMB  20-2:1570    16 THR  MG2         5.50    (#   1570:20  Single Ambig)
 &rst
  ixpk= 1570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1168,1169, 299, 300,
 igr2= 243, 244, 245,
 &end
#
#    0 AMB  20-2:1571    16 THR  MG2         5.50    (#   1571:20  Single Ambig)
 &rst
  ixpk= 1571, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 275, 276,1714,1715,
 igr2= 243, 244, 245,
 &end
#
#   80 LEU  HG           16 THR  MG2         4.50    (#   1572:20  Unique         3.07, 5.40 A)
 &rst
  ixpk= 1572, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 243, 244, 245,
 &end
#
#  112 MET  ME           17 ALA  MB          4.50    (#   1573:20  Unique         2.46, 4.56 A)
 &rst
  ixpk= 1573, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1718,1719,1720,
 igr2= 255, 256, 257,
 &end
#
#    0 AMB  20-2:1575     0 AMB  20-1:1575   6.50    (#   1575:20  Double Ambig)
 &rst
  ixpk= 1575, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1= 275, 276,1714,1715,
 igr2= 343, 344, 345, 255, 256, 257,
 &end
#
#   23 ALA  HN           23 ALA  MB          3.50    (#   1577:20  Unique         2.45, 2.88 A)
 &rst
  ixpk= 1577, nxpk= 20, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 343, 344, 345,
 &end
#
#    0 AMB  20-2:1578     0 AMB  20-1:1578   3.50    (#   1578:20  Double Ambig)
 &rst
  ixpk= 1578, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 261, 349,
 igr2= 255, 256, 257, 343, 344, 345,
 &end
#
#   21 THR  MG2          18 ALA  HA          4.50    (#   1579:20  Unique         4.27, 5.07 A)
 &rst
  ixpk= 1579, nxpk= 20, iat=  -1, 263, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 321, 322, 323,
 &end
#
#   15 GLU  HA           18 ALA  MB          3.50    (#   1581:20  Unique         2.65, 3.71 A)
 &rst
  ixpk= 1581, nxpk= 20, iat= 224,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 265, 266, 267,
 &end
#
#   18 ALA  HA           18 ALA  MB          3.50    (#   1582:20  Unique         2.44, 2.66 A)
 &rst
  ixpk= 1582, nxpk= 20, iat= 263,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 265, 266, 267,
 &end
#
#    0 AMB  20-2:1583    18 ALA  MB          3.50    (#   1583:20  Single Ambig)
 &rst
  ixpk= 1583, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 261, 271,
 igr2= 265, 266, 267,
 &end
#
#   22 ALA  MB           19 ARG  HA          3.50    (#   1585:20  Unique         2.56, 3.63 A)
 &rst
  ixpk= 1585, nxpk= 20, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 333, 334, 335,
 &end
#
#   19 ARG  HG+          19 ARG  HA          3.50    (#   1586:20  Unique         2.34, 3.05 A)
 &rst
  ixpk= 1586, nxpk= 20, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 278, 279,
 &end
#
#   19 ARG  HG-          19 ARG  HA          3.50    (#   1587:20  Unique         2.34, 3.05 A)
 &rst
  ixpk= 1587, nxpk= 20, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 278, 279,
 &end
#
#   19 ARG  HB+          19 ARG  HA          3.50    (#   1588:20  Unique         2.44, 2.79 A)
 &rst
  ixpk= 1588, nxpk= 20, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 275, 276,
 &end
#
#   34 SER  HB+          34 SER  HA          2.80    (#   1589:20  Unique         2.36, 2.72 A)
 &rst
  ixpk= 1589, nxpk= 20, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 514, 515,
 &end
#
#   34 SER  HB-          34 SER  HA          3.50    (#   1590:20  Unique         2.36, 2.72 A)
 &rst
  ixpk= 1590, nxpk= 20, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 514, 515,
 &end
#
#   22 ALA  HN           19 ARG  HA          5.50    (#   1591:20  Unique         3.09, 3.37 A)
 &rst
  ixpk= 1591, nxpk= 20, iat= 329, 273, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1592     0 AMB  20-1:1592   3.50    (#   1592:20  Double Ambig)
 &rst
  ixpk= 1592, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 271, 521,
 igr2= 273, 512,
 &end
#
#    0 AMB  20-2:1593    34 SER  HA          3.50    (#   1593:20  Single Ambig)
 &rst
  ixpk= 1593, nxpk= 20, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 510, 528,
 &end
#
#    0 AMB  20-2:1596    19 ARG  HA          5.50    (#   1596:20  Single Ambig)
 &rst
  ixpk= 1596, nxpk= 20, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 281, 282, 281, 282,
 &end
#
#   19 ARG  HN           19 ARG  HB+         4.50    (#   1597:20  Unique         2.21, 2.80 A)
 &rst
  ixpk= 1597, nxpk= 20, iat= 271,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 275, 276,
 &end
#
#   19 ARG  HN           19 ARG  HB-         4.50    (#   1598:20  Unique         2.21, 2.80 A)
 &rst
  ixpk= 1598, nxpk= 20, iat= 271,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 275, 276,
 &end
#
#    0 AMB  20-2:1599    19 ARG  HG-         4.50    (#   1599:20  Single Ambig)
 &rst
  ixpk= 1599, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 281, 282, 281, 282,
 igr2= 278, 279,
 &end
#
#    0 AMB  20-2:1600     0 AMB  20-1:1600   3.50    (#   1600:20  Double Ambig)
 &rst
  ixpk= 1600, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 281, 282, 281, 282,
 igr2= 278, 279, 278, 279,
 &end
#
#   12 ARG  HN           11 THR  HB          4.50    (#   1603:20  Unique         2.39, 2.46 A)
 &rst
  ixpk= 1603, nxpk= 20, iat= 164, 154, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 THR  HN           11 THR  HB          4.50    (#   1604:20  Unique         2.49, 2.59 A)
 &rst
  ixpk= 1604, nxpk= 20, iat= 150, 154, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 VAL  HA           11 THR  HB          3.50    (#   1605:20  Unique         2.53, 3.14 A)
 &rst
  ixpk= 1605, nxpk= 20, iat= 112, 154, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   11 THR  MG2          11 THR  HB          3.50    (#   1606:20  Unique         2.45, 2.67 A)
 &rst
  ixpk= 1606, nxpk= 20, iat=  -1, 154, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 156, 157, 158,
 &end
#
#   12 ARG  HD+          11 THR  MG2         5.50    (#   1607:20  Unique         3.22, 6.53 A)
 &rst
  ixpk= 1607, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 174, 175,
 igr2= 156, 157, 158,
 &end
#
#    0 AMB  20-2:1608     0 AMB  20-1:1608   4.50    (#   1608:20  Double Ambig)
 &rst
  ixpk= 1608, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1748, 188,1176,
 igr2=1193, 166,
 &end
#
#   80 LEU  MDX          12 ARG  HA          4.50    (#   1609:20  Unique         4.35, 6.19 A)
 &rst
  ixpk= 1609, nxpk= 20, iat=  -1, 166, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#    0 AMB  20-2:1611    13 ALA  MB          4.50    (#   1611:20  Single Ambig)
 &rst
  ixpk= 1611, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 164, 237,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:1612    13 ALA  MB          4.50    (#   1612:20  Single Ambig)
 &rst
  ixpk= 1612, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 202, 203, 202, 203,
 igr2= 192, 193, 194,
 &end
#
#   17 ALA  HA           16 THR  MG2         5.50    (#   1614:20  Unique         3.68, 4.90 A)
 &rst
  ixpk= 1614, nxpk= 20, iat= 253,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 243, 244, 245,
 &end
#
#   80 LEU  MDX          16 THR  MG2         6.50    (#   1615:20  Unique         2.32, 5.59 A)
 &rst
  ixpk= 1615, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
 igr1=1215,1216,1217,1219,1220,1221,
 igr2= 243, 244, 245,
 &end
#
#   17 ALA  HN           17 ALA  MB          3.50    (#   1616:20  Unique         2.42, 2.86 A)
 &rst
  ixpk= 1616, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 255, 256, 257,
 &end
#
#    0 AMB  20-2:1617     0 AMB  20-1:1617   4.50    (#   1617:20  Double Ambig)
 &rst
  ixpk= 1617, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 329, 198,
 igr2= 343, 344, 345, 255, 256, 257,
 &end
#
#   17 ALA  HN           18 ALA  MB          5.50    (#   1619:20  Unique         4.85, 5.50 A)
 &rst
  ixpk= 1619, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 265, 266, 267,
 &end
#
#   21 THR  HB           18 ALA  MB          5.50    (#   1620:20  Unique         4.39, 5.21 A)
 &rst
  ixpk= 1620, nxpk= 20, iat= 319,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 265, 266, 267,
 &end
#
#   14 ARG  HA           18 ALA  MB          5.50    (#   1621:20  Unique         4.93, 6.07 A)
 &rst
  ixpk= 1621, nxpk= 20, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 265, 266, 267,
 &end
#
#   15 GLU  HG+          18 ALA  MB          4.50    (#   1622:20  Unique         4.57, 6.19 A)
 &rst
  ixpk= 1622, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 229, 230,
 igr2= 265, 266, 267,
 &end
#
#   15 GLU  HB-          18 ALA  MB          5.50    (#   1623:20  Unique         4.59, 6.26 A)
 &rst
  ixpk= 1623, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 226, 227,
 igr2= 265, 266, 267,
 &end
#
#    0 AMB  20-2:1625     0 AMB  20-1:1625   4.50    (#   1625:20  Double Ambig)
 &rst
  ixpk= 1625, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 281, 282, 281, 282,
 igr2= 275, 276, 275, 276,
 &end
#
#   24 LEU  HB-          21 THR  HA          4.50    (#   1626:20  Unique         2.46, 3.02 A)
 &rst
  ixpk= 1626, nxpk= 20, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 353, 354,
 &end
#
#    0 AMB  20-2:1627    21 THR  HA          4.50    (#   1627:20  Single Ambig)
 &rst
  ixpk= 1627, nxpk= 20, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1973,1974, 356,
 &end
#
#   21 THR  HN           21 THR  HB          4.50    (#   1628:20  Unique         2.54, 2.68 A)
 &rst
  ixpk= 1628, nxpk= 20, iat= 315, 319, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   23 ALA  HN           22 ALA  HA          4.50    (#   1629:20  Unique         3.57, 3.58 A)
 &rst
  ixpk= 1629, nxpk= 20, iat= 339, 331, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 THR  HN           22 ALA  MB          5.50    (#   1630:20  Unique         5.00, 5.61 A)
 &rst
  ixpk= 1630, nxpk= 20, iat= 315,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 333, 334, 335,
 &end
#
#  130 TRP  HZ2          22 ALA  MB          6.50    (#   1632:20  Unique         7.12, 7.79 A)
 &rst
  ixpk= 1632, nxpk= 20, iat=1955,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 333, 334, 335,
 &end
#
#    3 TYR  HD            3 TYR  HB-         4.50    (#   1634:20  Unique         2.33, 3.08 A)
 &rst
  ixpk= 1634, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  39,  48,
 igr2=  35,  36,
 &end
#
#    3 TYR  HD            3 TYR  HB+         4.50    (#   1635:20  Unique         2.33, 3.08 A)
 &rst
  ixpk= 1635, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  39,  48,
 igr2=  35,  36,
 &end
#
#    3 TYR  HA            3 TYR  HB-         4.50    (#   1636:20  Unique         2.30, 2.48 A)
 &rst
  ixpk= 1636, nxpk= 20, iat=  33,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  35,  36,
 &end
#
#    3 TYR  HA            3 TYR  HB+         4.50    (#   1637:20  Unique         2.30, 2.48 A)
 &rst
  ixpk= 1637, nxpk= 20, iat=  33,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  35,  36,
 &end
#
#    6 GLU  HB+           6 GLU  HA          2.80    (#   1640:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 1640, nxpk= 20, iat=  -1,  85, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  87,  88,
 &end
#
#  114 ASN  HA            9 ALA  MB          3.50    (#   1641:20  Unique         2.20, 2.97 A)
 &rst
  ixpk= 1641, nxpk= 20, iat=1736,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 130, 131, 132,
 &end
#
#    0 AMB  20-2:1642     0 AMB  20-1:1642   4.50    (#   1642:20  Double Ambig)
 &rst
  ixpk= 1642, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1738,1739,  69,  70,  69,  70, 208, 209,
 igr2= 130, 131, 132, 192, 193, 194,
 &end
#
#    0 AMB  20-2:1643     0 AMB  20-1:1643   5.50    (#   1643:20  Double Ambig)
 &rst
  ixpk= 1643, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1168,1169,1168,1169,
 igr2= 130, 131, 132, 192, 193, 194,
 &end
#
#  114 ASN  HB+           9 ALA  MB          4.50    (#   1644:20  Unique         2.27, 3.83 A)
 &rst
  ixpk= 1644, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1738,1739,
 igr2= 130, 131, 132,
 &end
#
#    0 AMB  20-2:1645    13 ALA  MB          2.80    (#   1645:20  Single Ambig)
 &rst
  ixpk= 1645, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1215,1216,1217,1219,1220,1221,1824,1825,1826,1828,
      1829,1830,
 igr2= 192, 193, 194,
 &end
#
#   10 ASN  HB+          10 ASN  HA          2.80    (#   1646:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 1646, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 140, 141,
 &end
#
#    0 AMB  20-2:1647    10 ASN  HA          5.50    (#   1647:20  Single Ambig)
 &rst
  ixpk= 1647, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 128, 112,
 &end
#
#   10 ASN  HD2-         10 ASN  HA          3.50    (#   1648:20  Unique         3.06, 3.83 A)
 &rst
  ixpk= 1648, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 145, 146,
 &end
#
#   14 ARG  HN           13 ALA  MB          4.50    (#   1650:20  Unique         2.49, 3.41 A)
 &rst
  ixpk= 1650, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 192, 193, 194,
 &end
#
#   18 ALA  HN           14 ARG  HA          4.50    (#   1651:20  Unique         3.86, 4.16 A)
 &rst
  ixpk= 1651, nxpk= 20, iat= 261, 200, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 ALA  HA           14 ARG  HA          5.50    (#   1652:20  Unique         5.35, 5.51 A)
 &rst
  ixpk= 1652, nxpk= 20, iat= 253, 200, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1653    14 ARG  HA          3.50    (#   1653:20  Single Ambig)
 &rst
  ixpk= 1653, nxpk= 20, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 202, 203, 202, 203,
 &end
#
#   14 ARG  HN            0 AMB  20-1:1654   5.50    (#   1654:20  Single Ambig)
 &rst
  ixpk= 1654, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 208, 209, 208, 209,
 &end
#
#    0 AMB  20-2:1655    15 GLU  HA          6.50    (#   1655:20  Single Ambig)
 &rst
  ixpk= 1655, nxpk= 20, iat=  -1, 224, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 208, 209, 208, 209,
 &end
#
#   12 ARG  HD-          16 THR  MG2         6.50    (#   1658:20  Unique         6.85, 8.54 A)
 &rst
  ixpk= 1658, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 174, 175,
 igr2= 243, 244, 245,
 &end
#
#   80 LEU  HB-          16 THR  MG2         4.50    (#   1659:20  Unique         3.64, 5.44 A)
 &rst
  ixpk= 1659, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1210,1211,
 igr2= 243, 244, 245,
 &end
#
#   19 ARG  HB-          19 ARG  HA          3.50    (#   1661:20  Unique         2.44, 2.79 A)
 &rst
  ixpk= 1661, nxpk= 20, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 275, 276,
 &end
#
#   49 ILE  QD1          23 ALA  HA          4.50    (#   1663:20  Unique         4.03, 5.19 A)
 &rst
  ixpk= 1663, nxpk= 20, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 743, 744, 745,
 &end
#
#   24 LEU  HN           24 LEU  HG          4.50    (#   1665:20  Unique         4.42, 4.46 A)
 &rst
  ixpk= 1665, nxpk= 20, iat= 349, 356, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ILE  QD1          24 LEU  HG          4.50    (#   1666:20  Unique         2.61, 3.67 A)
 &rst
  ixpk= 1666, nxpk= 20, iat=  -1, 356, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 425, 426, 427,
 &end
#
#   24 LEU  HN           24 LEU  MDX         5.50    (#   1667:20  Unique         4.49, 5.12 A)
 &rst
  ixpk= 1667, nxpk= 20, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#   42 PHE  HD           24 LEU  MDX         6.50    (#   1668:20  Unique         7.40,10.32 A)
 &rst
  ixpk= 1668, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 626, 634,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#    0 AMB  20-2:1669    24 LEU  MDX         5.50    (#   1669:20  Single Ambig)
 &rst
  ixpk= 1669, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1959, 307,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#    0 AMB  20-2:1670    24 LEU  MDX         4.50    (#   1670:20  Single Ambig)
 &rst
  ixpk= 1670, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 595, 596, 597, 425, 426, 427,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#   28 ILE  HB           25 GLU  HA          3.50    (#   1671:20  Unique         2.52, 2.74 A)
 &rst
  ixpk= 1671, nxpk= 20, iat= 416, 370, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1672    25 GLU  HB-         3.50    (#   1672:20  Single Ambig)
 &rst
  ixpk= 1672, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 383,1955,
 igr2= 372, 373,
 &end
#
#   25 GLU  HA           25 GLU  HG-         4.50    (#   1673:20  Unique         2.35, 2.69 A)
 &rst
  ixpk= 1673, nxpk= 20, iat= 370,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 375, 376,
 &end
#
#   25 GLU  HA           25 GLU  HG+         4.50    (#   1674:20  Unique         2.35, 2.69 A)
 &rst
  ixpk= 1674, nxpk= 20, iat= 370,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 375, 376,
 &end
#
#    0 AMB  20-2:1675    25 GLU  HG-         4.50    (#   1675:20  Single Ambig)
 &rst
  ixpk= 1675, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1955, 383,
 igr2= 375, 376,
 &end
#
#    0 AMB  20-2:1676     0 AMB  20-1:1676   5.50    (#   1676:20  Double Ambig)
 &rst
  ixpk= 1676, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1955, 383,
 igr2= 375, 376, 375, 376,
 &end
#
#   25 GLU  HN           25 GLU  HG+         4.50    (#   1677:20  Unique         4.17, 4.45 A)
 &rst
  ixpk= 1677, nxpk= 20, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 375, 376,
 &end
#
#   25 GLU  HN           25 GLU  HG-         4.50    (#   1678:20  Unique         4.17, 4.45 A)
 &rst
  ixpk= 1678, nxpk= 20, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 375, 376,
 &end
#
#   26 LEU  HN           26 LEU  HB-         4.50    (#   1679:20  Unique         2.03, 2.41 A)
 &rst
  ixpk= 1679, nxpk= 20, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 387, 388,
 &end
#
#   27 ALA  HN           26 LEU  HB-         3.50    (#   1680:20  Unique         2.56, 3.37 A)
 &rst
  ixpk= 1680, nxpk= 20, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 387, 388,
 &end
#
#    0 AMB  20-2:1681     0 AMB  20-1:1681   5.50    (#   1681:20  Double Ambig)
 &rst
  ixpk= 1681, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1007,1008, 383,
 igr2= 985, 986, 987, 989, 990, 991, 392, 393, 394, 396,
       397, 398,
 &end
#
#   26 LEU  HA           26 LEU  MDX         3.50    (#   1684:20  Unique         2.53, 4.19 A)
 &rst
  ixpk= 1684, nxpk= 20, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 392, 393, 394, 396, 397, 398,
 &end
#
#    0 AMB  20-2:1685     0 AMB  20-1:1685   4.50    (#   1685:20  Double Ambig)
 &rst
  ixpk= 1685, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 453, 454, 453, 454,
 igr2= 392, 393, 394, 396, 397, 398, 985, 986, 987, 989,
       990, 991,
 &end
#
#    0 AMB  20-2:1686     0 AMB  20-1:1686   3.50    (#   1686:20  Double Ambig)
 &rst
  ixpk= 1686, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1016,1017, 447, 448,
 igr2= 985, 986, 987, 989, 990, 991, 392, 393, 394, 396,
       397, 398,
 &end
#
#    0 AMB  20-2:1687     0 AMB  20-1:1687   2.80    (#   1687:20  Double Ambig)
 &rst
  ixpk= 1687, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 983, 450, 451,
 igr2= 985, 986, 987, 989, 990, 991, 392, 393, 394, 396,
       397, 398,
 &end
#
#   26 LEU  HB-          26 LEU  MDX         2.80    (#   1688:20  Unique         2.35, 3.28 A)
 &rst
  ixpk= 1688, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 387, 388,
 igr2= 392, 393, 394, 396, 397, 398,
 &end
#
#    0 AMB  20-2:1690    26 LEU  MDY         3.50    (#   1690:20  Single Ambig)
 &rst
  ixpk= 1690, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 447, 448, 447, 448,
 igr2= 392, 393, 394, 396, 397, 398,
 &end
#
#   27 ALA  HN           27 ALA  MB          3.50    (#   1691:20  Unique         2.44, 2.87 A)
 &rst
  ixpk= 1691, nxpk= 20, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 406, 407, 408,
 &end
#
#   28 ILE  HN           27 ALA  MB          3.50    (#   1692:20  Unique         2.60, 3.54 A)
 &rst
  ixpk= 1692, nxpk= 20, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 406, 407, 408,
 &end
#
#   27 ALA  HA           27 ALA  MB          3.50    (#   1693:20  Unique         2.43, 2.65 A)
 &rst
  ixpk= 1693, nxpk= 20, iat= 404,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 406, 407, 408,
 &end
#
#   24 LEU  HA           27 ALA  MB          3.50    (#   1694:20  Unique         2.31, 3.12 A)
 &rst
  ixpk= 1694, nxpk= 20, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 406, 407, 408,
 &end
#
#   24 LEU  MDX          27 ALA  MB          2.80    (#   1696:20  Unique         2.43, 5.79 A)
 &rst
  ixpk= 1696, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 358, 359, 360, 362, 363, 364,
 igr2= 406, 407, 408,
 &end
#
#   38 VAL  MGX          27 ALA  MB          2.80    (#   1697:20  Unique         2.37, 4.94 A)
 &rst
  ixpk= 1697, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 565, 566, 567, 569, 570, 571,
 igr2= 406, 407, 408,
 &end
#
#   28 ILE  HB           28 ILE  HA          4.50    (#   1698:20  Unique         3.00, 3.04 A)
 &rst
  ixpk= 1698, nxpk= 20, iat= 416, 414, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1699    28 ILE  QG2         5.50    (#   1699:20  Single Ambig)
 &rst
  ixpk= 1699, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 412, 443,
 igr2= 418, 419, 420,
 &end
#
#    0 AMB  20-2:1701    28 ILE  QG2         5.50    (#   1701:20  Single Ambig)
 &rst
  ixpk= 1701, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 433, 481,
 igr2= 418, 419, 420,
 &end
#
#   28 ILE  HA           28 ILE  QG2         3.50    (#   1703:20  Unique         2.37, 3.21 A)
 &rst
  ixpk= 1703, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 418, 419, 420,
 &end
#
#    0 AMB  20-2:1704    28 ILE  QG2         6.50    (#   1704:20  Single Ambig)
 &rst
  ixpk= 1704, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1946,1947,1946,1947,
 igr2= 418, 419, 420,
 &end
#
#   25 GLU  HA           28 ILE  QG2         4.50    (#   1705:20  Unique         4.44, 5.08 A)
 &rst
  ixpk= 1705, nxpk= 20, iat= 370,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 418, 419, 420,
 &end
#
#  104 GLN  HG-          28 ILE  QG2         6.50    (#   1707:20  Unique         7.01, 8.85 A)
 &rst
  ixpk= 1707, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1581,1582,
 igr2= 418, 419, 420,
 &end
#
#   28 ILE  HB           28 ILE  QG2         3.50    (#   1708:20  Unique         2.43, 2.68 A)
 &rst
  ixpk= 1708, nxpk= 20, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 418, 419, 420,
 &end
#
#   28 ILE  QD1          28 ILE  QG2         2.80    (#   1710:20  Unique         2.25, 3.87 A)
 &rst
  ixpk= 1710, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 425, 426, 427,
 igr2= 418, 419, 420,
 &end
#
#   24 LEU  HB+          28 ILE  QD1         4.50    (#   1712:20  Unique         4.55, 5.99 A)
 &rst
  ixpk= 1712, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 353, 354,
 igr2= 425, 426, 427,
 &end
#
#  105 ILE  QG2          28 ILE  QD1         5.50    (#   1713:20  Unique         5.32, 7.08 A)
 &rst
  ixpk= 1713, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1597,1598,1599,
 igr2= 425, 426, 427,
 &end
#
#   99 ILE  QG2          28 ILE  QD1         3.50    (#   1715:20  Unique         2.18, 4.66 A)
 &rst
  ixpk= 1715, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1513,1514,1515,
 igr2= 425, 426, 427,
 &end
#
#   29 ASP  HB+          29 ASP  HA          3.50    (#   1717:20  Unique         2.37, 2.73 A)
 &rst
  ixpk= 1717, nxpk= 20, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 435, 436,
 &end
#
#   29 ASP  HB-          29 ASP  HA          2.80    (#   1718:20  Unique         2.37, 2.73 A)
 &rst
  ixpk= 1718, nxpk= 20, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 435, 436,
 &end
#
#    0 AMB  20-2:1719     0 AMB  20-1:1719   3.50    (#   1719:20  Double Ambig)
 &rst
  ixpk= 1719, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 483, 484, 485,1819,1820,
 igr2= 433, 138,
 &end
#
#   28 ILE  QG2          29 ASP  HA          4.50    (#   1720:20  Unique         3.57, 4.75 A)
 &rst
  ixpk= 1720, nxpk= 20, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 418, 419, 420,
 &end
#
#    0 AMB  20-2:1721     0 AMB  20-1:1721   3.50    (#   1721:20  Double Ambig)
 &rst
  ixpk= 1721, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 443,1086,
 igr2= 435, 436,1063,1064,
 &end
#
#    0 AMB  20-2:1722    29 ASP  HB-         4.50    (#   1722:20  Single Ambig)
 &rst
  ixpk= 1722, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 392, 393, 394, 396, 397, 398, 500, 501, 502, 504,
       505, 506,
 igr2= 435, 436,
 &end
#
#   26 LEU  MDX          29 ASP  HB+         5.50    (#   1723:20  Unique         3.56, 6.70 A)
 &rst
  ixpk= 1723, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 392, 393, 394, 396, 397, 398,
 igr2= 435, 436,
 &end
#
#    0 AMB  20-2:1725     0 AMB  20-1:1725   4.50    (#   1725:20  Double Ambig)
 &rst
  ixpk= 1725, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1371,1372, 999,1000,1075,1076,
 igr2= 653, 654, 653, 654,1063,1064,
 &end
#
#    0 AMB  20-2:1726     0 AMB  20-1:1726   5.50    (#   1726:20  Double Ambig)
 &rst
  ixpk= 1726, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 447, 448, 372, 373,
 igr2= 435, 436, 435, 436,
 &end
#
#    0 AMB  20-2:1727    30 ARG  HB-         3.50    (#   1727:20  Single Ambig)
 &rst
  ixpk= 1727, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 445, 514, 515,
 igr2= 447, 448,
 &end
#
#    0 AMB  20-2:1728    30 ARG  HB-         4.50    (#   1728:20  Single Ambig)
 &rst
  ixpk= 1728, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 565, 566, 567, 569, 570, 571, 772, 773, 774, 776,
       777, 778,
 igr2= 447, 448,
 &end
#
#    0 AMB  20-2:1729     0 AMB  20-1:1729   3.50    (#   1729:20  Double Ambig)
 &rst
  ixpk= 1729, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 445, 514, 515,
 igr2= 450, 451, 450, 451,
 &end
#
#   30 ARG  HD+          30 ARG  HG+         3.50    (#   1730:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 1730, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 453, 454,
 igr2= 450, 451,
 &end
#
#   30 ARG  HD+          30 ARG  HG-         4.50    (#   1732:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 1732, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 453, 454,
 igr2= 450, 451,
 &end
#
#   30 ARG  HD-          30 ARG  HG-         4.50    (#   1733:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 1733, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 453, 454,
 igr2= 450, 451,
 &end
#
#   31 ALA  MB           31 ALA  HA          5.50    (#   1734:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 1734, nxpk= 20, iat=  -1, 469, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 471, 472, 473,
 &end
#
#    0 AMB  20-2:1735    31 ALA  MB          4.50    (#   1735:20  Single Ambig)
 &rst
  ixpk= 1735, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 514, 515, 404,
 igr2= 471, 472, 473,
 &end
#
#    0 AMB  20-2:1736     0 AMB  20-1:1736   5.50    (#   1736:20  Double Ambig)
 &rst
  ixpk= 1736, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1892,1893,1894,1896,1897,1898, 418, 419, 420,
 igr2=2111, 481,
 &end
#
#    0 AMB  20-2:1737     0 AMB  20-1:1737   3.50    (#   1737:20  Double Ambig)
 &rst
  ixpk= 1737, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 477,2121,
 igr2= 481,2111,
 &end
#
#    0 AMB  20-2:1738    32 THR  HB          4.50    (#   1738:20  Single Ambig)
 &rst
  ixpk= 1738, nxpk= 20, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 491,1545,
 &end
#
#    0 AMB  20-2:1739    33 LEU  HA          3.50    (#   1739:20  Single Ambig)
 &rst
  ixpk= 1739, nxpk= 20, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 491, 510,
 &end
#
#   33 LEU  HB+          33 LEU  HA          3.50    (#   1741:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 1741, nxpk= 20, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 495, 496,
 &end
#
#   33 LEU  HG           33 LEU  HA          4.50    (#   1742:20  Unique         2.97, 3.14 A)
 &rst
  ixpk= 1742, nxpk= 20, iat= 498, 493, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   33 LEU  HB-          33 LEU  HA          2.80    (#   1743:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 1743, nxpk= 20, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 495, 496,
 &end
#
#   32 THR  MG2          33 LEU  HA          3.50    (#   1744:20  Unique         3.64, 4.69 A)
 &rst
  ixpk= 1744, nxpk= 20, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 483, 484, 485,
 &end
#
#   33 LEU  MDX          33 LEU  HA          3.50    (#   1745:20  Unique         2.15, 3.96 A)
 &rst
  ixpk= 1745, nxpk= 20, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 500, 501, 502, 504, 505, 506,
 &end
#
#    0 AMB  20-2:1746    33 LEU  HB-         5.50    (#   1746:20  Single Ambig)
 &rst
  ixpk= 1746, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 512, 433,
 igr2= 495, 496,
 &end
#
#    0 AMB  20-2:1747     0 AMB  20-1:1747   4.50    (#   1747:20  Double Ambig)
 &rst
  ixpk= 1747, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 512, 433,
 igr2= 495, 496, 495, 496,
 &end
#
#   30 ARG  HA           33 LEU  HB-         3.50    (#   1748:20  Unique         2.34, 3.43 A)
 &rst
  ixpk= 1748, nxpk= 20, iat= 445,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 495, 496,
 &end
#
#    0 AMB  20-2:1749     0 AMB  20-1:1749   4.50    (#   1749:20  Double Ambig)
 &rst
  ixpk= 1749, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 510, 491, 402,
 igr2= 500, 501, 502, 504, 505, 506, 392, 393, 394, 396,
       397, 398,
 &end
#
#    0 AMB  20-2:1750     0 AMB  20-1:1750   3.50    (#   1750:20  Double Ambig)
 &rst
  ixpk= 1750, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 493, 341,
 igr2= 500, 501, 502, 504, 505, 506, 392, 393, 394, 396,
       397, 398,
 &end
#
#   29 ASP  HB+          33 LEU  MDX         4.50    (#   1751:20  Unique         4.26, 6.80 A)
 &rst
  ixpk= 1751, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 435, 436,
 igr2= 500, 501, 502, 504, 505, 506,
 &end
#
#   88 LYS  HG-          88 LYS  HA          6.50    (#   1754:20  Unique         2.67, 3.85 A)
 &rst
  ixpk= 1754, nxpk= 20, iat=  -1,1344, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1349,1350,
 &end
#
#   88 LYS  HB+          88 LYS  HA          5.50    (#   1755:20  Unique         2.26, 2.43 A)
 &rst
  ixpk= 1755, nxpk= 20, iat=  -1,1344, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1346,1347,
 &end
#
#   88 LYS  HB-          88 LYS  HA          5.50    (#   1756:20  Unique         2.26, 2.43 A)
 &rst
  ixpk= 1756, nxpk= 20, iat=  -1,1344, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1346,1347,
 &end
#
#   38 VAL  HN           37 PRO  HA          4.50    (#   1757:20  Unique         2.18, 2.26 A)
 &rst
  ixpk= 1757, nxpk= 20, iat= 559, 555, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 PRO  HB-          37 PRO  HA          5.50    (#   1758:20  Unique         2.27, 2.70 A)
 &rst
  ixpk= 1758, nxpk= 20, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 552, 553,
 &end
#
#    0 AMB  20-2:1759    37 PRO  HA          5.50    (#   1759:20  Single Ambig)
 &rst
  ixpk= 1759, nxpk= 20, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 552, 553, 549, 550,
 &end
#
#    0 AMB  20-2:1760    37 PRO  HA          5.50    (#   1760:20  Single Ambig)
 &rst
  ixpk= 1760, nxpk= 20, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 563,1511, 532, 533,
 &end
#
#    0 AMB  20-2:1761     0 AMB  20-1:1761   5.50    (#   1761:20  Double Ambig)
 &rst
  ixpk= 1761, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 969, 970, 549, 550,
 igr2= 972, 555,
 &end
#
#   38 VAL  HN           37 PRO  HB-         4.50    (#   1762:20  Unique         2.84, 3.31 A)
 &rst
  ixpk= 1762, nxpk= 20, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 552, 553,
 &end
#
#   38 VAL  HN           37 PRO  HB+         4.50    (#   1763:20  Unique         2.84, 3.31 A)
 &rst
  ixpk= 1763, nxpk= 20, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 552, 553,
 &end
#
#   61 TRP  HH2          37 PRO  HB-         5.50    (#   1764:20  Unique         2.95, 3.83 A)
 &rst
  ixpk= 1764, nxpk= 20, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 552, 553,
 &end
#
#   61 TRP  HH2          37 PRO  HB+         5.50    (#   1765:20  Unique         2.95, 3.83 A)
 &rst
  ixpk= 1765, nxpk= 20, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 552, 553,
 &end
#
#   37 PRO  HA           37 PRO  HB-         3.50    (#   1766:20  Unique         2.27, 2.70 A)
 &rst
  ixpk= 1766, nxpk= 20, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 552, 553,
 &end
#
#   37 PRO  HA           37 PRO  HB+         3.50    (#   1767:20  Unique         2.27, 2.70 A)
 &rst
  ixpk= 1767, nxpk= 20, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 552, 553,
 &end
#
#   39 GLY  HN           38 VAL  MGX         4.50    (#   1768:20  Unique         2.29, 3.82 A)
 &rst
  ixpk= 1768, nxpk= 20, iat= 575,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   38 VAL  HN           38 VAL  MGX         5.50    (#   1769:20  Unique         2.39, 4.20 A)
 &rst
  ixpk= 1769, nxpk= 20, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   36 GLN  HN           38 VAL  MGX         6.50    (#   1770:20  Unique         4.66, 7.22 A)
 &rst
  ixpk= 1770, nxpk= 20, iat= 528,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   98 VAL  HA           38 VAL  MGX         6.50    (#   1773:20  Unique         4.91, 7.06 A)
 &rst
  ixpk= 1773, nxpk= 20, iat=1493,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  20-2:1774    38 VAL  MGX         4.50    (#   1774:20  Single Ambig)
 &rst
  ixpk= 1774, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 783, 784, 404,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  20-2:1775    38 VAL  MGX         4.50    (#   1775:20  Single Ambig)
 &rst
  ixpk= 1775, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 447, 448, 447, 448,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   51 VAL  MGX          38 VAL  MGX         3.50    (#   1776:20  Unique         2.31, 5.59 A)
 &rst
  ixpk= 1776, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 772, 773, 774, 776, 777, 778,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   39 GLY  HN           38 VAL  MGY         4.50    (#   1777:20  Unique         2.29, 3.82 A)
 &rst
  ixpk= 1777, nxpk= 20, iat= 575,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   38 VAL  HN           38 VAL  MGY         4.50    (#   1778:20  Unique         2.39, 4.20 A)
 &rst
  ixpk= 1778, nxpk= 20, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   31 ALA  HN           38 VAL  MGY         3.50    (#   1779:20  Unique         2.74, 4.46 A)
 &rst
  ixpk= 1779, nxpk= 20, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   36 GLN  HN           38 VAL  MGY         5.50    (#   1780:20  Unique         4.66, 7.22 A)
 &rst
  ixpk= 1780, nxpk= 20, iat= 528,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   31 ALA  HA           38 VAL  MGY         3.50    (#   1781:20  Unique         2.14, 4.32 A)
 &rst
  ixpk= 1781, nxpk= 20, iat= 469,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  20-2:1783    38 VAL  MGY         3.50    (#   1783:20  Single Ambig)
 &rst
  ixpk= 1783, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 783, 784, 404,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  20-2:1784     0 AMB  20-1:1784   4.50    (#   1784:20  Double Ambig)
 &rst
  ixpk= 1784, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 582,1669,
 igr2= 592, 593,1676,
 &end
#
#   40 ILE  HN           40 ILE  HG1+        5.50    (#   1785:20  Unique         2.78, 3.47 A)
 &rst
  ixpk= 1785, nxpk= 20, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 592, 593,
 &end
#
#   23 ALA  MB           40 ILE  QD1         6.50    (#   1786:20  Unique         2.79, 5.34 A)
 &rst
  ixpk= 1786, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.37, r4= 9.87,
 igr1= 343, 344, 345,
 igr2= 595, 596, 597,
 &end
#
#   40 ILE  QD1          40 ILE  QG2         3.50    (#   1787:20  Unique         2.23, 3.71 A)
 &rst
  ixpk= 1787, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 595, 596, 597,
 igr2= 588, 589, 590,
 &end
#
#   40 ILE  HG1+         40 ILE  QG2         4.50    (#   1788:20  Unique         2.55, 3.58 A)
 &rst
  ixpk= 1788, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 592, 593,
 igr2= 588, 589, 590,
 &end
#
#   40 ILE  HG1-         40 ILE  QG2         5.50    (#   1789:20  Unique         2.55, 3.58 A)
 &rst
  ixpk= 1789, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 592, 593,
 igr2= 588, 589, 590,
 &end
#
#   40 ILE  HB           40 ILE  QG2         4.50    (#   1790:20  Unique         2.44, 2.68 A)
 &rst
  ixpk= 1790, nxpk= 20, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 588, 589, 590,
 &end
#
#   20 PHE  HE           40 ILE  QG2         5.50    (#   1792:20  Unique         2.28, 5.94 A)
 &rst
  ixpk= 1792, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 305, 309,
 igr2= 588, 589, 590,
 &end
#
#   41 HIS  HN           40 ILE  QG2         4.50    (#   1793:20  Unique         2.60, 3.41 A)
 &rst
  ixpk= 1793, nxpk= 20, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 588, 589, 590,
 &end
#
#   44 ASP  HA            0 AMB  20-1:1794   2.80    (#   1794:20  Single Ambig)
 &rst
  ixpk= 1794, nxpk= 20, iat= 651,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 653, 654, 653, 654,
 &end
#
#    0 AMB  20-2:1795     0 AMB  20-1:1795   5.50    (#   1795:20  Double Ambig)
 &rst
  ixpk= 1795, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 999,1000,1075,1076, 447, 448,
 igr2=1063,1064, 435, 436,
 &end
#
#   45 SER  HB+          45 SER  HA          6.50    (#   1796:20  Unique         2.40, 2.57 A)
 &rst
  ixpk= 1796, nxpk= 20, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 665, 666,
 &end
#
#   45 SER  HN           45 SER  HB+         5.50    (#   1797:20  Unique         2.46, 3.33 A)
 &rst
  ixpk= 1797, nxpk= 20, iat= 661,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 665, 666,
 &end
#
#   45 SER  HA           45 SER  HB-         3.50    (#   1798:20  Unique         2.40, 2.57 A)
 &rst
  ixpk= 1798, nxpk= 20, iat= 663,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 665, 666,
 &end
#
#   45 SER  HA           45 SER  HB+         3.50    (#   1799:20  Unique         2.40, 2.57 A)
 &rst
  ixpk= 1799, nxpk= 20, iat= 663,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 665, 666,
 &end
#
#   73 GLN  HE2+         46 ALA  MB          5.50    (#   1800:20  Unique         5.88, 7.44 A)
 &rst
  ixpk= 1800, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1109,1110,
 igr2= 676, 677, 678,
 &end
#
#   46 ALA  HA           46 ALA  MB          3.50    (#   1801:20  Unique         2.42, 2.67 A)
 &rst
  ixpk= 1801, nxpk= 20, iat= 674,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 676, 677, 678,
 &end
#
#    0 AMB  20-2:1802    46 ALA  MB          5.50    (#   1802:20  Single Ambig)
 &rst
  ixpk= 1802, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1394,1395, 686, 687,
 igr2= 676, 677, 678,
 &end
#
#   73 GLN  HB-          46 ALA  MB          4.50    (#   1804:20  Unique         2.51, 5.05 A)
 &rst
  ixpk= 1804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1101,1102,
 igr2= 676, 677, 678,
 &end
#
#    0 AMB  20-2:1805    49 ILE  HB          3.50    (#   1805:20  Single Ambig)
 &rst
  ixpk= 1805, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 985, 986, 987, 989, 990, 991, 743, 744, 745,
 &end
#
#   49 ILE  QG2          49 ILE  HB          3.50    (#   1806:20  Unique         2.41, 2.67 A)
 &rst
  ixpk= 1806, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 736, 737, 738,
 &end
#
#   49 ILE  HN           49 ILE  HB          4.50    (#   1808:20  Unique         2.58, 2.70 A)
 &rst
  ixpk= 1808, nxpk= 20, iat= 730, 734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   23 ALA  HA           49 ILE  QD1         6.50    (#   1810:20  Unique         4.03, 5.19 A)
 &rst
  ixpk= 1810, nxpk= 20, iat= 341,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 743, 744, 745,
 &end
#
#   64 LEU  HA           49 ILE  QG2         5.50    (#   1812:20  Unique         4.54, 6.25 A)
 &rst
  ixpk= 1812, nxpk= 20, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 736, 737, 738,
 &end
#
#   50 MET  HA           50 MET  ME          6.50    (#   1813:20  Unique         3.88, 4.90 A)
 &rst
  ixpk= 1813, nxpk= 20, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 760, 761, 762,
 &end
#
#   61 TRP  HA           50 MET  ME          4.50    (#   1814:20  Unique         4.25, 5.43 A)
 &rst
  ixpk= 1814, nxpk= 20, iat= 924,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 760, 761, 762,
 &end
#
#   93 ASN  HA           50 MET  ME          4.50    (#   1815:20  Unique         3.41, 4.70 A)
 &rst
  ixpk= 1815, nxpk= 20, iat=1415,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 760, 761, 762,
 &end
#
#   63 PRO  HD+          50 MET  ME          4.50    (#   1816:20  Unique         2.69, 4.82 A)
 &rst
  ixpk= 1816, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 963, 964,
 igr2= 760, 761, 762,
 &end
#
#   61 TRP  HB-          50 MET  ME          4.50    (#   1817:20  Unique         2.14, 3.57 A)
 &rst
  ixpk= 1817, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 926, 927,
 igr2= 760, 761, 762,
 &end
#
#   93 ASN  HB-          50 MET  ME          5.50    (#   1819:20  Unique         4.45, 6.61 A)
 &rst
  ixpk= 1819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1417,1418,
 igr2= 760, 761, 762,
 &end
#
#   50 MET  HB-          50 MET  ME          5.50    (#   1820:20  Unique         2.25, 3.75 A)
 &rst
  ixpk= 1820, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 753, 754,
 igr2= 760, 761, 762,
 &end
#
#   52 PRO  HD+          51 VAL  MGX         4.50    (#   1822:20  Unique         2.05, 4.47 A)
 &rst
  ixpk= 1822, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 783, 784,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   52 PRO  HD-          51 VAL  MGX         4.50    (#   1823:20  Unique         2.05, 4.47 A)
 &rst
  ixpk= 1823, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 783, 784,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   62 VAL  HB           51 VAL  MGX         4.50    (#   1824:20  Unique         2.26, 5.00 A)
 &rst
  ixpk= 1824, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   52 PRO  HD-          51 VAL  MGY         4.50    (#   1826:20  Unique         2.05, 4.47 A)
 &rst
  ixpk= 1826, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 783, 784,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   52 PRO  HB+          52 PRO  HA          4.50    (#   1827:20  Unique         2.26, 2.66 A)
 &rst
  ixpk= 1827, nxpk= 20, iat=  -1, 792, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 789, 790,
 &end
#
#   52 PRO  HB-          52 PRO  HA          4.50    (#   1828:20  Unique         2.26, 2.66 A)
 &rst
  ixpk= 1828, nxpk= 20, iat=  -1, 792, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 789, 790,
 &end
#
#   61 TRP  HA           52 PRO  HA          4.50    (#   1829:20  Unique         2.96, 3.34 A)
 &rst
  ixpk= 1829, nxpk= 20, iat= 924, 792, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 THR  HN           54 LYS  HA          3.50    (#   1838:20  Unique         3.43, 3.50 A)
 &rst
  ixpk= 1838, nxpk= 20, iat= 825, 805, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:1839    54 LYS  HA          3.50    (#   1839:20  Single Ambig)
 &rst
  ixpk= 1839, nxpk= 20, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 810, 811, 810, 811,
 &end
#
#   54 LYS  HD+          54 LYS  HA          4.50    (#   1840:20  Unique         2.25, 4.27 A)
 &rst
  ixpk= 1840, nxpk= 20, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 813, 814,
 &end
#
#   54 LYS  HA            0 AMB  20-1:1841   4.50    (#   1841:20  Single Ambig)
 &rst
  ixpk= 1841, nxpk= 20, iat= 805,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 810, 811, 810, 811,
 &end
#
#    0 AMB  20-2:1842     0 AMB  20-1:1842   4.50    (#   1842:20  Double Ambig)
 &rst
  ixpk= 1842, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 816, 817, 816, 817,
 igr2= 810, 811, 810, 811,
 &end
#
#   54 LYS  HA           54 LYS  HD+         5.50    (#   1843:20  Unique         2.25, 4.27 A)
 &rst
  ixpk= 1843, nxpk= 20, iat= 805,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 813, 814,
 &end
#
#   54 LYS  HE+          54 LYS  HD+         3.50    (#   1844:20  Unique         2.36, 2.76 A)
 &rst
  ixpk= 1844, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 816, 817,
 igr2= 813, 814,
 &end
#
#    0 AMB  20-2:1845     0 AMB  20-1:1845   2.80    (#   1845:20  Double Ambig)
 &rst
  ixpk= 1845, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 810, 811, 810, 811,
 igr2= 813, 814, 813, 814,
 &end
#
#    0 AMB  20-2:1846     0 AMB  20-1:1846   4.50    (#   1846:20  Double Ambig)
 &rst
  ixpk= 1846, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 810, 811, 810, 811,
 igr2= 816, 817, 816, 817,
 &end
#
#   54 LYS  HD+          54 LYS  HE+         3.50    (#   1847:20  Unique         2.36, 2.76 A)
 &rst
  ixpk= 1847, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 813, 814,
 igr2= 816, 817,
 &end
#
#    0 AMB  20-2:1848    55 THR  HB          3.50    (#   1848:20  Single Ambig)
 &rst
  ixpk= 1848, nxpk= 20, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 835, 831, 832, 833,
 &end
#
#   57 SER  HB+          55 THR  HB          4.50    (#   1849:20  Unique         4.04, 5.37 A)
 &rst
  ixpk= 1849, nxpk= 20, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 857, 858,
 &end
#
#    0 AMB  20-2:1851    55 THR  MG2         4.50    (#   1851:20  Single Ambig)
 &rst
  ixpk= 1851, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 908, 909, 908, 909,
 igr2= 831, 832, 833,
 &end
#
#    0 AMB  20-2:1852    55 THR  MG2         4.50    (#   1852:20  Single Ambig)
 &rst
  ixpk= 1852, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 857, 858, 840, 841,
 igr2= 831, 832, 833,
 &end
#
#   54 LYS  HA           55 THR  MG2         5.50    (#   1853:20  Unique         4.75, 6.27 A)
 &rst
  ixpk= 1853, nxpk= 20, iat= 805,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 831, 832, 833,
 &end
#
#   55 THR  HB           55 THR  MG2         3.50    (#   1854:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 1854, nxpk= 20, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 831, 832, 833,
 &end
#
#  122 LEU  HA          135 THR  MG2         5.50    (#   1855:20  Unique         4.07, 5.27 A)
 &rst
  ixpk= 1855, nxpk= 20, iat=1836,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2034,2035,2036,
 &end
#
#   56 PRO  HB-          56 PRO  HA          3.50    (#   1856:20  Unique         2.27, 2.53 A)
 &rst
  ixpk= 1856, nxpk= 20, iat=  -1, 849, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 846, 847,
 &end
#
#   56 PRO  HB+          56 PRO  HA          3.50    (#   1857:20  Unique         2.27, 2.53 A)
 &rst
  ixpk= 1857, nxpk= 20, iat=  -1, 849, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 846, 847,
 &end
#
#   36 GLN  HB-          56 PRO  HA          3.50    (#   1858:20  Unique         2.28, 3.25 A)
 &rst
  ixpk= 1858, nxpk= 20, iat=  -1, 849, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 532, 533,
 &end
#
#    0 AMB  20-2:1859    56 PRO  HA          4.50    (#   1859:20  Single Ambig)
 &rst
  ixpk= 1859, nxpk= 20, iat=  -1, 849, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 843, 844, 843, 844,
 &end
#
#   43 SER  HA           89 PRO  HB-         5.50    (#   1860:20  Unique         2.42, 4.07 A)
 &rst
  ixpk= 1860, nxpk= 20, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1371,1372,
 &end
#
#    0 AMB  20-2:1861    56 PRO  HD-         5.50    (#   1861:20  Single Ambig)
 &rst
  ixpk= 1861, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 835, 831, 832, 833,
 igr2= 840, 841,
 &end
#
#    0 AMB  20-2:1862     0 AMB  20-1:1862   5.50    (#   1862:20  Double Ambig)
 &rst
  ixpk= 1862, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 835, 831, 832, 833,
 igr2= 840, 841, 840, 841,
 &end
#
#   55 THR  HB           56 PRO  HD+         4.50    (#   1863:20  Unique         2.74, 4.18 A)
 &rst
  ixpk= 1863, nxpk= 20, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 840, 841,
 &end
#
#   55 THR  HB           56 PRO  HD-         4.50    (#   1864:20  Unique         2.74, 4.18 A)
 &rst
  ixpk= 1864, nxpk= 20, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 840, 841,
 &end
#
#   59 TRP  HN           58 ALA  HA          4.50    (#   1865:20  Unique         2.29, 2.59 A)
 &rst
  ixpk= 1865, nxpk= 20, iat= 874, 866, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 ALA  MB           58 ALA  HA          3.50    (#   1866:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 1866, nxpk= 20, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 868, 869, 870,
 &end
#
#   61 TRP  HN           60 ARG  HA          4.50    (#   1867:20  Unique         2.11, 2.22 A)
 &rst
  ixpk= 1867, nxpk= 20, iat= 922, 900, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1868    60 ARG  HA          3.50    (#   1868:20  Single Ambig)
 &rst
  ixpk= 1868, nxpk= 20, iat=  -1, 900, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 902, 903, 902, 903,
 &end
#
#    0 AMB  20-2:1869     0 AMB  20-1:1869   2.80    (#   1869:20  Double Ambig)
 &rst
  ixpk= 1869, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 905, 906, 905, 906, 905, 906,
 igr2= 902, 903, 902, 903, 902, 903,
 &end
#
#    0 AMB  20-2:1870    60 ARG  HB-         4.50    (#   1870:20  Single Ambig)
 &rst
  ixpk= 1870, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 908, 909, 908, 909,
 igr2= 902, 903,
 &end
#
#    0 AMB  20-2:1871     0 AMB  20-1:1871   4.50    (#   1871:20  Double Ambig)
 &rst
  ixpk= 1871, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 908, 909, 908, 909, 908, 909,
 igr2= 902, 903, 902, 903, 902, 903,
 &end
#
#   61 TRP  HN           60 ARG  HB+         4.50    (#   1872:20  Unique         3.63, 4.14 A)
 &rst
  ixpk= 1872, nxpk= 20, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 902, 903,
 &end
#
#   61 TRP  HA           61 TRP  HB-         5.50    (#   1873:20  Unique         2.50, 2.78 A)
 &rst
  ixpk= 1873, nxpk= 20, iat= 924,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 926, 927,
 &end
#
#   62 VAL  MGY          62 VAL  HB          3.50    (#   1874:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 1874, nxpk= 20, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 952, 953, 954, 956, 957, 958,
 &end
#
#   62 VAL  MGX          62 VAL  HB          3.50    (#   1875:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 1875, nxpk= 20, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 952, 953, 954, 956, 957, 958,
 &end
#
#    0 AMB  20-2:1877    94 GLN  HG-         4.50    (#   1877:20  Single Ambig)
 &rst
  ixpk= 1877, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1465,1466,1465,1466,
 igr2=1434,1435,
 &end
#
#   87 PHE  HB-           0 AMB  20-1:1878   5.50    (#   1878:20  Single Ambig)
 &rst
  ixpk= 1878, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1326,1327,
 igr2=1315,1316,1315,1316,1434,1435,
 &end
#
#   62 VAL  HA           62 VAL  HB          3.50    (#   1879:20  Unique         2.41, 2.96 A)
 &rst
  ixpk= 1879, nxpk= 20, iat= 948, 950, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 VAL  HN           62 VAL  MGX         5.50    (#   1881:20  Unique         2.56, 4.17 A)
 &rst
  ixpk= 1881, nxpk= 20, iat= 946,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   62 VAL  HA           62 VAL  MGX         3.50    (#   1882:20  Unique         2.41, 3.23 A)
 &rst
  ixpk= 1882, nxpk= 20, iat= 948,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   63 PRO  HD+          62 VAL  MGX         3.50    (#   1883:20  Unique         2.30, 4.54 A)
 &rst
  ixpk= 1883, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 963, 964,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   62 VAL  HB           62 VAL  MGX         3.50    (#   1884:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 1884, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#    0 AMB  20-2:1885    62 VAL  MGX         3.50    (#   1885:20  Single Ambig)
 &rst
  ixpk= 1885, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 905, 906, 905, 906,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#    0 AMB  20-2:1886    62 VAL  MGX         5.50    (#   1886:20  Single Ambig)
 &rst
  ixpk= 1886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 908, 909, 908, 909,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   62 VAL  HB           62 VAL  MGY         3.50    (#   1888:20  Unique         2.40, 2.66 A)
 &rst
  ixpk= 1888, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   62 VAL  HN           62 VAL  MGY         4.50    (#   1889:20  Unique         2.56, 4.17 A)
 &rst
  ixpk= 1889, nxpk= 20, iat= 946,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   62 VAL  HA           62 VAL  MGY         4.50    (#   1890:20  Unique         2.41, 3.23 A)
 &rst
  ixpk= 1890, nxpk= 20, iat= 948,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   51 VAL  HN           62 VAL  MGY         4.50    (#   1891:20  Unique         3.10, 5.50 A)
 &rst
  ixpk= 1891, nxpk= 20, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   63 PRO  HD+          62 VAL  MGY         4.50    (#   1893:20  Unique         2.30, 4.54 A)
 &rst
  ixpk= 1893, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 963, 964,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   63 PRO  HA           63 PRO  HB+         4.50    (#   1894:20  Unique         2.29, 2.59 A)
 &rst
  ixpk= 1894, nxpk= 20, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 969, 970,
 &end
#
#   63 PRO  HD+          63 PRO  HB+         3.50    (#   1895:20  Unique         2.77, 3.67 A)
 &rst
  ixpk= 1895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 963, 964,
 igr2= 969, 970,
 &end
#
#    0 AMB  20-2:1899     0 AMB  20-1:1899   3.50    (#   1899:20  Double Ambig)
 &rst
  ixpk= 1899, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1315,1316,1315,1316, 950,
 igr2=1309,1310,1309,1310, 963, 964,
 &end
#
#   64 LEU  HA           64 LEU  HB+         4.50    (#   1901:20  Unique         2.33, 2.74 A)
 &rst
  ixpk= 1901, nxpk= 20, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 980, 981,
 &end
#
#    0 AMB  20-2:1902    64 LEU  HB-         4.50    (#   1902:20  Single Ambig)
 &rst
  ixpk= 1902, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 995, 976,
 igr2= 980, 981,
 &end
#
#   65 GLN  HN           64 LEU  MDX         4.50    (#   1903:20  Unique         2.62, 5.14 A)
 &rst
  ixpk= 1903, nxpk= 20, iat= 995,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#   64 LEU  HB+          64 LEU  MDY         3.50    (#   1905:20  Unique         2.34, 3.40 A)
 &rst
  ixpk= 1905, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 980, 981,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#    0 AMB  20-2:1906    64 LEU  MDY         3.50    (#   1906:20  Single Ambig)
 &rst
  ixpk= 1906, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 983, 450, 451,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#    0 AMB  20-2:1907    64 LEU  MDY         3.50    (#   1907:20  Single Ambig)
 &rst
  ixpk= 1907, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 980, 981, 450, 451,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#   66 GLU  HB+          64 LEU  MDY         4.50    (#   1908:20  Unique         2.39, 6.97 A)
 &rst
  ixpk= 1908, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1016,1017,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#    0 AMB  20-2:1909    64 LEU  MDY         5.50    (#   1909:20  Single Ambig)
 &rst
  ixpk= 1909, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 447, 448, 999,1000,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#    0 AMB  20-2:1910    64 LEU  MDY         4.50    (#   1910:20  Single Ambig)
 &rst
  ixpk= 1910, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1019,1020,1019,1020,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#   64 LEU  HA           64 LEU  MDY         4.50    (#   1911:20  Unique         2.22, 3.90 A)
 &rst
  ixpk= 1911, nxpk= 20, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#   65 GLN  HN           64 LEU  MDY         5.50    (#   1912:20  Unique         2.62, 5.14 A)
 &rst
  ixpk= 1912, nxpk= 20, iat= 995,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 985, 986, 987, 989, 990, 991,
 &end
#
#   65 GLN  HN           65 GLN  HG+         4.50    (#   1913:20  Unique         2.24, 3.71 A)
 &rst
  ixpk= 1913, nxpk= 20, iat= 995,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1002,1003,
 &end
#
#   67 ASP  HA           66 GLU  HA          5.50    (#   1915:20  Unique         4.27, 4.53 A)
 &rst
  ixpk= 1915, nxpk= 20, iat=1029,1014, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1916     0 AMB  20-1:1916   2.80    (#   1916:20  Double Ambig)
 &rst
  ixpk= 1916, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1075,1076,1075,1076,
 igr2=1078,1079,1078,1079,
 &end
#
#   65 GLN  HA           68 ALA  MB          4.50    (#   1918:20  Unique         2.32, 4.06 A)
 &rst
  ixpk= 1918, nxpk= 20, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1043,1044,1045,
 &end
#
#   67 ASP  HA           69 ALA  HA          5.50    (#   1919:20  Unique         5.08, 5.47 A)
 &rst
  ixpk= 1919, nxpk= 20, iat=1029,1051, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 ASP  HB+          69 ALA  HA          5.50    (#   1920:20  Unique         4.13, 5.09 A)
 &rst
  ixpk= 1920, nxpk= 20, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1063,1064,
 &end
#
#    0 AMB  20-2:1921    69 ALA  MB          3.50    (#   1921:20  Single Ambig)
 &rst
  ixpk= 1921, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1059,1049,
 igr2=1053,1054,1055,
 &end
#
#    0 AMB  20-2:1922    69 ALA  MB          3.50    (#   1922:20  Single Ambig)
 &rst
  ixpk= 1922, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1051,1088,
 igr2=1053,1054,1055,
 &end
#
#    0 AMB  20-2:1923     0 AMB  20-1:1923   3.50    (#   1923:20  Double Ambig)
 &rst
  ixpk= 1923, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 999,1000,1016,1017,1075,1076,
 igr2=1073,1014,
 &end
#
#    0 AMB  20-2:1924     0 AMB  20-1:1924   3.50    (#   1924:20  Double Ambig)
 &rst
  ixpk= 1924, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 999,1000,1016,1017,
 igr2=1073,1014,
 &end
#
#    0 AMB  20-2:1925     0 AMB  20-1:1925   3.50    (#   1925:20  Double Ambig)
 &rst
  ixpk= 1925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=1002,1003,1078,1079,1078,1079,1019,1020,1019,1020,
      
 igr2=1073,1014,
 &end
#
#   72 SER  HN           71 GLU  HA          3.50    (#   1926:20  Unique         2.14, 2.72 A)
 &rst
  ixpk= 1926, nxpk= 20, iat=1086,1073, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   71 GLU  HN            0 AMB  20-1:1927   4.50    (#   1927:20  Single Ambig)
 &rst
  ixpk= 1927, nxpk= 20, iat=1071,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1078,1079,1078,1079,
 &end
#
#   72 SER  HB+          72 SER  HA          3.50    (#   1928:20  Unique         2.36, 2.50 A)
 &rst
  ixpk= 1928, nxpk= 20, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1090,1091,
 &end
#
#   72 SER  HN           72 SER  HB+         4.50    (#   1929:20  Unique         2.45, 3.21 A)
 &rst
  ixpk= 1929, nxpk= 20, iat=1086,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1090,1091,
 &end
#
#   72 SER  HN           72 SER  HB-         4.50    (#   1930:20  Unique         2.45, 3.21 A)
 &rst
  ixpk= 1930, nxpk= 20, iat=1086,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1090,1091,
 &end
#
#   73 GLN  HN           73 GLN  HA          4.50    (#   1931:20  Unique         2.80, 2.88 A)
 &rst
  ixpk= 1931, nxpk= 20, iat=1097,1099, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 ASN  HN           73 GLN  HA          3.50    (#   1932:20  Unique         2.09, 2.21 A)
 &rst
  ixpk= 1932, nxpk= 20, iat=1114,1099, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   73 GLN  HG-          73 GLN  HA          4.50    (#   1933:20  Unique         3.66, 3.92 A)
 &rst
  ixpk= 1933, nxpk= 20, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1104,1105,
 &end
#
#   64 LEU  HB-          64 LEU  HA          2.80    (#   1935:20  Unique         2.33, 2.74 A)
 &rst
  ixpk= 1935, nxpk= 20, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 980, 981,
 &end
#
#   79 GLU  HG+          79 GLU  HA          3.50    (#   1939:20  Unique         2.45, 3.50 A)
 &rst
  ixpk= 1939, nxpk= 20, iat=  -1,1193, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1198,1199,
 &end
#
#   92 SER  HB-          88 LYS  HD-         4.50    (#   1940:20  Unique         3.77, 5.90 A)
 &rst
  ixpk= 1940, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1406,1407,
 igr2=1352,1353,
 &end
#
#    9 ALA  HA           79 GLU  HG+         5.50    (#   1941:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 1941, nxpk= 20, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1198,1199,
 &end
#
#   79 GLU  HN           79 GLU  HG-         6.50    (#   1942:20  Unique         2.36, 3.83 A)
 &rst
  ixpk= 1942, nxpk= 20, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1198,1199,
 &end
#
#   79 GLU  HN           79 GLU  HG+         6.50    (#   1943:20  Unique         2.36, 3.83 A)
 &rst
  ixpk= 1943, nxpk= 20, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1198,1199,
 &end
#
#    0 AMB  20-2:1944    80 LEU  HG          4.50    (#   1944:20  Single Ambig)
 &rst
  ixpk= 1944, nxpk= 20, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 188,1748,
 &end
#
#   80 LEU  HN           80 LEU  HG          6.50    (#   1945:20  Unique         2.75, 3.48 A)
 &rst
  ixpk= 1945, nxpk= 20, iat=1206,1213, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   16 THR  HB           80 LEU  HG          5.50    (#   1946:20  Unique         3.19, 4.65 A)
 &rst
  ixpk= 1946, nxpk= 20, iat= 241,1213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ALA  HA           80 LEU  HG          5.50    (#   1947:20  Unique         2.94, 3.99 A)
 &rst
  ixpk= 1947, nxpk= 20, iat= 190,1213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 ASP  HB+          80 LEU  HG          4.50    (#   1948:20  Unique         2.13, 3.11 A)
 &rst
  ixpk= 1948, nxpk= 20, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1168,1169,
 &end
#
#    0 AMB  20-2:1949    80 LEU  HG          3.50    (#   1949:20  Single Ambig)
 &rst
  ixpk= 1949, nxpk= 20, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1210,1211, 168, 169,
 &end
#
#   80 LEU  HB+          80 LEU  HG          3.50    (#   1952:20  Unique         2.30, 2.65 A)
 &rst
  ixpk= 1952, nxpk= 20, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1210,1211,
 &end
#
#   80 LEU  MDX          80 LEU  HG          2.80    (#   1953:20  Unique         2.36, 2.65 A)
 &rst
  ixpk= 1953, nxpk= 20, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#   82 ILE  QD1          80 LEU  HG          5.50    (#   1954:20  Unique         4.04, 5.15 A)
 &rst
  ixpk= 1954, nxpk= 20, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1249,1250,1251,
 &end
#
#   17 ALA  HA          124 LEU  MDX         4.50    (#   1956:20  Unique         2.33, 4.12 A)
 &rst
  ixpk= 1956, nxpk= 20, iat= 253,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#   82 ILE  HN           81 SER  HA          6.50    (#   1957:20  Unique         2.15, 2.22 A)
 &rst
  ixpk= 1957, nxpk= 20, iat=1236,1227, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  20-2:1958    81 SER  HA          5.50    (#   1958:20  Single Ambig)
 &rst
  ixpk= 1958, nxpk= 20, iat=  -1,1227, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1229,1230,1229,1230,
 &end
#
#  113 ALA  HN            0 AMB  20-1:1959   5.50    (#   1959:20  Single Ambig)
 &rst
  ixpk= 1959, nxpk= 20, iat=1724,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1229,1230,1229,1230,
 &end
#
#   81 SER  HN            0 AMB  20-1:1960   3.50    (#   1960:20  Single Ambig)
 &rst
  ixpk= 1960, nxpk= 20, iat=1225,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1229,1230,1229,1230,
 &end
#
#   82 ILE  HN            0 AMB  20-1:1961   4.50    (#   1961:20  Single Ambig)
 &rst
  ixpk= 1961, nxpk= 20, iat=1236,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1229,1230,1229,1230,
 &end
#
#   80 LEU  HA            0 AMB  20-1:1962   5.50    (#   1962:20  Single Ambig)
 &rst
  ixpk= 1962, nxpk= 20, iat=1208,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1229,1230,1229,1230,
 &end
#
#   81 SER  HA            0 AMB  20-1:1963   3.50    (#   1963:20  Single Ambig)
 &rst
  ixpk= 1963, nxpk= 20, iat=1227,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1229,1230,1229,1230,
 &end
#
#    0 AMB  20-2:1964     0 AMB  20-1:1964   5.50    (#   1964:20  Double Ambig)
 &rst
  ixpk= 1964, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1736, 674,
 igr2=1229,1230,1229,1230,1229,1230,
 &end
#
#    0 AMB  20-2:1965     0 AMB  20-1:1965   3.50    (#   1965:20  Double Ambig)
 &rst
  ixpk= 1965, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1750, 665, 666,
 igr2=1229,1230,1229,1230,
 &end
#
#  113 ALA  MB            0 AMB  20-1:1966   3.50    (#   1966:20  Single Ambig)
 &rst
  ixpk= 1966, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1728,1729,1730,
 igr2=1229,1230,1229,1230,
 &end
#
#  115 ALA  MB            0 AMB  20-1:1967   3.50    (#   1967:20  Single Ambig)
 &rst
  ixpk= 1967, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1752,1753,1754,
 igr2=1229,1230,1229,1230,
 &end
#
#    0 AMB  20-2:1969    82 ILE  QD1         5.50    (#   1969:20  Single Ambig)
 &rst
  ixpk= 1969, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 255, 256, 257,1838,1839,1874,
 igr2=1249,1250,1251,
 &end
#
#   84 LEU  HN           83 HIS  HB+         6.50    (#   1970:20  Unique         2.68, 3.74 A)
 &rst
  ixpk= 1970, nxpk= 20, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1259,1260,
 &end
#
#   83 HIS  HN           83 HIS  HB-         4.50    (#   1971:20  Unique         2.59, 3.30 A)
 &rst
  ixpk= 1971, nxpk= 20, iat=1255,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1259,1260,
 &end
#
#  111 LEU  HB-          83 HIS  HB+         4.50    (#   1974:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 1974, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1692,1693,
 igr2=1259,1260,
 &end
#
#  111 LEU  HB-          83 HIS  HB-         4.50    (#   1975:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 1975, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1692,1693,
 igr2=1259,1260,
 &end
#
#  111 LEU  MDY          83 HIS  HB+         4.50    (#   1976:20  Unique         2.54, 5.15 A)
 &rst
  ixpk= 1976, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=1259,1260,
 &end
#
#  111 LEU  MDY          83 HIS  HB-         4.50    (#   1977:20  Unique         2.54, 5.15 A)
 &rst
  ixpk= 1977, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=1259,1260,
 &end
#
#   84 LEU  HN           84 LEU  MDX         4.50    (#   1978:20  Unique         2.64, 5.13 A)
 &rst
  ixpk= 1978, nxpk= 20, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  HN           84 LEU  MDY         5.50    (#   1979:20  Unique         2.64, 5.13 A)
 &rst
  ixpk= 1979, nxpk= 20, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#  108 PHE  HD           84 LEU  MDY         5.50    (#   1980:20  Unique         2.31, 5.23 A)
 &rst
  ixpk= 1980, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1646,1654,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   42 PHE  HD           84 LEU  MDY         4.50    (#   1981:20  Unique         2.41, 5.05 A)
 &rst
  ixpk= 1981, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 626, 634,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   87 PHE  HZ           84 LEU  MDY         6.50    (#   1982:20  Unique         3.56, 7.99 A)
 &rst
  ixpk= 1982, nxpk= 20, iat=1334,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:1983    84 LEU  MDY         4.50    (#   1983:20  Single Ambig)
 &rst
  ixpk= 1983, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 620, 603,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  HA           84 LEU  MDY         4.50    (#   1984:20  Unique         2.18, 3.80 A)
 &rst
  ixpk= 1984, nxpk= 20, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   42 PHE  HB-          84 LEU  MDY         4.50    (#   1985:20  Unique         2.21, 4.42 A)
 &rst
  ixpk= 1985, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 622, 623,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:1986    84 LEU  MDY         4.50    (#   1986:20  Single Ambig)
 &rst
  ixpk= 1986, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 622, 623,1465,1466,1465,1466,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   85 GLN  HN            0 AMB  20-1:1988   4.50    (#   1988:20  Single Ambig)
 &rst
  ixpk= 1988, nxpk= 20, iat=1291,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1298,1299,1298,1299,
 &end
#
#   85 GLN  HE2-          0 AMB  20-1:1989   4.50    (#   1989:20  Single Ambig)
 &rst
  ixpk= 1989, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1303,1304,
 igr2=1298,1299,1298,1299,
 &end
#
#   85 GLN  HA            0 AMB  20-1:1990   3.50    (#   1990:20  Single Ambig)
 &rst
  ixpk= 1990, nxpk= 20, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1298,1299,1298,1299,
 &end
#
#   86 PRO  HA            0 AMB  20-1:1991   6.50    (#   1991:20  Single Ambig)
 &rst
  ixpk= 1991, nxpk= 20, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr2=1298,1299,1298,1299,
 &end
#
#   88 LYS  HN           88 LYS  HB-         4.50    (#   1994:20  Unique         2.36, 3.11 A)
 &rst
  ixpk= 1994, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1346,1347,
 &end
#
#   88 LYS  HN           88 LYS  HB+         4.50    (#   1995:20  Unique         2.36, 3.11 A)
 &rst
  ixpk= 1995, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1346,1347,
 &end
#
#   88 LYS  HA           88 LYS  HB+         4.50    (#   1996:20  Unique         2.26, 2.43 A)
 &rst
  ixpk= 1996, nxpk= 20, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1346,1347,
 &end
#
#   88 LYS  HA           88 LYS  HB-         3.50    (#   1997:20  Unique         2.26, 2.43 A)
 &rst
  ixpk= 1997, nxpk= 20, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1346,1347,
 &end
#
#   88 LYS  HN           88 LYS  HG+         5.50    (#   1999:20  Unique         1.93, 3.09 A)
 &rst
  ixpk= 1999, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1349,1350,
 &end
#
#   88 LYS  HN           88 LYS  HG-         5.50    (#   2000:20  Unique         1.93, 3.09 A)
 &rst
  ixpk= 2000, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1349,1350,
 &end
#
#   88 LYS  HA           88 LYS  HG+         4.50    (#   2001:20  Unique         2.67, 3.85 A)
 &rst
  ixpk= 2001, nxpk= 20, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1349,1350,
 &end
#
#   88 LYS  HA           88 LYS  HG-         4.50    (#   2002:20  Unique         2.67, 3.85 A)
 &rst
  ixpk= 2002, nxpk= 20, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1349,1350,
 &end
#
#    0 AMB  20-2:2003     0 AMB  20-1:2003   4.50    (#   2003:20  Double Ambig)
 &rst
  ixpk= 2003, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1355,1356,1355,1356,
 igr2=1349,1350,1349,1350,
 &end
#
#    0 AMB  20-2:2004    88 LYS  HG-         4.50    (#   2004:20  Single Ambig)
 &rst
  ixpk= 2004, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1355,1356,1355,1356,
 igr2=1349,1350,
 &end
#
#   96 GLN  HE2-         89 PRO  HA          4.50    (#   2005:20  Unique         3.03, 4.18 A)
 &rst
  ixpk= 2005, nxpk= 20, iat=  -1,1374, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1470,1471,
 &end
#
#   85 GLN  HA           85 GLN  HB-         3.50    (#   2006:20  Unique         2.19, 2.72 A)
 &rst
  ixpk= 2006, nxpk= 20, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1295,1296,
 &end
#
#   89 PRO  HD+          89 PRO  HB+         3.50    (#   2007:20  Unique         2.81, 3.71 A)
 &rst
  ixpk= 2007, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1365,1366,
 igr2=1371,1372,
 &end
#
#  105 ILE  HB            0 AMB  20-1:2008   3.50    (#   2008:20  Single Ambig)
 &rst
  ixpk= 2008, nxpk= 20, iat=1595,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1601,1602,1601,1602,
 &end
#
#  100 LEU  HA           37 PRO  HG+         4.50    (#   2009:20  Unique         2.29, 3.54 A)
 &rst
  ixpk= 2009, nxpk= 20, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 549, 550,
 &end
#
#    0 AMB  20-2:2010     0 AMB  20-1:2010   4.50    (#   2010:20  Double Ambig)
 &rst
  ixpk= 2010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1593, 555,
 igr2=1601,1602,1601,1602, 549, 550,
 &end
#
#   88 LYS  HA           89 PRO  HD-         3.50    (#   2011:20  Unique         2.12, 2.38 A)
 &rst
  ixpk= 2011, nxpk= 20, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1365,1366,
 &end
#
#   88 LYS  HA           89 PRO  HD+         3.50    (#   2012:20  Unique         2.12, 2.38 A)
 &rst
  ixpk= 2012, nxpk= 20, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1365,1366,
 &end
#
#   89 PRO  HA           89 PRO  HD-         3.50    (#   2013:20  Unique         3.54, 3.88 A)
 &rst
  ixpk= 2013, nxpk= 20, iat=1374,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1365,1366,
 &end
#
#   92 SER  HN           92 SER  HA          4.50    (#   2017:20  Unique         2.86, 2.94 A)
 &rst
  ixpk= 2017, nxpk= 20, iat=1402,1404, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   92 SER  HB-          92 SER  HA          3.50    (#   2019:20  Unique         2.41, 2.70 A)
 &rst
  ixpk= 2019, nxpk= 20, iat=  -1,1404, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1406,1407,
 &end
#
#   93 ASN  HA           93 ASN  HB-         4.50    (#   2020:20  Unique         2.38, 2.72 A)
 &rst
  ixpk= 2020, nxpk= 20, iat=1415,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1417,1418,
 &end
#
#   95 PRO  HD+          94 GLN  HA          4.50    (#   2023:20  Unique         2.38, 2.54 A)
 &rst
  ixpk= 2023, nxpk= 20, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1445,1446,
 &end
#
#   94 GLN  HA           94 GLN  HG+         4.50    (#   2027:20  Unique         3.70, 3.83 A)
 &rst
  ixpk= 2027, nxpk= 20, iat=1429,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1434,1435,
 &end
#
#   94 GLN  HE2-         94 GLN  HG-         4.50    (#   2028:20  Unique         2.23, 3.37 A)
 &rst
  ixpk= 2028, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1439,1440,
 igr2=1434,1435,
 &end
#
#   94 GLN  HE2+         94 GLN  HG+         4.50    (#   2030:20  Unique         2.23, 3.37 A)
 &rst
  ixpk= 2030, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1439,1440,
 igr2=1434,1435,
 &end
#
#   95 PRO  HB-          95 PRO  HA          4.50    (#   2031:20  Unique         2.28, 2.52 A)
 &rst
  ixpk= 2031, nxpk= 20, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1451,1452,
 &end
#
#   95 PRO  HB+          95 PRO  HA          4.50    (#   2032:20  Unique         2.28, 2.52 A)
 &rst
  ixpk= 2032, nxpk= 20, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1451,1452,
 &end
#
#   41 HIS  HB-          95 PRO  HA          4.50    (#   2033:20  Unique         2.16, 3.12 A)
 &rst
  ixpk= 2033, nxpk= 20, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 605, 606,
 &end
#
#   41 HIS  HB+          95 PRO  HA          4.50    (#   2034:20  Unique         2.16, 3.12 A)
 &rst
  ixpk= 2034, nxpk= 20, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 605, 606,
 &end
#
#   41 HIS  HA           95 PRO  HA          4.50    (#   2035:20  Unique         1.95, 2.30 A)
 &rst
  ixpk= 2035, nxpk= 20, iat= 603,1454, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:2036    95 PRO  HA          4.50    (#   2036:20  Single Ambig)
 &rst
  ixpk= 2036, nxpk= 20, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 582, 618,
 &end
#
#    0 AMB  20-2:2038     0 AMB  20-1:2038   4.50    (#   2038:20  Double Ambig)
 &rst
  ixpk= 2038, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1462,1463,1462,1463,
 igr2=1465,1466,1465,1466,
 &end
#
#   96 GLN  HB-           0 AMB  20-1:2039   5.50    (#   2039:20  Single Ambig)
 &rst
  ixpk= 2039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1462,1463,
 igr2=1465,1466,1465,1466,
 &end
#
#   96 GLN  HA           96 GLN  HG+         4.50    (#   2040:20  Unique         2.31, 3.03 A)
 &rst
  ixpk= 2040, nxpk= 20, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1465,1466,
 &end
#
#    0 AMB  20-2:2042    97 VAL  MGY         3.50    (#   2042:20  Single Ambig)
 &rst
  ixpk= 2042, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 628, 632,1334,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   99 ILE  HN           98 VAL  HA          4.50    (#   2043:20  Unique         2.04, 2.12 A)
 &rst
  ixpk= 2043, nxpk= 20, iat=1507,1493, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 VAL  MGX          98 VAL  HA          4.50    (#   2044:20  Unique         3.74, 5.73 A)
 &rst
  ixpk= 2044, nxpk= 20, iat=  -1,1493, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#  125 VAL  MGX         125 VAL  HB          2.80    (#   2046:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 2046, nxpk= 20, iat=  -1,1890, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#  126 CYS  HN          125 VAL  MGX         4.50    (#   2047:20  Unique         2.67, 4.16 A)
 &rst
  ixpk= 2047, nxpk= 20, iat=1902,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  125 VAL  HA          125 VAL  MGX         3.50    (#   2048:20  Unique         2.43, 3.16 A)
 &rst
  ixpk= 2048, nxpk= 20, iat=1888,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#    0 AMB  20-2:2049   125 VAL  MGX         4.50    (#   2049:20  Single Ambig)
 &rst
  ixpk= 2049, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1662,1663,1662,1663,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  125 VAL  HN          125 VAL  MGX         4.50    (#   2050:20  Unique         2.69, 4.35 A)
 &rst
  ixpk= 2050, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#   99 ILE  HN           98 VAL  MGY         4.50    (#   2051:20  Unique         2.47, 3.93 A)
 &rst
  ixpk= 2051, nxpk= 20, iat=1507,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1497,1498,1499,1501,1502,1503,
 &end
#
#   98 VAL  HN           98 VAL  MGY         4.50    (#   2052:20  Unique         3.08, 4.36 A)
 &rst
  ixpk= 2052, nxpk= 20, iat=1491,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1497,1498,1499,1501,1502,1503,
 &end
#
#  105 ILE  QG2          99 ILE  HG1+        4.50    (#   2053:20  Unique         2.16, 3.98 A)
 &rst
  ixpk= 2053, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1597,1598,1599,
 igr2=1517,1518,
 &end
#
#   98 VAL  HA           99 ILE  QD1         4.50    (#   2054:20  Unique         2.33, 3.52 A)
 &rst
  ixpk= 2054, nxpk= 20, iat=1493,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1520,1521,1522,
 &end
#
#   24 LEU  HA           99 ILE  QD1         5.50    (#   2055:20  Unique         3.78, 5.04 A)
 &rst
  ixpk= 2055, nxpk= 20, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1520,1521,1522,
 &end
#
#    0 AMB  20-2:2057    99 ILE  QD1         5.50    (#   2057:20  Single Ambig)
 &rst
  ixpk= 2057, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 552, 553, 447, 448,
 igr2=1520,1521,1522,
 &end
#
#    0 AMB  20-2:2058     0 AMB  20-1:2058   3.50    (#   2058:20  Double Ambig)
 &rst
  ixpk= 2058, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 425, 426, 427,1822,
 igr2=1513,1514,1515,1824,1825,1826,1828,1829,1830,
 &end
#
#  100 LEU  MDX         100 LEU  HA          4.50    (#   2059:20  Unique         2.36, 3.71 A)
 &rst
  ixpk= 2059, nxpk= 20, iat=  -1,1528, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1535,1536,1537,1539,1540,1541,
 &end
#
#  101 ALA  HN          100 LEU  HA          4.50    (#   2060:20  Unique         2.26, 2.34 A)
 &rst
  ixpk= 2060, nxpk= 20, iat=1545,1528, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  100 LEU  HN          100 LEU  HB+         4.50    (#   2061:20  Unique         2.30, 3.11 A)
 &rst
  ixpk= 2061, nxpk= 20, iat=1526,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1530,1531,
 &end
#
#  101 ALA  HN          100 LEU  HB-         4.50    (#   2062:20  Unique         2.28, 3.01 A)
 &rst
  ixpk= 2062, nxpk= 20, iat=1545,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1530,1531,
 &end
#
#  100 LEU  HA          100 LEU  HB-         4.50    (#   2063:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 2063, nxpk= 20, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1530,1531,
 &end
#
#  100 LEU  HA          100 LEU  HB+         4.50    (#   2064:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 2064, nxpk= 20, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1530,1531,
 &end
#
#  105 ILE  QD1         100 LEU  HB-         5.50    (#   2066:20  Unique         4.59, 6.72 A)
 &rst
  ixpk= 2066, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1604,1605,1606,
 igr2=1530,1531,
 &end
#
#  100 LEU  HN          100 LEU  MDX         4.50    (#   2067:20  Unique         2.44, 4.21 A)
 &rst
  ixpk= 2067, nxpk= 20, iat=1526,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#  100 LEU  HA          100 LEU  MDX         3.50    (#   2068:20  Unique         2.36, 3.71 A)
 &rst
  ixpk= 2068, nxpk= 20, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#   37 PRO  HB-         100 LEU  MDX         3.50    (#   2069:20  Unique         2.33, 5.15 A)
 &rst
  ixpk= 2069, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 552, 553,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#  100 LEU  HB-         100 LEU  MDX         3.50    (#   2070:20  Unique         2.38, 3.45 A)
 &rst
  ixpk= 2070, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1530,1531,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#  102 ASP  HN          101 ALA  HA          4.50    (#   2072:20  Unique         3.44, 3.49 A)
 &rst
  ixpk= 2072, nxpk= 20, iat=1555,1547, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  102 ASP  HN          102 ASP  HA          4.50    (#   2075:20  Unique         2.92, 2.95 A)
 &rst
  ixpk= 2075, nxpk= 20, iat=1555,1557, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  102 ASP  HB-         102 ASP  HA          3.50    (#   2076:20  Unique         2.31, 2.64 A)
 &rst
  ixpk= 2076, nxpk= 20, iat=  -1,1557, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1559,1560,
 &end
#
#  102 ASP  HB+         102 ASP  HA          4.50    (#   2077:20  Unique         2.31, 2.64 A)
 &rst
  ixpk= 2077, nxpk= 20, iat=  -1,1557, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1559,1560,
 &end
#
#  100 LEU  HB+         104 GLN  HB-         4.50    (#   2079:20  Unique         2.10, 3.89 A)
 &rst
  ixpk= 2079, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1530,1531,
 igr2=1578,1579,
 &end
#
#    0 AMB  20-2:2080   105 ILE  HA          4.50    (#   2080:20  Single Ambig)
 &rst
  ixpk= 2080, nxpk= 20, iat=  -1,1593, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1604,1605,1606,1533,
 &end
#
#   79 GLU  HB+         115 ALA  MB          4.50    (#   2081:20  Unique         3.17, 5.28 A)
 &rst
  ixpk= 2081, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1195,1196,
 igr2=1752,1753,1754,
 &end
#
#    0 AMB  20-2:2082   105 ILE  QG2         4.50    (#   2082:20  Single Ambig)
 &rst
  ixpk= 2082, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1601,1602,1601,1602,
 igr2=1597,1598,1599,
 &end
#
#  105 ILE  HA          105 ILE  QG2         4.50    (#   2083:20  Unique         2.31, 3.03 A)
 &rst
  ixpk= 2083, nxpk= 20, iat=1593,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1597,1598,1599,
 &end
#
#  106 THR  HN          105 ILE  QG2         4.50    (#   2084:20  Unique         2.28, 3.15 A)
 &rst
  ixpk= 2084, nxpk= 20, iat=1610,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1597,1598,1599,
 &end
#
#   81 SER  HA          115 ALA  MB          5.50    (#   2086:20  Unique         4.08, 5.41 A)
 &rst
  ixpk= 2086, nxpk= 20, iat=1227,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1752,1753,1754,
 &end
#
#  107 PRO  HA          107 PRO  HG-         3.50    (#   2088:20  Unique         2.75, 3.56 A)
 &rst
  ixpk= 2088, nxpk= 20, iat=1634,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1628,1629,
 &end
#
#  112 MET  HG+         110 LEU  MDX         3.50    (#   2090:20  Unique         2.85, 4.98 A)
 &rst
  ixpk= 2090, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1714,1715,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  113 ALA  HN          112 MET  HA          4.50    (#   2091:20  Unique         2.13, 2.17 A)
 &rst
  ixpk= 2091, nxpk= 20, iat=1724,1709, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:2092   111 LEU  MDX         4.50    (#   2092:20  Single Ambig)
 &rst
  ixpk= 2092, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1802,1803,1802,1803,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  112 MET  HG-           0 AMB  20-1:2094   4.50    (#   2094:20  Single Ambig)
 &rst
  ixpk= 2094, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1714,1715,
 igr2=1709,1690,
 &end
#
#   82 ILE  QD1         112 MET  HA          4.50    (#   2095:20  Unique         2.31, 3.71 A)
 &rst
  ixpk= 2095, nxpk= 20, iat=  -1,1709, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1249,1250,1251,
 &end
#
#    0 AMB  20-2:2096     0 AMB  20-1:2096   4.50    (#   2096:20  Double Ambig)
 &rst
  ixpk= 2096, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1610,1206,
 igr2=1597,1598,1599,1752,1753,1754,
 &end
#
#    0 AMB  20-2:2097   115 ALA  MB          4.50    (#   2097:20  Single Ambig)
 &rst
  ixpk= 2097, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1198,1199,1195,1196,
 igr2=1752,1753,1754,
 &end
#
#    0 AMB  20-2:2098     0 AMB  20-1:2098   5.50    (#   2098:20  Double Ambig)
 &rst
  ixpk= 2098, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=1180,1181,1180,1181,1578,1579,1578,1579, 114,
 igr2=1752,1753,1754,1597,1598,1599,
 &end
#
#  117 THR  MG2         117 THR  HA          3.50    (#   2099:20  Unique         2.38, 3.09 A)
 &rst
  ixpk= 2099, nxpk= 20, iat=  -1,1767, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1771,1772,1773,
 &end
#
#  119 GLU  HN          119 GLU  HB+         3.50    (#   2100:20  Unique         2.31, 2.84 A)
 &rst
  ixpk= 2100, nxpk= 20, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1790,1791,
 &end
#
#  119 GLU  HN          119 GLU  HB-         3.50    (#   2101:20  Unique         2.31, 2.84 A)
 &rst
  ixpk= 2101, nxpk= 20, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1790,1791,
 &end
#
#  117 THR  MG2           0 AMB  20-1:2102   5.50    (#   2102:20  Single Ambig)
 &rst
  ixpk= 2102, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1771,1772,1773,
 igr2=1793,1794,1793,1794,
 &end
#
#  121 LEU  HB-         120 PRO  HA          5.50    (#   2104:20  Unique         3.64, 5.00 A)
 &rst
  ixpk= 2104, nxpk= 20, iat=  -1,1811, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1819,1820,
 &end
#
#  120 PRO  HB-         122 LEU  HB-         6.50    (#   2106:20  Unique         6.27, 7.37 A)
 &rst
  ixpk= 2106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1808,1809,
 igr2=1838,1839,
 &end
#
#  120 PRO  HB-         122 LEU  HB+         6.50    (#   2107:20  Unique         6.27, 7.37 A)
 &rst
  ixpk= 2107, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1808,1809,
 igr2=1838,1839,
 &end
#
#  122 LEU  HA          122 LEU  HG          4.50    (#   2108:20  Unique         2.20, 2.53 A)
 &rst
  ixpk= 2108, nxpk= 20, iat=1836,1841, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  123 THR  HN          123 THR  HA          4.50    (#   2109:20  Unique         2.97, 2.99 A)
 &rst
  ixpk= 2109, nxpk= 20, iat=1853,1855, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  124 LEU  HN          123 THR  HA          3.50    (#   2110:20  Unique         2.14, 2.19 A)
 &rst
  ixpk= 2110, nxpk= 20, iat=1867,1855, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  111 LEU  HA          123 THR  HA          3.50    (#   2111:20  Unique         2.06, 2.21 A)
 &rst
  ixpk= 2111, nxpk= 20, iat=1690,1855, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:2112   123 THR  HA          4.50    (#   2112:20  Single Ambig)
 &rst
  ixpk= 2112, nxpk= 20, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1692,1693,1871,1872,2075,2076,2075,2076,
 &end
#
#    0 AMB  20-2:2113   123 THR  HA          4.50    (#   2113:20  Single Ambig)
 &rst
  ixpk= 2113, nxpk= 20, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1874,1838,1839,1841,
 &end
#
#    0 AMB  20-2:2114   123 THR  HA          4.50    (#   2114:20  Single Ambig)
 &rst
  ixpk= 2114, nxpk= 20, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1871,1872,1673,1674,
 &end
#
#    0 AMB  20-2:2115   123 THR  HA          4.50    (#   2115:20  Single Ambig)
 &rst
  ixpk= 2115, nxpk= 20, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1697,1698,1699,1701,1702,1703,1843,1844,1845,1847,
      1848,1849,1892,1893,1894,1896,1897,1898,
 &end
#
#  123 THR  MG2         123 THR  HA          3.50    (#   2116:20  Unique         2.35, 3.05 A)
 &rst
  ixpk= 2116, nxpk= 20, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1859,1860,1861,
 &end
#
#    0 AMB  20-2:2117   123 THR  MG2         6.50    (#   2117:20  Single Ambig)
 &rst
  ixpk= 2117, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1886,1853,
 igr2=1859,1860,1861,
 &end
#
#  124 LEU  HN          124 LEU  HA          5.50    (#   2118:20  Unique         2.95, 2.97 A)
 &rst
  ixpk= 2118, nxpk= 20, iat=1867,1869, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 LEU  HN          124 LEU  HG          6.50    (#   2119:20  Unique         2.78, 4.07 A)
 &rst
  ixpk= 2119, nxpk= 20, iat=1867,1874, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  125 VAL  HN          124 LEU  HG          5.50    (#   2120:20  Unique         3.49, 4.14 A)
 &rst
  ixpk= 2120, nxpk= 20, iat=1886,1874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 LEU  HA          124 LEU  HG          5.50    (#   2121:20  Unique         2.41, 2.63 A)
 &rst
  ixpk= 2121, nxpk= 20, iat=1869,1874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   20 PHE  HE          124 LEU  MDY         4.50    (#   2122:20  Unique         2.60, 6.68 A)
 &rst
  ixpk= 2122, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 305, 309,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#  124 LEU  HA          124 LEU  MDY         4.50    (#   2124:20  Unique         2.26, 4.10 A)
 &rst
  ixpk= 2124, nxpk= 20, iat=1869,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#    0 AMB  20-2:2126   124 LEU  MDY         3.50    (#   2126:20  Single Ambig)
 &rst
  ixpk= 2126, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 255, 256, 257,1874,1841,1838,1839,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#  110 LEU  MDX         124 LEU  MDY         4.50    (#   2128:20  Unique         2.30, 5.69 A)
 &rst
  ixpk= 2128, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1678,1679,1680,1682,1683,1684,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#  126 CYS  HN          125 VAL  HA          3.50    (#   2129:20  Unique         2.12, 2.17 A)
 &rst
  ixpk= 2129, nxpk= 20, iat=1902,1888, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  126 CYS  HB+         125 VAL  HA          4.50    (#   2130:20  Unique         4.24, 4.57 A)
 &rst
  ixpk= 2130, nxpk= 20, iat=  -1,1888, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1906,1907,
 &end
#
#  126 CYS  HA          126 CYS  HB+         4.50    (#   2132:20  Unique         2.37, 2.77 A)
 &rst
  ixpk= 2132, nxpk= 20, iat=1904,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1906,1907,
 &end
#
#  114 ASN  HN          120 PRO  HA          4.50    (#   2133:20  Unique         3.56, 3.89 A)
 &rst
  ixpk= 2133, nxpk= 20, iat=1734,1811, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  127 SER  HN          127 SER  HB-         5.50    (#   2134:20  Unique         2.55, 3.20 A)
 &rst
  ixpk= 2134, nxpk= 20, iat=1913,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1917,1918,
 &end
#
#  132 LEU  HN          131 PRO  HA          4.50    (#   2135:20  Unique         2.45, 2.80 A)
 &rst
  ixpk= 2135, nxpk= 20, iat=1980,1976, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  130 TRP  HA          131 PRO  HA          4.50    (#   2137:20  Unique         1.98, 2.06 A)
 &rst
  ixpk= 2137, nxpk= 20, iat=1944,1976, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  131 PRO  HD+         131 PRO  HA          5.50    (#   2138:20  Unique         3.79, 3.94 A)
 &rst
  ixpk= 2138, nxpk= 20, iat=  -1,1976, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1967,1968,
 &end
#
#  132 LEU  MDY         131 PRO  HA          5.50    (#   2140:20  Unique         3.46, 5.97 A)
 &rst
  ixpk= 2140, nxpk= 20, iat=  -1,1976, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#  132 LEU  HN          131 PRO  HB+         5.50    (#   2141:20  Unique         2.33, 3.75 A)
 &rst
  ixpk= 2141, nxpk= 20, iat=1980,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1973,1974,
 &end
#
#  132 LEU  HN          131 PRO  HB-         5.50    (#   2142:20  Unique         2.33, 3.75 A)
 &rst
  ixpk= 2142, nxpk= 20, iat=1980,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1973,1974,
 &end
#
#  131 PRO  HD+         131 PRO  HB+         4.50    (#   2144:20  Unique         2.82, 3.72 A)
 &rst
  ixpk= 2144, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1967,1968,
 igr2=1973,1974,
 &end
#
#  131 PRO  HA          131 PRO  HB+         4.50    (#   2145:20  Unique         2.28, 2.54 A)
 &rst
  ixpk= 2145, nxpk= 20, iat=1976,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1973,1974,
 &end
#
#  131 PRO  HA          131 PRO  HB-         4.50    (#   2146:20  Unique         2.28, 2.54 A)
 &rst
  ixpk= 2146, nxpk= 20, iat=1976,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1973,1974,
 &end
#
#  131 PRO  HG-         131 PRO  HB+         3.50    (#   2147:20  Unique         2.31, 2.61 A)
 &rst
  ixpk= 2147, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1970,1971,
 igr2=1973,1974,
 &end
#
#  131 PRO  HD-         131 PRO  HG+         3.50    (#   2148:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 2148, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1967,1968,
 igr2=1970,1971,
 &end
#
#  131 PRO  HD-         131 PRO  HG-         3.50    (#   2149:20  Unique         2.30, 2.61 A)
 &rst
  ixpk= 2149, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1967,1968,
 igr2=1970,1971,
 &end
#
#  132 LEU  HN          132 LEU  HA          4.50    (#   2150:20  Unique         2.24, 2.59 A)
 &rst
  ixpk= 2150, nxpk= 20, iat=1980,1982, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  132 LEU  HA          132 LEU  HG          4.50    (#   2151:20  Unique         2.15, 2.38 A)
 &rst
  ixpk= 2151, nxpk= 20, iat=1982,1987, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  132 LEU  HB+         132 LEU  HG          3.50    (#   2152:20  Unique         2.47, 2.79 A)
 &rst
  ixpk= 2152, nxpk= 20, iat=  -1,1987, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1984,1985,
 &end
#
#  121 LEU  HG          121 LEU  MDY         3.50    (#   2154:20  Unique         2.22, 2.64 A)
 &rst
  ixpk= 2154, nxpk= 20, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  121 LEU  HB+         121 LEU  MDY         3.50    (#   2155:20  Unique         2.22, 3.51 A)
 &rst
  ixpk= 2155, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1819,1820,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#   13 ALA  MB          121 LEU  MDY         3.50    (#   2156:20  Unique         2.36, 4.99 A)
 &rst
  ixpk= 2156, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 192, 193, 194,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  122 LEU  HB-         121 LEU  MDY         3.50    (#   2157:20  Unique         2.26, 6.14 A)
 &rst
  ixpk= 2157, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1838,1839,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  121 LEU  HA          121 LEU  MDY         3.50    (#   2158:20  Unique         2.21, 3.61 A)
 &rst
  ixpk= 2158, nxpk= 20, iat=1817,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#    0 AMB  20-2:2159   121 LEU  MDY         4.50    (#   2159:20  Single Ambig)
 &rst
  ixpk= 2159, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1793,1794,1793,1794,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#    0 AMB  20-2:2160   121 LEU  MDY         5.50    (#   2160:20  Single Ambig)
 &rst
  ixpk= 2160, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1769, 154,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  121 LEU  HN          121 LEU  MDY         4.50    (#   2161:20  Unique         1.96, 4.12 A)
 &rst
  ixpk= 2161, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  114 ASN  HN          121 LEU  MDY         4.50    (#   2162:20  Unique         2.39, 4.21 A)
 &rst
  ixpk= 2162, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  122 LEU  HN          121 LEU  MDY         5.50    (#   2163:20  Unique         3.14, 4.86 A)
 &rst
  ixpk= 2163, nxpk= 20, iat=1834,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#   10 ASN  HD2-        121 LEU  MDY         5.50    (#   2164:20  Unique         1.93, 5.11 A)
 &rst
  ixpk= 2164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 145, 146,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#   10 ASN  HD2+        121 LEU  MDY         5.50    (#   2165:20  Unique         1.93, 5.11 A)
 &rst
  ixpk= 2165, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 145, 146,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  113 ALA  HA          121 LEU  MDY         5.50    (#   2166:20  Unique         2.09, 4.68 A)
 &rst
  ixpk= 2166, nxpk= 20, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#   10 ASN  HA          121 LEU  MDY         4.50    (#   2167:20  Unique         2.00, 3.98 A)
 &rst
  ixpk= 2167, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#   10 ASN  HB-         121 LEU  MDY         4.50    (#   2168:20  Unique         2.28, 5.14 A)
 &rst
  ixpk= 2168, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 140, 141,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  114 ASN  HB+         121 LEU  MDY         4.50    (#   2169:20  Unique         2.07, 4.24 A)
 &rst
  ixpk= 2169, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1738,1739,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  108 PHE  HA          132 LEU  MDY         5.50    (#   2170:20  Unique         6.28, 7.96 A)
 &rst
  ixpk= 2170, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  132 LEU  HA          132 LEU  MDY         3.50    (#   2171:20  Unique         2.87, 4.16 A)
 &rst
  ixpk= 2171, nxpk= 20, iat=1982,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#    0 AMB  20-2:2173   132 LEU  MDY         3.50    (#   2173:20  Single Ambig)
 &rst
  ixpk= 2173, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1906,1907,1601,1602,1601,1602,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#    0 AMB  20-2:2174   132 LEU  MDY         2.80    (#   2174:20  Single Ambig)
 &rst
  ixpk= 2174, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1987,1874,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  132 LEU  HB+         132 LEU  MDY         3.50    (#   2175:20  Unique         2.26, 3.30 A)
 &rst
  ixpk= 2175, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1984,1985,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  108 PHE  HE          132 LEU  MDY         4.50    (#   2176:20  Unique         2.32, 4.38 A)
 &rst
  ixpk= 2176, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1648,1652,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  132 LEU  HN          132 LEU  MDY         5.50    (#   2178:20  Unique         2.52, 4.56 A)
 &rst
  ixpk= 2178, nxpk= 20, iat=1980,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  125 VAL  HN          132 LEU  MDY         5.50    (#   2179:20  Unique         2.77, 5.11 A)
 &rst
  ixpk= 2179, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  124 LEU  MDX         134 GLN  HB+         3.50    (#   2180:20  Unique         2.28, 5.49 A)
 &rst
  ixpk= 2180, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1876,1877,1878,1880,1881,1882,
 igr2=2015,2016,
 &end
#
#  124 LEU  MDX         134 GLN  HB-         4.50    (#   2181:20  Unique         2.28, 5.49 A)
 &rst
  ixpk= 2181, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1876,1877,1878,1880,1881,1882,
 igr2=2015,2016,
 &end
#
#  135 THR  HN          134 GLN  HG-         5.50    (#   2182:20  Unique         2.90, 4.09 A)
 &rst
  ixpk= 2182, nxpk= 20, iat=2028,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#  122 LEU  MDX         134 GLN  HG-         4.50    (#   2183:20  Unique         2.18, 4.96 A)
 &rst
  ixpk= 2183, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1843,1844,1845,1847,1848,1849,
 igr2=2018,2019,
 &end
#
#  122 LEU  MDX         134 GLN  HG+         4.50    (#   2184:20  Unique         2.18, 4.96 A)
 &rst
  ixpk= 2184, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1843,1844,1845,1847,1848,1849,
 igr2=2018,2019,
 &end
#
#  135 THR  HN          135 THR  MG2         4.50    (#   2185:20  Unique         2.40, 3.41 A)
 &rst
  ixpk= 2185, nxpk= 20, iat=2028,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2034,2035,2036,
 &end
#
#  135 THR  HA          135 THR  MG2         3.50    (#   2186:20  Unique         3.68, 3.96 A)
 &rst
  ixpk= 2186, nxpk= 20, iat=2030,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2034,2035,2036,
 &end
#
#  137 ALA  HA          135 THR  MG2         4.50    (#   2187:20  Unique         4.76, 5.74 A)
 &rst
  ixpk= 2187, nxpk= 20, iat=2063,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2034,2035,2036,
 &end
#
#  135 THR  HB          135 THR  MG2         3.50    (#   2188:20  Unique         2.38, 2.65 A)
 &rst
  ixpk= 2188, nxpk= 20, iat=2032,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2034,2035,2036,
 &end
#
#  137 ALA  HN          136 LEU  HA          5.50    (#   2189:20  Unique         2.07, 2.14 A)
 &rst
  ixpk= 2189, nxpk= 20, iat=2061,2044, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  136 LEU  HA          136 LEU  MDX         3.50    (#   2192:20  Unique         2.18, 3.85 A)
 &rst
  ixpk= 2192, nxpk= 20, iat=2044,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#  122 LEU  HA          136 LEU  MDX         4.50    (#   2193:20  Unique         2.96, 5.73 A)
 &rst
  ixpk= 2193, nxpk= 20, iat=1836,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#    0 AMB  20-2:2194   136 LEU  MDX         5.50    (#   2194:20  Single Ambig)
 &rst
  ixpk= 2194, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 202, 203, 202, 203,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#    0 AMB  20-2:2195   136 LEU  MDX         2.80    (#   2195:20  Single Ambig)
 &rst
  ixpk= 2195, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=2046,2047,1838,1839,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#  135 THR  MG2         137 ALA  HA          4.50    (#   2196:20  Unique         4.76, 5.74 A)
 &rst
  ixpk= 2196, nxpk= 20, iat=  -1,2063, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2034,2035,2036,
 &end
#
#    0 AMB  20-2:2198     0 AMB  20-1:2198   4.50    (#   2198:20  Double Ambig)
 &rst
  ixpk= 2198, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2071, 110,
 igr2=2075,2076,2075,2076,  63,  64,
 &end
#
#  138 ARG  HA            0 AMB  20-1:2199   3.50    (#   2199:20  Single Ambig)
 &rst
  ixpk= 2199, nxpk= 20, iat=2073,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2075,2076,2075,2076,
 &end
#
#    0 AMB  20-2:2200     0 AMB  20-1:2200   3.50    (#   2200:20  Double Ambig)
 &rst
  ixpk= 2200, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2081,2082,2081,2082,2081,2082,
 igr2=2075,2076,2075,2076,2075,2076,
 &end
#
#  138 ARG  HA            0 AMB  20-1:2201   3.50    (#   2201:20  Single Ambig)
 &rst
  ixpk= 2201, nxpk= 20, iat=2073,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2078,2079,2078,2079,
 &end
#
#    0 AMB  20-2:2202     0 AMB  20-1:2202   3.50    (#   2202:20  Double Ambig)
 &rst
  ixpk= 2202, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2081,2082,2081,2082,2081,2082,
 igr2=2078,2079,2078,2079,2078,2079,
 &end
#
#  139 ASP  HB-         140 THR  HA          6.50    (#   2204:20  Unique         4.52, 5.28 A)
 &rst
  ixpk= 2204, nxpk= 20, iat=  -1,2109, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=2099,2100,
 &end
#
#  141 ARG  HB-         140 THR  HB          5.50    (#   2205:20  Unique         3.72, 5.91 A)
 &rst
  ixpk= 2205, nxpk= 20, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2125,2126,
 &end
#
#   40 ILE  HN           97 VAL  HB          4.50    (#   2209:20  Unique         2.81, 2.96 A)
 &rst
  ixpk= 2209, nxpk= 20, iat= 582,1479, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ILE  HN           28 ILE  HG1+        4.50    (#   2210:20  Unique         1.95, 2.99 A)
 &rst
  ixpk= 2210, nxpk= 20, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 422, 423,
 &end
#
#   28 ILE  HA           28 ILE  HG1+        4.50    (#   2211:20  Unique         2.51, 2.77 A)
 &rst
  ixpk= 2211, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 422, 423,
 &end
#
#   28 ILE  HA           28 ILE  HG1-        4.50    (#   2212:20  Unique         2.51, 2.77 A)
 &rst
  ixpk= 2212, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 422, 423,
 &end
#
#   28 ILE  QD1          28 ILE  HG1+        4.50    (#   2213:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 2213, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 425, 426, 427,
 igr2= 422, 423,
 &end
#
#   28 ILE  QD1          28 ILE  HG1-        4.50    (#   2214:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 2214, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 425, 426, 427,
 igr2= 422, 423,
 &end
#
#   45 SER  HN           44 ASP  HA          6.50    (#   2215:20  Unique         2.33, 3.40 A)
 &rst
  ixpk= 2215, nxpk= 20, iat= 661, 651, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   47 TRP  HA           47 TRP  HB+         5.50    (#   2216:20  Unique         2.24, 2.48 A)
 &rst
  ixpk= 2216, nxpk= 20, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 686, 687,
 &end
#
#   47 TRP  HA           47 TRP  HB-         5.50    (#   2217:20  Unique         2.24, 2.48 A)
 &rst
  ixpk= 2217, nxpk= 20, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 686, 687,
 &end
#
#   48 ARG  HA           48 ARG  HB-         5.50    (#   2218:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 2218, nxpk= 20, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 710, 711,
 &end
#
#   49 ILE  HG1-         49 ILE  HB          3.50    (#   2219:20  Unique         2.32, 2.48 A)
 &rst
  ixpk= 2219, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 740, 741,
 &end
#
#    0 AMB  20-2:2220    89 PRO  HB-         4.50    (#   2220:20  Single Ambig)
 &rst
  ixpk= 2220, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 622, 623,1465,1466,
 igr2=1371,1372,
 &end
#
#   56 PRO  HD-          56 PRO  HB-         4.50    (#   2221:20  Unique         2.79, 3.69 A)
 &rst
  ixpk= 2221, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 840, 841,
 igr2= 846, 847,
 &end
#
#   56 PRO  HD+          56 PRO  HB-         4.50    (#   2222:20  Unique         2.79, 3.69 A)
 &rst
  ixpk= 2222, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 840, 841,
 igr2= 846, 847,
 &end
#
#   60 ARG  HN            0 AMB  20-1:2224   5.50    (#   2224:20  Single Ambig)
 &rst
  ixpk= 2224, nxpk= 20, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 905, 906, 905, 906,
 &end
#
#   60 ARG  HA            0 AMB  20-1:2225   4.50    (#   2225:20  Single Ambig)
 &rst
  ixpk= 2225, nxpk= 20, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 905, 906, 905, 906,
 &end
#
#    0 AMB  20-2:2226     0 AMB  20-1:2226   3.50    (#   2226:20  Double Ambig)
 &rst
  ixpk= 2226, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 908, 909, 908, 909, 908, 909,
 igr2= 905, 906, 905, 906, 905, 906,
 &end
#
#    0 AMB  20-2:2227     0 AMB  20-1:2227   2.80    (#   2227:20  Double Ambig)
 &rst
  ixpk= 2227, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 902, 903, 902, 903, 902, 903,
 igr2= 905, 906, 905, 906, 905, 906,
 &end
#
#    0 AMB  20-2:2229     0 AMB  20-1:2229   6.50    (#   2229:20  Double Ambig)
 &rst
  ixpk= 2229, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1658,1255,
 igr2=1298,1299,1298,1299,1298,1299,
 &end
#
#   65 GLN  HE2-         65 GLN  HG-         4.50    (#   2230:20  Unique         2.21, 3.28 A)
 &rst
  ixpk= 2230, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1007,1008,
 igr2=1002,1003,
 &end
#
#   37 PRO  HG-          37 PRO  HD+         3.50    (#   2240:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 2240, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 549, 550,
 igr2= 546, 547,
 &end
#
#   37 PRO  HG-          37 PRO  HD-         3.50    (#   2241:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 2241, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 549, 550,
 igr2= 546, 547,
 &end
#
#    0 AMB  20-2:2242     0 AMB  20-1:2242   3.50    (#   2242:20  Double Ambig)
 &rst
  ixpk= 2242, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 532, 533, 552, 553,
 igr2= 546, 547, 546, 547,
 &end
#
#    0 AMB  20-2:2243    37 PRO  HD-         3.50    (#   2243:20  Single Ambig)
 &rst
  ixpk= 2243, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 549, 550, 532, 533, 552, 553,
 igr2= 546, 547,
 &end
#
#   24 LEU  HB-          24 LEU  MDY         3.50    (#   2245:20  Unique         2.39, 3.28 A)
 &rst
  ixpk= 2245, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 353, 354,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#  132 LEU  HG          132 LEU  MDX         2.80    (#   2247:20  Unique         2.39, 2.65 A)
 &rst
  ixpk= 2247, nxpk= 20, iat=1987,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#   80 LEU  HN           78 GLU  HA          5.50    (#   2248:20  Unique         3.76, 4.22 A)
 &rst
  ixpk= 2248, nxpk= 20, iat=1206,1178, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 GLU  HN            0 AMB  20-1:2249   3.50    (#   2249:20  Single Ambig)
 &rst
  ixpk= 2249, nxpk= 20, iat= 222,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 202, 203, 202, 203,
 &end
#
#   14 ARG  HN            0 AMB  20-1:2250   3.50    (#   2250:20  Single Ambig)
 &rst
  ixpk= 2250, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 202, 203, 202, 203,
 &end
#
#   14 ARG  HA            0 AMB  20-1:2251   3.50    (#   2251:20  Single Ambig)
 &rst
  ixpk= 2251, nxpk= 20, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 202, 203, 202, 203,
 &end
#
#    0 AMB  20-2:2252     0 AMB  20-1:2252   3.50    (#   2252:20  Double Ambig)
 &rst
  ixpk= 2252, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 208, 209, 208, 209, 208, 209,
 igr2= 202, 203, 202, 203, 202, 203,
 &end
#
#   14 ARG  HN           14 ARG  HG-         4.50    (#   2253:20  Unique         2.11, 3.02 A)
 &rst
  ixpk= 2253, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 205, 206,
 &end
#
#   14 ARG  HA           14 ARG  HG-         3.50    (#   2254:20  Unique         2.42, 2.85 A)
 &rst
  ixpk= 2254, nxpk= 20, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 205, 206,
 &end
#
#   52 PRO  HD+          52 PRO  HG+         4.50    (#   2255:20  Unique         2.30, 2.60 A)
 &rst
  ixpk= 2255, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 783, 784,
 igr2= 786, 787,
 &end
#
#    0 AMB  20-2:2257     0 AMB  20-1:2257   5.50    (#   2257:20  Double Ambig)
 &rst
  ixpk= 2257, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1365,1366,1365,1366,
 igr2=1352,1353,1352,1353,
 &end
#
#    0 AMB  20-2:2258     0 AMB  20-1:2258   3.50    (#   2258:20  Double Ambig)
 &rst
  ixpk= 2258, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1355,1356,1355,1356,
 igr2=1352,1353,1352,1353,
 &end
#
#    0 AMB  20-2:2259    88 LYS  HD-         3.50    (#   2259:20  Single Ambig)
 &rst
  ixpk= 2259, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1355,1356,1355,1356,
 igr2=1352,1353,
 &end
#
#   88 LYS  HG-          88 LYS  HB-         3.50    (#   2260:20  Unique         2.34, 2.69 A)
 &rst
  ixpk= 2260, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1349,1350,
 igr2=1346,1347,
 &end
#
#   88 LYS  HB-          88 LYS  HG+         3.50    (#   2262:20  Unique         2.34, 2.69 A)
 &rst
  ixpk= 2262, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1346,1347,
 igr2=1349,1350,
 &end
#
#   88 LYS  HB-          88 LYS  HG-         3.50    (#   2263:20  Unique         2.34, 2.69 A)
 &rst
  ixpk= 2263, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1346,1347,
 igr2=1349,1350,
 &end
#
#    0 AMB  20-2:2266     0 AMB  20-1:2266   3.50    (#   2266:20  Double Ambig)
 &rst
  ixpk= 2266, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1352,1353,1352,1353,1352,1353,
 igr2=1355,1356,1355,1356,1355,1356,
 &end
#
#   54 LYS  HB-           0 AMB  20-1:2268   3.50    (#   2268:20  Single Ambig)
 &rst
  ixpk= 2268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 807, 808,
 igr2= 810, 811, 810, 811,
 &end
#
#   79 GLU  HN           77 ASP  HA          6.50    (#   2269:20  Unique         3.76, 4.10 A)
 &rst
  ixpk= 2269, nxpk= 20, iat=1191,1166, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   94 GLN  HA           95 PRO  HD+         4.50    (#   2270:20  Unique         2.38, 2.54 A)
 &rst
  ixpk= 2270, nxpk= 20, iat=1429,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1445,1446,
 &end
#
#   94 GLN  HA           95 PRO  HD-         4.50    (#   2271:20  Unique         2.38, 2.54 A)
 &rst
  ixpk= 2271, nxpk= 20, iat=1429,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1445,1446,
 &end
#
#   95 PRO  HG+          95 PRO  HD+         6.50    (#   2272:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 2272, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1448,1449,
 igr2=1445,1446,
 &end
#
#    0 AMB  20-2:2273     0 AMB  20-1:2273   5.50    (#   2273:20  Double Ambig)
 &rst
  ixpk= 2273, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1445,1446, 605, 606,
 igr2=1451,1452,1451,1452,
 &end
#
#   95 PRO  HD-          95 PRO  HB-         5.50    (#   2274:20  Unique         2.74, 3.67 A)
 &rst
  ixpk= 2274, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1445,1446,
 igr2=1451,1452,
 &end
#
#   14 ARG  HN           13 ALA  HA          5.50    (#   2275:20  Unique         3.56, 3.59 A)
 &rst
  ixpk= 2275, nxpk= 20, iat= 198, 190, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 LEU  HG           13 ALA  HA          5.50    (#   2276:20  Unique         5.37, 5.55 A)
 &rst
  ixpk= 2276, nxpk= 20, iat=1822, 190, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 ALA  HN           26 LEU  HA          4.50    (#   2277:20  Unique         3.57, 3.58 A)
 &rst
  ixpk= 2277, nxpk= 20, iat= 402, 385, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:2278    43 SER  HA          6.50    (#   2278:20  Single Ambig)
 &rst
  ixpk= 2278, nxpk= 20, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 665, 666,1365,1366,
 &end
#
#   10 ASN  HD2-         10 ASN  HB-         3.50    (#   2279:20  Unique         2.17, 3.29 A)
 &rst
  ixpk= 2279, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 145, 146,
 igr2= 140, 141,
 &end
#
#    0 AMB  20-2:2280     0 AMB  20-1:2280   3.50    (#   2280:20  Double Ambig)
 &rst
  ixpk= 2280, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 145, 146, 150,
 igr2= 140, 141, 140, 141,
 &end
#
#    0 AMB  20-2:2281    19 ARG  HB-         4.50    (#   2281:20  Single Ambig)
 &rst
  ixpk= 2281, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 281, 282, 281, 282,
 igr2= 275, 276,
 &end
#
#   79 GLU  HN           77 ASP  HB-         5.50    (#   2283:20  Unique         2.48, 3.76 A)
 &rst
  ixpk= 2283, nxpk= 20, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1168,1169,
 &end
#
#   78 GLU  HN           77 ASP  HB+         3.50    (#   2284:20  Unique         2.36, 3.55 A)
 &rst
  ixpk= 2284, nxpk= 20, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1168,1169,
 &end
#
#   80 LEU  HN           77 ASP  HB+         5.50    (#   2285:20  Unique         2.64, 4.03 A)
 &rst
  ixpk= 2285, nxpk= 20, iat=1206,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1168,1169,
 &end
#
#   80 LEU  MDX           0 AMB  20-1:2287   4.50    (#   2287:20  Single Ambig)
 &rst
  ixpk= 2287, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1215,1216,1217,1219,1220,1221,
 igr2=1168,1169,1168,1169,
 &end
#
#   77 ASP  HB+          77 ASP  HA          3.50    (#   2288:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 2288, nxpk= 20, iat=  -1,1166, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1168,1169,
 &end
#
#   26 LEU  HN           27 ALA  MB          5.50    (#   2289:20  Unique         5.00, 5.59 A)
 &rst
  ixpk= 2289, nxpk= 20, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 406, 407, 408,
 &end
#
#   28 ILE  HN           28 ILE  HG1-        4.50    (#   2290:20  Unique         1.95, 2.99 A)
 &rst
  ixpk= 2290, nxpk= 20, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 422, 423,
 &end
#
#    0 AMB  20-2:2291     0 AMB  20-1:2291   4.50    (#   2291:20  Double Ambig)
 &rst
  ixpk= 2291, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 477, 110,
 igr2= 498, 171, 172,
 &end
#
#  118 GLY  HA+           3 TYR  HB+         6.50    (#   2294:20  Unique         6.41, 8.78 A)
 &rst
  ixpk= 2294, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1781,1782,
 igr2=  35,  36,
 &end
#
#  118 GLY  HA+           3 TYR  HB-         6.50    (#   2295:20  Unique         6.41, 8.78 A)
 &rst
  ixpk= 2295, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1781,1782,
 igr2=  35,  36,
 &end
#
#    5 ARG  HN            0 AMB  20-1:2298   5.50    (#   2298:20  Single Ambig)
 &rst
  ixpk= 2298, nxpk= 20, iat=  59,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=  54,  55,  54,  55,
 &end
#
#    0 AMB  20-2:2299     0 AMB  20-1:2299   5.50    (#   2299:20  Double Ambig)
 &rst
  ixpk= 2299, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  66,  67,  66,  67,
 igr2=  54,  55,  54,  55,
 &end
#
#    6 GLU  HN            5 ARG  HA          4.50    (#   2300:20  Unique         2.13, 2.53 A)
 &rst
  ixpk= 2300, nxpk= 20, iat=  83,  61, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 ARG  HB+           5 ARG  HA          4.50    (#   2301:20  Unique         2.24, 2.50 A)
 &rst
  ixpk= 2301, nxpk= 20, iat=  -1,  61, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  63,  64,
 &end
#
#    0 AMB  20-2:2305     0 AMB  20-1:2305   6.50    (#   2305:20  Double Ambig)
 &rst
  ixpk= 2305, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.32, r4=10.82,
 igr1=1743,1744,1743,1744,
 igr2=  90,  91,  90,  91,
 &end
#
#    7 ASP  HN            7 ASP  HB-         5.50    (#   2310:20  Unique         2.02, 2.76 A)
 &rst
  ixpk= 2310, nxpk= 20, iat=  98,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 102, 103,
 &end
#
#   12 ARG  HN            8 VAL  HA          5.50    (#   2312:20  Unique         3.64, 4.02 A)
 &rst
  ixpk= 2312, nxpk= 20, iat= 164, 112, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 ALA  HN            8 VAL  HA          4.50    (#   2313:20  Unique         3.53, 3.56 A)
 &rst
  ixpk= 2313, nxpk= 20, iat= 126, 112, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 VAL  HN            8 VAL  HA          4.50    (#   2314:20  Unique         2.27, 2.85 A)
 &rst
  ixpk= 2314, nxpk= 20, iat= 110, 112, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 THR  HN            8 VAL  HA          4.50    (#   2315:20  Unique         3.23, 3.50 A)
 &rst
  ixpk= 2315, nxpk= 20, iat= 150, 112, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 VAL  MGY           8 VAL  HA          3.50    (#   2316:20  Unique         2.37, 3.15 A)
 &rst
  ixpk= 2316, nxpk= 20, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#    8 VAL  MGX           8 VAL  HA          3.50    (#   2317:20  Unique         2.37, 3.15 A)
 &rst
  ixpk= 2317, nxpk= 20, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#    8 VAL  HB            8 VAL  HA          3.50    (#   2318:20  Unique         3.01, 3.04 A)
 &rst
  ixpk= 2318, nxpk= 20, iat= 114, 112, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:2319     8 VAL  HA          5.50    (#   2319:20  Single Ambig)
 &rst
  ixpk= 2319, nxpk= 20, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1198,1199,1183,1184,
 &end
#
#    7 ASP  HB-           8 VAL  HA          5.50    (#   2320:20  Unique         4.41, 5.69 A)
 &rst
  ixpk= 2320, nxpk= 20, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 102, 103,
 &end
#
#   11 THR  HB            8 VAL  HA          3.50    (#   2321:20  Unique         2.53, 3.14 A)
 &rst
  ixpk= 2321, nxpk= 20, iat= 154, 112, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 VAL  HN            8 VAL  HB          4.50    (#   2322:20  Unique         2.32, 2.48 A)
 &rst
  ixpk= 2322, nxpk= 20, iat= 110, 114, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 VAL  HA            8 VAL  HB          3.50    (#   2325:20  Unique         3.01, 3.04 A)
 &rst
  ixpk= 2325, nxpk= 20, iat= 112, 114, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:2330    97 VAL  MGX         4.50    (#   2330:20  Single Ambig)
 &rst
  ixpk= 2330, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 628, 632,1650,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#  121 LEU  HN          113 ALA  MB          4.50    (#   2331:20  Unique         3.87, 4.95 A)
 &rst
  ixpk= 2331, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1728,1729,1730,
 &end
#
#    8 VAL  HN            8 VAL  MGX         4.50    (#   2332:20  Unique         2.04, 3.87 A)
 &rst
  ixpk= 2332, nxpk= 20, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#   12 ARG  HH1+          8 VAL  MGX         6.50    (#   2334:20  Unique         2.49, 6.51 A)
 &rst
  ixpk= 2334, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 180, 181,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#  114 ASN  HB+         113 ALA  MB          4.50    (#   2337:20  Unique         4.50, 5.86 A)
 &rst
  ixpk= 2337, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1738,1739,
 igr2=1728,1729,1730,
 &end
#
#   78 GLU  HG-           8 VAL  MGX         4.50    (#   2338:20  Unique         2.69, 6.73 A)
 &rst
  ixpk= 2338, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1183,1184,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#   12 ARG  HB-           8 VAL  MGX         4.50    (#   2339:20  Unique         2.47, 6.42 A)
 &rst
  ixpk= 2339, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 168, 169,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    5 ARG  HG-           8 VAL  MGX         4.50    (#   2340:20  Unique         2.34, 5.51 A)
 &rst
  ixpk= 2340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  66,  67,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#   98 VAL  HA           97 VAL  MGX         4.50    (#   2341:20  Unique         3.74, 5.73 A)
 &rst
  ixpk= 2341, nxpk= 20, iat=1493,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   12 ARG  HD+           8 VAL  MGY         4.50    (#   2342:20  Unique         2.44, 5.84 A)
 &rst
  ixpk= 2342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 174, 175,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    7 ASP  HB+           8 VAL  MGY         5.50    (#   2343:20  Unique         2.67, 7.47 A)
 &rst
  ixpk= 2343, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 102, 103,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    0 AMB  20-2:2344     8 VAL  MGY         3.50    (#   2344:20  Single Ambig)
 &rst
  ixpk= 2344, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1198,1199,1183,1184,
 igr2= 116, 117, 118, 120, 121, 122,
 &end
#
#    0 AMB  20-2:2345     0 AMB  20-1:2345   3.50    (#   2345:20  Double Ambig)
 &rst
  ixpk= 2345, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1479, 168, 169,
 igr2=1481,1482,1483,1485,1486,1487, 116, 117, 118, 120,
       121, 122,
 &end
#
#   40 ILE  HB           97 VAL  MGX         3.50    (#   2346:20  Unique         3.25, 4.24 A)
 &rst
  ixpk= 2346, nxpk= 20, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   12 ARG  HD-           9 ALA  HA          6.50    (#   2348:20  Unique         3.74, 5.33 A)
 &rst
  ixpk= 2348, nxpk= 20, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 174, 175,
 &end
#
#  121 LEU  HG            9 ALA  HA          5.50    (#   2349:20  Unique         4.40, 4.85 A)
 &rst
  ixpk= 2349, nxpk= 20, iat=1822, 128, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   80 LEU  HA            0 AMB  20-1:2350   5.50    (#   2350:20  Single Ambig)
 &rst
  ixpk= 2350, nxpk= 20, iat=1208,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 130, 131, 132, 192, 193, 194,
 &end
#
#    0 AMB  20-2:2352    10 ASN  HA          4.50    (#   2352:20  Single Ambig)
 &rst
  ixpk= 2352, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 208, 209, 208, 209,1738,1739,
 &end
#
#    8 VAL  HA           10 ASN  HB+         5.50    (#   2353:20  Unique         4.42, 5.55 A)
 &rst
  ixpk= 2353, nxpk= 20, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 140, 141,
 &end
#
#    8 VAL  HA           10 ASN  HB-         5.50    (#   2354:20  Unique         4.42, 5.55 A)
 &rst
  ixpk= 2354, nxpk= 20, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 140, 141,
 &end
#
#   94 GLN  HG-          93 ASN  HB+         5.50    (#   2356:20  Unique         4.24, 6.11 A)
 &rst
  ixpk= 2356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1434,1435,
 igr2=1417,1418,
 &end
#
#  121 LEU  HB+          10 ASN  HB-         6.50    (#   2358:20  Unique         3.05, 5.53 A)
 &rst
  ixpk= 2358, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1819,1820,
 igr2= 140, 141,
 &end
#
#  121 LEU  HB+          10 ASN  HB+         6.50    (#   2359:20  Unique         3.05, 5.53 A)
 &rst
  ixpk= 2359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1819,1820,
 igr2= 140, 141,
 &end
#
#    0 AMB  20-2:2360    11 THR  HA          5.50    (#   2360:20  Single Ambig)
 &rst
  ixpk= 2360, nxpk= 20, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 166, 190,
 &end
#
#    0 AMB  20-2:2362    11 THR  HA          4.50    (#   2362:20  Single Ambig)
 &rst
  ixpk= 2362, nxpk= 20, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 208, 209, 208, 209,
 &end
#
#   15 GLU  HG+          11 THR  HA          6.50    (#   2364:20  Unique         4.17, 5.90 A)
 &rst
  ixpk= 2364, nxpk= 20, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 229, 230,
 &end
#
#   15 GLU  HB-          11 THR  HA          6.50    (#   2365:20  Unique         4.80, 6.06 A)
 &rst
  ixpk= 2365, nxpk= 20, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 226, 227,
 &end
#
#    0 AMB  20-2:2368    11 THR  HB          4.50    (#   2368:20  Single Ambig)
 &rst
  ixpk= 2368, nxpk= 20, iat=  -1, 154, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 168, 169, 205, 206,
 &end
#
#    8 VAL  MGY          11 THR  HB          4.50    (#   2369:20  Unique         3.03, 5.07 A)
 &rst
  ixpk= 2369, nxpk= 20, iat=  -1, 154, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#   11 THR  HN           11 THR  MG2         5.50    (#   2371:20  Unique         4.30, 4.53 A)
 &rst
  ixpk= 2371, nxpk= 20, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 156, 157, 158,
 &end
#
#   12 ARG  HN           12 ARG  HD-         5.50    (#   2373:20  Unique         3.14, 4.41 A)
 &rst
  ixpk= 2373, nxpk= 20, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 174, 175,
 &end
#
#   78 GLU  HN           12 ARG  HD-         6.50    (#   2374:20  Unique         2.50, 4.81 A)
 &rst
  ixpk= 2374, nxpk= 20, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 174, 175,
 &end
#
#    8 VAL  HA           12 ARG  HD+         6.50    (#   2375:20  Unique         5.45, 6.34 A)
 &rst
  ixpk= 2375, nxpk= 20, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 174, 175,
 &end
#
#    8 VAL  HA           12 ARG  HD-         6.50    (#   2376:20  Unique         5.45, 6.34 A)
 &rst
  ixpk= 2376, nxpk= 20, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 174, 175,
 &end
#
#   77 ASP  HB+          12 ARG  HD-         5.50    (#   2379:20  Unique         2.92, 4.92 A)
 &rst
  ixpk= 2379, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1168,1169,
 igr2= 174, 175,
 &end
#
#    0 AMB  20-2:2380    12 ARG  HD-         5.50    (#   2380:20  Single Ambig)
 &rst
  ixpk= 2380, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1183,1184,1198,1199,
 igr2= 174, 175,
 &end
#
#    9 ALA  MB           12 ARG  HD+         6.50    (#   2381:20  Unique         5.52, 7.75 A)
 &rst
  ixpk= 2381, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 130, 131, 132,
 igr2= 174, 175,
 &end
#
#   11 THR  MG2          12 ARG  HD+         6.50    (#   2383:20  Unique         3.22, 6.53 A)
 &rst
  ixpk= 2383, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 156, 157, 158,
 igr2= 174, 175,
 &end
#
#  122 LEU  HN           13 ALA  MB          5.50    (#   2385:20  Unique         3.74, 4.80 A)
 &rst
  ixpk= 2385, nxpk= 20, iat=1834,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:2386     0 AMB  20-1:2386   5.50    (#   2386:20  Double Ambig)
 &rst
  ixpk= 2386, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1709,1726,
 igr2= 192, 193, 194, 130, 131, 132,
 &end
#
#  121 LEU  HG           13 ALA  MB          3.50    (#   2387:20  Unique         2.91, 3.60 A)
 &rst
  ixpk= 2387, nxpk= 20, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 192, 193, 194,
 &end
#
#   80 LEU  HG           13 ALA  MB          4.50    (#   2388:20  Unique         2.60, 5.27 A)
 &rst
  ixpk= 2388, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 192, 193, 194,
 &end
#
#   17 ALA  HA           15 GLU  HA          6.50    (#   2390:20  Unique         6.52, 6.57 A)
 &rst
  ixpk= 2390, nxpk= 20, iat= 253, 224, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   15 GLU  HB-          15 GLU  HA          3.50    (#   2392:20  Unique         2.45, 2.80 A)
 &rst
  ixpk= 2392, nxpk= 20, iat=  -1, 224, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 226, 227,
 &end
#
#    0 AMB  20-2:2395    15 GLU  HG-         5.50    (#   2395:20  Single Ambig)
 &rst
  ixpk= 2395, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 271, 261,
 igr2= 229, 230,
 &end
#
#   20 PHE  HN           16 THR  HA          5.50    (#   2400:20  Unique         3.64, 3.78 A)
 &rst
  ixpk= 2400, nxpk= 20, iat= 295, 239, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2402    16 THR  HA          5.50    (#   2402:20  Single Ambig)
 &rst
  ixpk= 2402, nxpk= 20, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 299, 300,1168,1169,
 &end
#
#   17 ALA  HN           16 THR  HB          5.50    (#   2403:20  Unique         2.67, 2.81 A)
 &rst
  ixpk= 2403, nxpk= 20, iat= 251, 241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 THR  HN           16 THR  HB          5.50    (#   2404:20  Unique         2.30, 2.45 A)
 &rst
  ixpk= 2404, nxpk= 20, iat= 237, 241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 THR  MG2          16 THR  HB          4.50    (#   2405:20  Unique         2.34, 2.65 A)
 &rst
  ixpk= 2405, nxpk= 20, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 243, 244, 245,
 &end
#
#   80 LEU  HG           16 THR  HB          6.50    (#   2406:20  Unique         3.19, 4.65 A)
 &rst
  ixpk= 2406, nxpk= 20, iat=1213, 241, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  20-2:2408    16 THR  MG2         6.50    (#   2408:20  Single Ambig)
 &rst
  ixpk= 2408, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.37, r4= 9.87,
 igr1= 297, 200, 128,
 igr2= 243, 244, 245,
 &end
#
#   20 PHE  HB-          16 THR  MG2         5.50    (#   2409:20  Unique         3.57, 5.02 A)
 &rst
  ixpk= 2409, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 299, 300,
 igr2= 243, 244, 245,
 &end
#
#  110 LEU  MDX          16 THR  MG2         5.50    (#   2411:20  Unique         4.89, 7.11 A)
 &rst
  ixpk= 2411, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1678,1679,1680,1682,1683,1684,
 igr2= 243, 244, 245,
 &end
#
#   16 THR  HN           18 ALA  MB          6.50    (#   2413:20  Unique         5.10, 6.30 A)
 &rst
  ixpk= 2413, nxpk= 20, iat= 237,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 265, 266, 267,
 &end
#
#   17 ALA  HA           18 ALA  MB          5.50    (#   2415:20  Unique         5.82, 6.14 A)
 &rst
  ixpk= 2415, nxpk= 20, iat= 253,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 265, 266, 267,
 &end
#
#   23 ALA  HN           19 ARG  HA          5.50    (#   2416:20  Unique         3.86, 4.04 A)
 &rst
  ixpk= 2416, nxpk= 20, iat= 339, 273, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 LEU  MDX          34 SER  HA          5.50    (#   2418:20  Unique         2.68, 6.77 A)
 &rst
  ixpk= 2418, nxpk= 20, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 500, 501, 502, 504, 505, 506,
 &end
#
#   20 PHE  HN           19 ARG  HB-         5.50    (#   2419:20  Unique         2.49, 3.19 A)
 &rst
  ixpk= 2419, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 275, 276,
 &end
#
#   20 PHE  HN           19 ARG  HB+         4.50    (#   2420:20  Unique         2.49, 3.19 A)
 &rst
  ixpk= 2420, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 275, 276,
 &end
#
#    0 AMB  20-2:2421     0 AMB  20-1:2421   3.50    (#   2421:20  Double Ambig)
 &rst
  ixpk= 2421, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 849, 273,
 igr2= 846, 847, 275, 276,
 &end
#
#   19 ARG  HA           19 ARG  HB+         3.50    (#   2422:20  Unique         2.44, 2.79 A)
 &rst
  ixpk= 2422, nxpk= 20, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 275, 276,
 &end
#
#   18 ALA  MB           19 ARG  HB+         4.50    (#   2423:20  Unique         3.96, 5.90 A)
 &rst
  ixpk= 2423, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 265, 266, 267,
 igr2= 275, 276,
 &end
#
#   18 ALA  MB           19 ARG  HB-         4.50    (#   2424:20  Unique         3.96, 5.90 A)
 &rst
  ixpk= 2424, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 265, 266, 267,
 igr2= 275, 276,
 &end
#
#    0 AMB  20-2:2426     0 AMB  20-1:2426   5.50    (#   2426:20  Double Ambig)
 &rst
  ixpk= 2426, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2023,2024,1153,
 igr2= 205, 206, 278, 279,
 &end
#
#   18 ALA  MB            0 AMB  20-1:2429   5.50    (#   2429:20  Single Ambig)
 &rst
  ixpk= 2429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 265, 266, 267,
 igr2= 281, 282, 281, 282,
 &end
#
#   16 THR  HA            0 AMB  20-1:2432   5.50    (#   2432:20  Single Ambig)
 &rst
  ixpk= 2432, nxpk= 20, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 281, 282, 281, 282,
 &end
#
#   20 PHE  HN           20 PHE  HB-         5.50    (#   2434:20  Unique         2.29, 2.54 A)
 &rst
  ixpk= 2434, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 299, 300,
 &end
#
#  130 TRP  HH2          21 THR  HA          6.50    (#   2436:20  Unique         3.44, 4.06 A)
 &rst
  ixpk= 2436, nxpk= 20, iat=1957, 317, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   21 THR  MG2          21 THR  HA          3.50    (#   2438:20  Unique         2.38, 3.11 A)
 &rst
  ixpk= 2438, nxpk= 20, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 321, 322, 323,
 &end
#
#    0 AMB  20-2:2439    21 THR  HA          4.50    (#   2439:20  Single Ambig)
 &rst
  ixpk= 2439, nxpk= 20, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 358, 359, 360, 362, 363, 364,1989,1990,1991,1993,
      1994,1995,
 &end
#
#   17 ALA  HA           21 THR  MG2         6.50    (#   2441:20  Unique         5.26, 7.56 A)
 &rst
  ixpk= 2441, nxpk= 20, iat= 253,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 321, 322, 323,
 &end
#
#    0 AMB  20-2:2443    21 THR  MG2         4.50    (#   2443:20  Single Ambig)
 &rst
  ixpk= 2443, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 372, 373,2018,2019,
 igr2= 321, 322, 323,
 &end
#
#  131 PRO  HG+          21 THR  MG2         3.50    (#   2445:20  Unique         4.30, 4.92 A)
 &rst
  ixpk= 2445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1970,1971,
 igr2= 321, 322, 323,
 &end
#
#  130 TRP  HZ2          22 ALA  HA          5.50    (#   2446:20  Unique         5.50, 5.52 A)
 &rst
  ixpk= 2446, nxpk= 20, iat=1955, 331, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 GLU  HB-          23 ALA  HA          5.50    (#   2447:20  Unique         5.05, 5.61 A)
 &rst
  ixpk= 2447, nxpk= 20, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 372, 373,
 &end
#
#    0 AMB  20-2:2448    17 ALA  MB          5.50    (#   2448:20  Single Ambig)
 &rst
  ixpk= 2448, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 237,2011,
 igr2= 255, 256, 257,
 &end
#
#    0 AMB  20-2:2450    17 ALA  MB          5.50    (#   2450:20  Single Ambig)
 &rst
  ixpk= 2450, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1714,1715, 226, 227,
 igr2= 255, 256, 257,
 &end
#
#   27 ALA  HA           24 LEU  HA          5.50    (#   2452:20  Unique         4.82, 4.97 A)
 &rst
  ixpk= 2452, nxpk= 20, iat= 404, 351, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2453    24 LEU  HA          5.50    (#   2453:20  Single Ambig)
 &rst
  ixpk= 2453, nxpk= 20, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 372, 373, 447, 448,
 &end
#
#   25 GLU  HN           24 LEU  HB+         5.50    (#   2454:20  Unique         2.71, 3.40 A)
 &rst
  ixpk= 2454, nxpk= 20, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 353, 354,
 &end
#
#    0 AMB  20-2:2455     0 AMB  20-1:2455   6.50    (#   2455:20  Double Ambig)
 &rst
  ixpk= 2455, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1= 339,1980,
 igr2= 387, 388, 353, 354,
 &end
#
#  130 TRP  HH2          24 LEU  HB-         6.50    (#   2456:20  Unique         4.17, 5.10 A)
 &rst
  ixpk= 2456, nxpk= 20, iat=1957,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 353, 354,
 &end
#
#  130 TRP  HZ3          24 LEU  HB+         6.50    (#   2457:20  Unique         2.14, 3.06 A)
 &rst
  ixpk= 2457, nxpk= 20, iat=1959,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 353, 354,
 &end
#
#    0 AMB  20-2:2458    24 LEU  HB-         6.50    (#   2458:20  Single Ambig)
 &rst
  ixpk= 2458, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 595, 596, 597, 425, 426, 427,
 igr2= 353, 354,
 &end
#
#    0 AMB  20-2:2459     0 AMB  20-1:2459   6.50    (#   2459:20  Double Ambig)
 &rst
  ixpk= 2459, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1= 595, 596, 597, 425, 426, 427,
 igr2= 353, 354, 353, 354,
 &end
#
#   28 ILE  HN           24 LEU  HG          4.50    (#   2460:20  Unique         4.33, 4.48 A)
 &rst
  ixpk= 2460, nxpk= 20, iat= 412, 356, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  130 TRP  HE3          24 LEU  HG          6.50    (#   2461:20  Unique         2.49, 2.73 A)
 &rst
  ixpk= 2461, nxpk= 20, iat=1961, 356, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  20-2:2462    24 LEU  MDX         6.50    (#   2462:20  Single Ambig)
 &rst
  ixpk= 2462, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
 igr1= 443,1638,1567,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#   20 PHE  HE           24 LEU  MDX         4.50    (#   2463:20  Unique         2.68, 4.93 A)
 &rst
  ixpk= 2463, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 305, 309,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#  105 ILE  QG2          24 LEU  MDX         3.50    (#   2464:20  Unique         2.45, 4.71 A)
 &rst
  ixpk= 2464, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1597,1598,1599,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#  125 VAL  HN          132 LEU  MDX         5.50    (#   2465:20  Unique         2.77, 5.11 A)
 &rst
  ixpk= 2465, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#   28 ILE  HN           24 LEU  MDY         5.50    (#   2466:20  Unique         4.18, 6.31 A)
 &rst
  ixpk= 2466, nxpk= 20, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#  130 TRP  HH2          25 GLU  HA          5.50    (#   2467:20  Unique         3.78, 4.03 A)
 &rst
  ixpk= 2467, nxpk= 20, iat=1957, 370, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 ALA  HA           25 GLU  HA          5.50    (#   2468:20  Unique         4.94, 5.15 A)
 &rst
  ixpk= 2468, nxpk= 20, iat= 331, 370, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 ILE  HA           25 GLU  HA          5.50    (#   2469:20  Unique         5.30, 5.40 A)
 &rst
  ixpk= 2469, nxpk= 20, iat= 414, 370, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 GLU  HB-          25 GLU  HA          3.50    (#   2472:20  Unique         2.43, 2.81 A)
 &rst
  ixpk= 2472, nxpk= 20, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 372, 373,
 &end
#
#    0 AMB  20-2:2473    25 GLU  HA          5.50    (#   2473:20  Single Ambig)
 &rst
  ixpk= 2473, nxpk= 20, iat=  -1, 370, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 406, 407, 408,1517,1518,
 &end
#
#   28 ILE  HN            0 AMB  20-1:2474   4.50    (#   2474:20  Single Ambig)
 &rst
  ixpk= 2474, nxpk= 20, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 447, 448, 372, 373,
 &end
#
#   28 ILE  HN            0 AMB  20-1:2475   4.50    (#   2475:20  Single Ambig)
 &rst
  ixpk= 2475, nxpk= 20, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 447, 448, 372, 373,
 &end
#
#  130 TRP  HH2          25 GLU  HB-         4.50    (#   2476:20  Unique         2.15, 3.08 A)
 &rst
  ixpk= 2476, nxpk= 20, iat=1957,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 372, 373,
 &end
#
#  130 TRP  HH2          25 GLU  HB+         4.50    (#   2477:20  Unique         2.15, 3.08 A)
 &rst
  ixpk= 2477, nxpk= 20, iat=1957,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 372, 373,
 &end
#
#   25 GLU  HA           25 GLU  HB-         3.50    (#   2478:20  Unique         2.43, 2.81 A)
 &rst
  ixpk= 2478, nxpk= 20, iat= 370,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 372, 373,
 &end
#
#   25 GLU  HA           25 GLU  HB+         3.50    (#   2479:20  Unique         2.43, 2.81 A)
 &rst
  ixpk= 2479, nxpk= 20, iat= 370,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 372, 373,
 &end
#
#   28 ILE  QD1          25 GLU  HB-         6.50    (#   2481:20  Unique         4.24, 5.99 A)
 &rst
  ixpk= 2481, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 425, 426, 427,
 igr2= 372, 373,
 &end
#
#    0 AMB  20-2:2482     0 AMB  20-1:2482   6.50    (#   2482:20  Double Ambig)
 &rst
  ixpk= 2482, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1= 425, 426, 427, 595, 596, 597,
 igr2= 372, 373, 447, 448,
 &end
#
#  130 TRP  HH2          25 GLU  HG-         6.50    (#   2483:20  Unique         3.34, 4.33 A)
 &rst
  ixpk= 2483, nxpk= 20, iat=1957,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 375, 376,
 &end
#
#  130 TRP  HE3          25 GLU  HG+         5.50    (#   2484:20  Unique         5.02, 6.25 A)
 &rst
  ixpk= 2484, nxpk= 20, iat=1961,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 375, 376,
 &end
#
#   26 LEU  HA           25 GLU  HG-         5.50    (#   2485:20  Unique         4.19, 5.21 A)
 &rst
  ixpk= 2485, nxpk= 20, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 375, 376,
 &end
#
#   26 LEU  HA           25 GLU  HG+         6.50    (#   2486:20  Unique         4.19, 5.21 A)
 &rst
  ixpk= 2486, nxpk= 20, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 375, 376,
 &end
#
#   28 ILE  QD1          25 GLU  HG-         6.50    (#   2489:20  Unique         3.52, 5.41 A)
 &rst
  ixpk= 2489, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 425, 426, 427,
 igr2= 375, 376,
 &end
#
#   28 ILE  QD1          25 GLU  HG+         6.50    (#   2490:20  Unique         3.52, 5.41 A)
 &rst
  ixpk= 2490, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 425, 426, 427,
 igr2= 375, 376,
 &end
#
#   25 GLU  HA           26 LEU  HA          5.50    (#   2492:20  Unique         4.95, 4.98 A)
 &rst
  ixpk= 2492, nxpk= 20, iat= 370, 385, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2493    26 LEU  HA          4.50    (#   2493:20  Single Ambig)
 &rst
  ixpk= 2493, nxpk= 20, iat=  -1, 385, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 372, 373, 447, 448,
 &end
#
#   30 ARG  HB-          26 LEU  HB+         5.50    (#   2495:20  Unique         5.79, 6.97 A)
 &rst
  ixpk= 2495, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 447, 448,
 igr2= 387, 388,
 &end
#
#    0 AMB  20-2:2497     0 AMB  20-1:2497   6.50    (#   2497:20  Double Ambig)
 &rst
  ixpk= 2497, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 150, 349,
 igr2= 171, 172, 390,
 &end
#
#    0 AMB  20-2:2500    26 LEU  MDY         5.50    (#   2500:20  Single Ambig)
 &rst
  ixpk= 2500, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1031,1032, 435, 436,
 igr2= 392, 393, 394, 396, 397, 398,
 &end
#
#   30 ARG  HD+          27 ALA  HA          5.50    (#   2505:20  Unique         3.75, 5.48 A)
 &rst
  ixpk= 2505, nxpk= 20, iat=  -1, 404, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 453, 454,
 &end
#
#    0 AMB  20-2:2506    27 ALA  HA          6.50    (#   2506:20  Single Ambig)
 &rst
  ixpk= 2506, nxpk= 20, iat=  -1, 404, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 595, 596, 597, 425, 426, 427,
 &end
#
#   28 ILE  HA           27 ALA  MB          5.50    (#   2507:20  Unique         4.48, 5.06 A)
 &rst
  ixpk= 2507, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 406, 407, 408,
 &end
#
#   29 ASP  HA           28 ILE  HB          6.50    (#   2509:20  Unique         3.92, 4.57 A)
 &rst
  ixpk= 2509, nxpk= 20, iat= 433, 416, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  20-2:2510    28 ILE  HB          5.50    (#   2510:20  Single Ambig)
 &rst
  ixpk= 2510, nxpk= 20, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 406, 407, 408,1517,1518,
 &end
#
#    0 AMB  20-2:2511    28 ILE  HB          6.50    (#   2511:20  Single Ambig)
 &rst
  ixpk= 2511, nxpk= 20, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1517,1518, 358, 359, 360, 362, 363, 364,
 &end
#
#  130 TRP  HN           28 ILE  QD1         6.50    (#   2512:20  Unique         4.26, 5.06 A)
 &rst
  ixpk= 2512, nxpk= 20, iat=1942,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 425, 426, 427,
 &end
#
#   29 ASP  HN           28 ILE  QD1         6.50    (#   2513:20  Unique         4.79, 5.62 A)
 &rst
  ixpk= 2513, nxpk= 20, iat= 431,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 425, 426, 427,
 &end
#
#  130 TRP  HA           28 ILE  QD1         5.50    (#   2514:20  Unique         3.74, 4.61 A)
 &rst
  ixpk= 2514, nxpk= 20, iat=1944,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 425, 426, 427,
 &end
#
#   25 GLU  HB+          28 ILE  QD1         4.50    (#   2516:20  Unique         4.24, 5.99 A)
 &rst
  ixpk= 2516, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 372, 373,
 igr2= 425, 426, 427,
 &end
#
#   31 ALA  HN           30 ARG  HG-         5.50    (#   2520:20  Unique         3.97, 4.97 A)
 &rst
  ixpk= 2520, nxpk= 20, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 450, 451,
 &end
#
#    0 AMB  20-2:2521    30 ARG  HG-         3.50    (#   2521:20  Single Ambig)
 &rst
  ixpk= 2521, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 565, 566, 567, 569, 570, 571, 772, 773, 774, 776,
       777, 778,
 igr2= 450, 451,
 &end
#
#   30 ARG  HN           30 ARG  HD-         5.50    (#   2522:20  Unique         2.63, 4.51 A)
 &rst
  ixpk= 2522, nxpk= 20, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 453, 454,
 &end
#
#   30 ARG  HN           30 ARG  HD+         5.50    (#   2523:20  Unique         2.63, 4.51 A)
 &rst
  ixpk= 2523, nxpk= 20, iat= 443,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 453, 454,
 &end
#
#   30 ARG  HA           30 ARG  HD-         4.50    (#   2525:20  Unique         2.06, 3.42 A)
 &rst
  ixpk= 2525, nxpk= 20, iat= 445,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 453, 454,
 &end
#
#    0 AMB  20-2:2527     0 AMB  20-1:2527   4.50    (#   2527:20  Double Ambig)
 &rst
  ixpk= 2527, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 392, 393, 394, 396, 397, 398, 985, 986, 987, 989,
       990, 991,
 igr2= 453, 454, 453, 454,
 &end
#
#   99 ILE  HN           31 ALA  MB          6.50    (#   2528:20  Unique         4.86, 5.71 A)
 &rst
  ixpk= 2528, nxpk= 20, iat=1507,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 471, 472, 473,
 &end
#
#    0 AMB  20-2:2529    31 ALA  MB          5.50    (#   2529:20  Single Ambig)
 &rst
  ixpk= 2529, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 431,1555,
 igr2= 471, 472, 473,
 &end
#
#   51 VAL  HA           31 ALA  MB          6.50    (#   2530:20  Unique         6.65, 7.81 A)
 &rst
  ixpk= 2530, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 471, 472, 473,
 &end
#
#    0 AMB  20-2:2531    31 ALA  MB          4.50    (#   2531:20  Single Ambig)
 &rst
  ixpk= 2531, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 481, 433,
 igr2= 471, 472, 473,
 &end
#
#   37 PRO  HB-          31 ALA  MB          5.50    (#   2532:20  Unique         4.15, 5.79 A)
 &rst
  ixpk= 2532, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 552, 553,
 igr2= 471, 472, 473,
 &end
#
#    0 AMB  20-2:2533    32 THR  HA          6.50    (#   2533:20  Single Ambig)
 &rst
  ixpk= 2533, nxpk= 20, iat=  -1, 479, r1= 1.30, r2= 1.80, r3= 8.50, r4= 9.00,
 igr1=1530,1531, 786, 787, 416,
 &end
#
#  101 ALA  HA           32 THR  HB          6.50    (#   2535:20  Unique         2.66, 3.21 A)
 &rst
  ixpk= 2535, nxpk= 20, iat=1547, 481, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   31 ALA  HN           32 THR  MG2         6.50    (#   2536:20  Unique         4.36, 5.47 A)
 &rst
  ixpk= 2536, nxpk= 20, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 483, 484, 485,
 &end
#
#   32 THR  MG2          33 LEU  HB+         4.50    (#   2540:20  Unique         3.16, 5.46 A)
 &rst
  ixpk= 2540, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 483, 484, 485,
 igr2= 495, 496,
 &end
#
#   32 THR  MG2          33 LEU  HB-         5.50    (#   2541:20  Unique         3.16, 5.46 A)
 &rst
  ixpk= 2541, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 483, 484, 485,
 igr2= 495, 496,
 &end
#
#   33 LEU  HA           33 LEU  HG          4.50    (#   2542:20  Unique         2.97, 3.14 A)
 &rst
  ixpk= 2542, nxpk= 20, iat= 493, 498, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ILE  HA            0 AMB  20-1:2544   6.50    (#   2544:20  Single Ambig)
 &rst
  ixpk= 2544, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr2= 392, 393, 394, 396, 397, 398, 500, 501, 502, 504,
       505, 506,
 &end
#
#   94 GLN  HN           92 SER  HB+         5.50    (#   2545:20  Unique         2.69, 3.55 A)
 &rst
  ixpk= 2545, nxpk= 20, iat=1427,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1406,1407,
 &end
#
#   51 VAL  HA           34 SER  HB-         5.50    (#   2546:20  Unique         5.47, 6.02 A)
 &rst
  ixpk= 2546, nxpk= 20, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 514, 515,
 &end
#
#   37 PRO  HD-          36 GLN  HB+         4.50    (#   2547:20  Unique         2.29, 4.28 A)
 &rst
  ixpk= 2547, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 546, 547,
 igr2= 532, 533,
 &end
#
#   36 GLN  HN           36 GLN  HB-         5.50    (#   2548:20  Unique         2.66, 3.14 A)
 &rst
  ixpk= 2548, nxpk= 20, iat= 528,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 532, 533,
 &end
#
#   50 MET  HA           63 PRO  HA          5.50    (#   2549:20  Unique         2.41, 2.71 A)
 &rst
  ixpk= 2549, nxpk= 20, iat= 751, 972, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  100 LEU  HA           37 PRO  HA          5.50    (#   2550:20  Unique         2.54, 2.95 A)
 &rst
  ixpk= 2550, nxpk= 20, iat=1528, 555, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2551     0 AMB  20-1:2551   5.50    (#   2551:20  Double Ambig)
 &rst
  ixpk= 2551, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1535,1536,1537,1539,1540,1541, 952, 953, 954, 956,
       957, 958,
 igr2= 555, 972,
 &end
#
#   30 ARG  HD+          38 VAL  MGX         6.50    (#   2553:20  Unique         3.57, 6.02 A)
 &rst
  ixpk= 2553, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 453, 454,
 igr2= 565, 566, 567, 569, 570, 571,
 &end
#
#   97 VAL  HN           40 ILE  HB          6.50    (#   2556:20  Unique         3.44, 3.82 A)
 &rst
  ixpk= 2556, nxpk= 20, iat=1475, 586, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   24 LEU  HA           40 ILE  QD1         5.50    (#   2559:20  Unique         2.33, 3.73 A)
 &rst
  ixpk= 2559, nxpk= 20, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 595, 596, 597,
 &end
#
#   99 ILE  QD1          40 ILE  QD1         4.50    (#   2560:20  Unique         2.55, 4.50 A)
 &rst
  ixpk= 2560, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1520,1521,1522,
 igr2= 595, 596, 597,
 &end
#
#   42 PHE  HD           40 ILE  QG2         6.50    (#   2561:20  Unique         3.10, 4.92 A)
 &rst
  ixpk= 2561, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 626, 634,
 igr2= 588, 589, 590,
 &end
#
#   20 PHE  HZ           40 ILE  QG2         5.50    (#   2562:20  Unique         3.86, 5.84 A)
 &rst
  ixpk= 2562, nxpk= 20, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 588, 589, 590,
 &end
#
#    0 AMB  20-2:2564    40 ILE  QG2         5.50    (#   2564:20  Single Ambig)
 &rst
  ixpk= 2564, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1479, 353, 354,
 igr2= 588, 589, 590,
 &end
#
#   49 ILE  HG1-         40 ILE  QG2         6.50    (#   2565:20  Unique         2.28, 5.51 A)
 &rst
  ixpk= 2565, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 740, 741,
 igr2= 588, 589, 590,
 &end
#
#   41 HIS  HB+          41 HIS  HA          6.50    (#   2566:20  Unique         2.26, 2.67 A)
 &rst
  ixpk= 2566, nxpk= 20, iat=  -1, 603, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 605, 606,
 &end
#
#   42 PHE  HD           42 PHE  HA          5.50    (#   2569:20  Unique         2.43, 3.51 A)
 &rst
  ixpk= 2569, nxpk= 20, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 634,
 &end
#
#   47 TRP  HA           42 PHE  HA          5.50    (#   2570:20  Unique         2.28, 2.49 A)
 &rst
  ixpk= 2570, nxpk= 20, iat= 684, 620, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 PHE  HB-          42 PHE  HA          5.50    (#   2571:20  Unique         2.45, 2.78 A)
 &rst
  ixpk= 2571, nxpk= 20, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 622, 623,
 &end
#
#   42 PHE  HB+          42 PHE  HA          5.50    (#   2572:20  Unique         2.45, 2.78 A)
 &rst
  ixpk= 2572, nxpk= 20, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 622, 623,
 &end
#
#   42 PHE  HN           42 PHE  HB+         6.50    (#   2573:20  Unique         2.37, 3.24 A)
 &rst
  ixpk= 2573, nxpk= 20, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 622, 623,
 &end
#
#   42 PHE  HD           42 PHE  HB-         4.50    (#   2574:20  Unique         2.37, 3.08 A)
 &rst
  ixpk= 2574, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 626, 634,
 igr2= 622, 623,
 &end
#
#   42 PHE  HD           42 PHE  HB+         4.50    (#   2575:20  Unique         2.37, 3.08 A)
 &rst
  ixpk= 2575, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 626, 634,
 igr2= 622, 623,
 &end
#
#   42 PHE  HA           42 PHE  HB-         5.50    (#   2576:20  Unique         2.45, 2.78 A)
 &rst
  ixpk= 2576, nxpk= 20, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 622, 623,
 &end
#
#   84 LEU  MDY          42 PHE  HB-         5.50    (#   2578:20  Unique         2.21, 4.42 A)
 &rst
  ixpk= 2578, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2= 622, 623,
 &end
#
#   91 ASP  HA           43 SER  HA          6.50    (#   2580:20  Unique         3.21, 4.40 A)
 &rst
  ixpk= 2580, nxpk= 20, iat=1392, 640, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  20-2:2582    43 SER  HA          5.50    (#   2582:20  Single Ambig)
 &rst
  ixpk= 2582, nxpk= 20, iat=  -1, 640, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 653, 654, 653, 654,
 &end
#
#   43 SER  HA           43 SER  HB-         5.50    (#   2585:20  Unique         2.29, 2.54 A)
 &rst
  ixpk= 2585, nxpk= 20, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 642, 643,
 &end
#
#   43 SER  HA           44 ASP  HA          5.50    (#   2587:20  Unique         4.24, 4.46 A)
 &rst
  ixpk= 2587, nxpk= 20, iat= 640, 651, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 SER  HN           45 SER  HA          6.50    (#   2588:20  Unique         2.23, 2.94 A)
 &rst
  ixpk= 2588, nxpk= 20, iat= 661, 663, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   46 ALA  HN           45 SER  HB+         5.50    (#   2590:20  Unique         2.61, 3.96 A)
 &rst
  ixpk= 2590, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 665, 666,
 &end
#
#   46 ALA  MB           45 SER  HB-         5.50    (#   2591:20  Unique         3.54, 5.37 A)
 &rst
  ixpk= 2591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 676, 677, 678,
 igr2= 665, 666,
 &end
#
#   46 ALA  MB           45 SER  HB+         4.50    (#   2592:20  Unique         3.54, 5.37 A)
 &rst
  ixpk= 2592, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 676, 677, 678,
 igr2= 665, 666,
 &end
#
#   48 ARG  HN           46 ALA  MB          6.50    (#   2593:20  Unique         5.67, 6.57 A)
 &rst
  ixpk= 2593, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 676, 677, 678,
 &end
#
#   73 GLN  HE2-         46 ALA  MB          6.50    (#   2595:20  Unique         5.88, 7.44 A)
 &rst
  ixpk= 2595, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1109,1110,
 igr2= 676, 677, 678,
 &end
#
#   45 SER  HB-          46 ALA  MB          5.50    (#   2600:20  Unique         3.54, 5.37 A)
 &rst
  ixpk= 2600, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 665, 666,
 igr2= 676, 677, 678,
 &end
#
#   45 SER  HB+          46 ALA  MB          5.50    (#   2601:20  Unique         3.54, 5.37 A)
 &rst
  ixpk= 2601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 665, 666,
 igr2= 676, 677, 678,
 &end
#
#   73 GLN  HG-          46 ALA  MB          4.50    (#   2603:20  Unique         3.50, 5.56 A)
 &rst
  ixpk= 2603, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1104,1105,
 igr2= 676, 677, 678,
 &end
#
#   48 ARG  HN           47 TRP  HA          5.50    (#   2604:20  Unique         2.22, 2.34 A)
 &rst
  ixpk= 2604, nxpk= 20, iat= 706, 684, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 TRP  HB+          47 TRP  HA          5.50    (#   2605:20  Unique         2.24, 2.48 A)
 &rst
  ixpk= 2605, nxpk= 20, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 686, 687,
 &end
#
#   48 ARG  HN           47 TRP  HB+         5.50    (#   2606:20  Unique         2.52, 3.39 A)
 &rst
  ixpk= 2606, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 686, 687,
 &end
#
#   48 ARG  HN           47 TRP  HB-         6.50    (#   2607:20  Unique         2.52, 3.39 A)
 &rst
  ixpk= 2607, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 686, 687,
 &end
#
#   47 TRP  HN           47 TRP  HB+         6.50    (#   2608:20  Unique         2.45, 3.45 A)
 &rst
  ixpk= 2608, nxpk= 20, iat= 682,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 686, 687,
 &end
#
#   42 PHE  HE           47 TRP  HB-         5.50    (#   2609:20  Unique         2.43, 4.60 A)
 &rst
  ixpk= 2609, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 628, 632,
 igr2= 686, 687,
 &end
#
#    0 AMB  20-2:2610    47 TRP  HB-         5.50    (#   2610:20  Single Ambig)
 &rst
  ixpk= 2610, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 588, 589, 590,1246,1247,
 igr2= 686, 687,
 &end
#
#   40 ILE  QG2          47 TRP  HB+         5.50    (#   2611:20  Unique         2.85, 4.39 A)
 &rst
  ixpk= 2611, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 588, 589, 590,
 igr2= 686, 687,
 &end
#
#   49 ILE  HN           48 ARG  HA          5.50    (#   2612:20  Unique         2.16, 2.35 A)
 &rst
  ixpk= 2612, nxpk= 20, iat= 730, 708, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 ARG  HA           49 ILE  HB          6.50    (#   2613:20  Unique         4.69, 4.84 A)
 &rst
  ixpk= 2613, nxpk= 20, iat= 708, 734, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   50 MET  HN           49 ILE  QD1         5.50    (#   2614:20  Unique         4.43, 5.26 A)
 &rst
  ixpk= 2614, nxpk= 20, iat= 749,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 743, 744, 745,
 &end
#
#   27 ALA  HN           49 ILE  QD1         6.50    (#   2616:20  Unique         3.79, 5.89 A)
 &rst
  ixpk= 2616, nxpk= 20, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 743, 744, 745,
 &end
#
#   76 TRP  HH2          49 ILE  QD1         6.50    (#   2617:20  Unique         2.35, 5.01 A)
 &rst
  ixpk= 2617, nxpk= 20, iat=1155,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 743, 744, 745,
 &end
#
#   27 ALA  HA           49 ILE  QD1         6.50    (#   2618:20  Unique         4.08, 6.38 A)
 &rst
  ixpk= 2618, nxpk= 20, iat= 404,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 743, 744, 745,
 &end
#
#   72 SER  HB+          49 ILE  QD1         6.50    (#   2619:20  Unique         2.45, 7.12 A)
 &rst
  ixpk= 2619, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1090,1091,
 igr2= 743, 744, 745,
 &end
#
#   38 VAL  MGX          49 ILE  QD1         4.50    (#   2620:20  Unique         4.38, 8.03 A)
 &rst
  ixpk= 2620, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 565, 566, 567, 569, 570, 571,
 igr2= 743, 744, 745,
 &end
#
#   40 ILE  QG2          49 ILE  QD1         5.50    (#   2621:20  Unique         2.22, 4.41 A)
 &rst
  ixpk= 2621, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 588, 589, 590,
 igr2= 743, 744, 745,
 &end
#
#   49 ILE  HN           49 ILE  QG2         5.50    (#   2622:20  Unique         4.47, 4.69 A)
 &rst
  ixpk= 2622, nxpk= 20, iat= 730,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 736, 737, 738,
 &end
#
#    0 AMB  20-2:2623    49 ILE  QG2         5.50    (#   2623:20  Single Ambig)
 &rst
  ixpk= 2623, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 976, 995,
 igr2= 736, 737, 738,
 &end
#
#   27 ALA  HA           49 ILE  QG2         5.50    (#   2625:20  Unique         3.29, 4.78 A)
 &rst
  ixpk= 2625, nxpk= 20, iat= 404,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 736, 737, 738,
 &end
#
#   51 VAL  MGY          50 MET  HA          5.50    (#   2628:20  Unique         3.22, 4.75 A)
 &rst
  ixpk= 2628, nxpk= 20, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 772, 773, 774, 776, 777, 778,
 &end
#
#   64 LEU  MDY          50 MET  HB+         5.50    (#   2629:20  Unique         6.07, 8.48 A)
 &rst
  ixpk= 2629, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 985, 986, 987, 989, 990, 991,
 igr2= 753, 754,
 &end
#
#   50 MET  HN           50 MET  HG+         5.50    (#   2632:20  Unique         3.05, 3.65 A)
 &rst
  ixpk= 2632, nxpk= 20, iat= 749,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 756, 757,
 &end
#
#   50 MET  HN           50 MET  HG-         5.50    (#   2633:20  Unique         3.05, 3.65 A)
 &rst
  ixpk= 2633, nxpk= 20, iat= 749,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 756, 757,
 &end
#
#   50 MET  HA           50 MET  HG-         5.50    (#   2636:20  Unique         2.39, 2.76 A)
 &rst
  ixpk= 2636, nxpk= 20, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 756, 757,
 &end
#
#   62 VAL  HN           50 MET  ME          5.50    (#   2637:20  Unique         3.44, 4.84 A)
 &rst
  ixpk= 2637, nxpk= 20, iat= 946,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 760, 761, 762,
 &end
#
#   61 TRP  HN           50 MET  ME          6.50    (#   2638:20  Unique         5.42, 6.29 A)
 &rst
  ixpk= 2638, nxpk= 20, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 760, 761, 762,
 &end
#
#   94 GLN  HA           50 MET  ME          5.50    (#   2640:20  Unique         2.39, 3.57 A)
 &rst
  ixpk= 2640, nxpk= 20, iat=1429,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 760, 761, 762,
 &end
#
#   62 VAL  MGY          50 MET  ME          6.50    (#   2641:20  Unique         5.76, 7.51 A)
 &rst
  ixpk= 2641, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
 igr1= 952, 953, 954, 956, 957, 958,
 igr2= 760, 761, 762,
 &end
#
#   51 VAL  HN           51 VAL  HA          5.50    (#   2642:20  Unique         2.97, 2.99 A)
 &rst
  ixpk= 2642, nxpk= 20, iat= 766, 768, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   39 GLY  HN           51 VAL  HA          5.50    (#   2643:20  Unique         3.32, 3.55 A)
 &rst
  ixpk= 2643, nxpk= 20, iat= 575, 768, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 VAL  HN           51 VAL  MGY         5.50    (#   2647:20  Unique         2.18, 3.64 A)
 &rst
  ixpk= 2647, nxpk= 20, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 772, 773, 774, 776, 777, 778,
 &end
#
#   52 PRO  HG+          52 PRO  HA          5.50    (#   2651:20  Unique         2.64, 3.52 A)
 &rst
  ixpk= 2651, nxpk= 20, iat=  -1, 792, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 786, 787,
 &end
#
#   52 PRO  HG-          52 PRO  HA          3.50    (#   2652:20  Unique         2.64, 3.52 A)
 &rst
  ixpk= 2652, nxpk= 20, iat=  -1, 792, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 786, 787,
 &end
#
#   52 PRO  HD-          52 PRO  HB-         6.50    (#   2653:20  Unique         2.61, 3.64 A)
 &rst
  ixpk= 2653, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 783, 784,
 igr2= 789, 790,
 &end
#
#   52 PRO  HA           52 PRO  HB+         5.50    (#   2654:20  Unique         2.26, 2.66 A)
 &rst
  ixpk= 2654, nxpk= 20, iat= 792,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 789, 790,
 &end
#
#   52 PRO  HA           52 PRO  HB-         4.50    (#   2655:20  Unique         2.26, 2.66 A)
 &rst
  ixpk= 2655, nxpk= 20, iat= 792,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 789, 790,
 &end
#
#   52 PRO  HD+          52 PRO  HB-         5.50    (#   2656:20  Unique         2.61, 3.64 A)
 &rst
  ixpk= 2656, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 783, 784,
 igr2= 789, 790,
 &end
#
#   52 PRO  HD+          52 PRO  HB+         6.50    (#   2657:20  Unique         2.61, 3.64 A)
 &rst
  ixpk= 2657, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 783, 784,
 igr2= 789, 790,
 &end
#
#   52 PRO  HG+          52 PRO  HB-         3.50    (#   2658:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 2658, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 786, 787,
 igr2= 789, 790,
 &end
#
#    0 AMB  20-2:2659     0 AMB  20-1:2659   6.50    (#   2659:20  Double Ambig)
 &rst
  ixpk= 2659, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.39, r4=12.89,
 igr1= 500, 501, 502, 504, 505, 506, 985, 986, 987, 989,
       990, 991,
 igr2= 789, 790, 789, 790,
 &end
#
#   52 PRO  HD-          52 PRO  HG-         5.50    (#   2660:20  Unique         2.30, 2.60 A)
 &rst
  ixpk= 2660, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 783, 784,
 igr2= 786, 787,
 &end
#
#   52 PRO  HD+          52 PRO  HG-         5.50    (#   2661:20  Unique         2.30, 2.60 A)
 &rst
  ixpk= 2661, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 783, 784,
 igr2= 786, 787,
 &end
#
#   52 PRO  HD-          52 PRO  HG+         4.50    (#   2662:20  Unique         2.30, 2.60 A)
 &rst
  ixpk= 2662, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 783, 784,
 igr2= 786, 787,
 &end
#
#   51 VAL  HB           52 PRO  HG+         6.50    (#   2663:20  Unique         2.93, 4.80 A)
 &rst
  ixpk= 2663, nxpk= 20, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 786, 787,
 &end
#
#  132 LEU  MDX         132 LEU  HG          2.80    (#   2664:20  Unique         2.39, 2.65 A)
 &rst
  ixpk= 2664, nxpk= 20, iat=  -1,1987, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#   52 PRO  HB+          52 PRO  HD-         5.50    (#   2671:20  Unique         2.61, 3.64 A)
 &rst
  ixpk= 2671, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 789, 790,
 igr2= 783, 784,
 &end
#
#   52 PRO  HB+          52 PRO  HD+         4.50    (#   2672:20  Unique         2.61, 3.64 A)
 &rst
  ixpk= 2672, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 789, 790,
 igr2= 783, 784,
 &end
#
#   54 LYS  HN           54 LYS  HB+         6.50    (#   2673:20  Unique         2.34, 2.67 A)
 &rst
  ixpk= 2673, nxpk= 20, iat= 803,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 807, 808,
 &end
#
#   54 LYS  HA           54 LYS  HE+         5.50    (#   2675:20  Unique         2.15, 4.96 A)
 &rst
  ixpk= 2675, nxpk= 20, iat= 805,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 816, 817,
 &end
#
#   55 THR  HB           54 LYS  HE+         6.50    (#   2676:20  Unique         3.83, 6.17 A)
 &rst
  ixpk= 2676, nxpk= 20, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 816, 817,
 &end
#
#   56 PRO  HD-          54 LYS  HE+         6.50    (#   2677:20  Unique         6.02, 8.18 A)
 &rst
  ixpk= 2677, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 840, 841,
 igr2= 816, 817,
 &end
#
#   56 PRO  HD+          54 LYS  HE+         6.50    (#   2678:20  Unique         6.02, 8.18 A)
 &rst
  ixpk= 2678, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 840, 841,
 igr2= 816, 817,
 &end
#
#    0 AMB  20-2:2681    55 THR  HB          5.50    (#   2681:20  Single Ambig)
 &rst
  ixpk= 2681, nxpk= 20, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 843, 844, 843, 844,
 &end
#
#    0 AMB  20-2:2682     0 AMB  20-1:2682   5.50    (#   2682:20  Double Ambig)
 &rst
  ixpk= 2682, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2107, 825,
 igr2=2034,2035,2036, 831, 832, 833,
 &end
#
#    0 AMB  20-2:2684    55 THR  MG2         3.50    (#   2684:20  Single Ambig)
 &rst
  ixpk= 2684, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 905, 906, 905, 906,
 igr2= 831, 832, 833,
 &end
#
#   56 PRO  HA           56 PRO  HB-         3.50    (#   2685:20  Unique         2.27, 2.53 A)
 &rst
  ixpk= 2685, nxpk= 20, iat= 849,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 846, 847,
 &end
#
#   84 LEU  MDY          89 PRO  HD-         5.50    (#   2687:20  Unique         2.73, 7.15 A)
 &rst
  ixpk= 2687, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1365,1366,
 &end
#
#   84 LEU  HB-          89 PRO  HD-         6.50    (#   2688:20  Unique         3.04, 5.44 A)
 &rst
  ixpk= 2688, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1276,1277,
 igr2=1365,1366,
 &end
#
#    0 AMB  20-2:2692    60 ARG  HA          6.50    (#   2692:20  Single Ambig)
 &rst
  ixpk= 2692, nxpk= 20, iat=  -1, 900, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 908, 909, 908, 909,
 &end
#
#   60 ARG  HN           60 ARG  HB+         5.50    (#   2693:20  Unique         2.17, 3.04 A)
 &rst
  ixpk= 2693, nxpk= 20, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 902, 903,
 &end
#
#   60 ARG  HN           60 ARG  HB-         5.50    (#   2694:20  Unique         2.17, 3.04 A)
 &rst
  ixpk= 2694, nxpk= 20, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 902, 903,
 &end
#
#   61 TRP  HN           60 ARG  HB-         4.50    (#   2696:20  Unique         3.63, 4.14 A)
 &rst
  ixpk= 2696, nxpk= 20, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 902, 903,
 &end
#
#    0 AMB  20-2:2698     0 AMB  20-1:2698   4.50    (#   2698:20  Double Ambig)
 &rst
  ixpk= 2698, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 831, 832, 833, 835,
 igr2= 905, 906, 905, 906, 905, 906,
 &end
#
#   61 TRP  HN            0 AMB  20-1:2699   5.50    (#   2699:20  Single Ambig)
 &rst
  ixpk= 2699, nxpk= 20, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 908, 909, 908, 909,
 &end
#
#   60 ARG  HA            0 AMB  20-1:2700   4.50    (#   2700:20  Single Ambig)
 &rst
  ixpk= 2700, nxpk= 20, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 908, 909, 908, 909,
 &end
#
#    0 AMB  20-2:2701     0 AMB  20-1:2701   3.50    (#   2701:20  Double Ambig)
 &rst
  ixpk= 2701, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 905, 906, 905, 906, 905, 906,
 igr2= 908, 909, 908, 909, 908, 909,
 &end
#
#   26 LEU  MDY          30 ARG  HD+         5.50    (#   2702:20  Unique         2.40, 5.98 A)
 &rst
  ixpk= 2702, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 392, 393, 394, 396, 397, 398,
 igr2= 453, 454,
 &end
#
#   62 VAL  HN           61 TRP  HA          5.50    (#   2703:20  Unique         2.05, 2.14 A)
 &rst
  ixpk= 2703, nxpk= 20, iat= 946, 924, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 VAL  HN           61 TRP  HB-         6.50    (#   2704:20  Unique         2.75, 3.49 A)
 &rst
  ixpk= 2704, nxpk= 20, iat= 946,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 926, 927,
 &end
#
#   61 TRP  HN           61 TRP  HB-         4.50    (#   2705:20  Unique         2.36, 3.13 A)
 &rst
  ixpk= 2705, nxpk= 20, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 926, 927,
 &end
#
#   61 TRP  HN           61 TRP  HB+         6.50    (#   2706:20  Unique         2.36, 3.13 A)
 &rst
  ixpk= 2706, nxpk= 20, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 926, 927,
 &end
#
#   61 TRP  HD1          61 TRP  HB-         5.50    (#   2707:20  Unique         2.52, 3.10 A)
 &rst
  ixpk= 2707, nxpk= 20, iat= 930,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 926, 927,
 &end
#
#   61 TRP  HA           61 TRP  HB+         6.50    (#   2708:20  Unique         2.50, 2.78 A)
 &rst
  ixpk= 2708, nxpk= 20, iat= 924,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 926, 927,
 &end
#
#   50 MET  ME           61 TRP  HB-         5.50    (#   2710:20  Unique         2.14, 3.57 A)
 &rst
  ixpk= 2710, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 760, 761, 762,
 igr2= 926, 927,
 &end
#
#    0 AMB  20-2:2712     0 AMB  20-1:2712   5.50    (#   2712:20  Double Ambig)
 &rst
  ixpk= 2712, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1402,1658,
 igr2=1434,1435,1315,1316,1315,1316,
 &end
#
#   94 GLN  HN           94 GLN  HG-         5.50    (#   2713:20  Unique         2.55, 2.92 A)
 &rst
  ixpk= 2713, nxpk= 20, iat=1427,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1434,1435,
 &end
#
#   96 GLN  HE2-         94 GLN  HG-         4.50    (#   2714:20  Unique         3.64, 5.73 A)
 &rst
  ixpk= 2714, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1470,1471,
 igr2=1434,1435,
 &end
#
#   65 GLN  HE2+         65 GLN  HG+         5.50    (#   2715:20  Unique         2.21, 3.28 A)
 &rst
  ixpk= 2715, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1007,1008,
 igr2=1002,1003,
 &end
#
#   60 ARG  HA           62 VAL  MGX         6.50    (#   2718:20  Unique         5.95, 8.24 A)
 &rst
  ixpk= 2718, nxpk= 20, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#    0 AMB  20-2:2720    62 VAL  MGY         4.50    (#   2720:20  Single Ambig)
 &rst
  ixpk= 2720, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 978, 792,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#    0 AMB  20-2:2721    62 VAL  MGY         6.50    (#   2721:20  Single Ambig)
 &rst
  ixpk= 2721, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1= 532, 533, 447, 448,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   50 MET  HA           63 PRO  HB-         6.50    (#   2722:20  Unique         4.55, 5.15 A)
 &rst
  ixpk= 2722, nxpk= 20, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 969, 970,
 &end
#
#   50 MET  HA           63 PRO  HB+         5.50    (#   2723:20  Unique         4.55, 5.15 A)
 &rst
  ixpk= 2723, nxpk= 20, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 969, 970,
 &end
#
#   63 PRO  HA           64 LEU  HA          5.50    (#   2725:20  Unique         4.24, 4.35 A)
 &rst
  ixpk= 2725, nxpk= 20, iat= 972, 978, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 ILE  HB           64 LEU  HB+         4.50    (#   2727:20  Unique         2.18, 2.83 A)
 &rst
  ixpk= 2727, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 980, 981,
 &end
#
#   65 GLN  HN           64 LEU  HG          5.50    (#   2728:20  Unique         3.00, 4.48 A)
 &rst
  ixpk= 2728, nxpk= 20, iat= 995, 983, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 LEU  HB+          64 LEU  HG          3.50    (#   2730:20  Unique         2.25, 2.67 A)
 &rst
  ixpk= 2730, nxpk= 20, iat=  -1, 983, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 980, 981,
 &end
#
#   20 PHE  HD           26 LEU  MDX         6.50    (#   2731:20  Unique         7.43,11.27 A)
 &rst
  ixpk= 2731, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 303, 311,
 igr2= 392, 393, 394, 396, 397, 398,
 &end
#
#    0 AMB  20-2:2738     0 AMB  20-1:2738   4.50    (#   2738:20  Double Ambig)
 &rst
  ixpk= 2738, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1824,1825,1826,1828,1829,1830, 985, 986, 987, 989,
       990, 991,
 igr2=1790,1791, 999,1000,
 &end
#
#   64 LEU  HN           65 GLN  HG-         5.50    (#   2739:20  Unique         4.01, 5.84 A)
 &rst
  ixpk= 2739, nxpk= 20, iat= 976,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1002,1003,
 &end
#
#   87 PHE  HN            0 AMB  20-1:2740   5.50    (#   2740:20  Single Ambig)
 &rst
  ixpk= 2740, nxpk= 20, iat=1322,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1298,1299,1298,1299,
 &end
#
#   66 GLU  HN           66 GLU  HA          3.50    (#   2741:20  Unique         2.24, 2.83 A)
 &rst
  ixpk= 2741, nxpk= 20, iat=1012,1014, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   71 GLU  HB-           0 AMB  20-1:2750   5.50    (#   2750:20  Single Ambig)
 &rst
  ixpk= 2750, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1075,1076,
 igr2=1043,1044,1045,1053,1054,1055,
 &end
#
#    0 AMB  20-2:2751    69 ALA  HA          5.50    (#   2751:20  Single Ambig)
 &rst
  ixpk= 2751, nxpk= 20, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 999,1000,1016,1017,
 &end
#
#    0 AMB  20-2:2752    68 ALA  HA          6.50    (#   2752:20  Single Ambig)
 &rst
  ixpk= 2752, nxpk= 20, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1075,1076, 999,1000,
 &end
#
#    0 AMB  20-2:2756     0 AMB  20-1:2756   5.50    (#   2756:20  Double Ambig)
 &rst
  ixpk= 2756, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1=1078,1079,1078,1079,1019,1020,1019,1020,1002,1003,
      
 igr2=1063,1064,1031,1032,
 &end
#
#    0 AMB  20-2:2762    72 SER  HB-         5.50    (#   2762:20  Single Ambig)
 &rst
  ixpk= 2762, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1002,1003, 969, 970,
 igr2=1090,1091,
 &end
#
#    0 AMB  20-2:2763     0 AMB  20-1:2763   5.50    (#   2763:20  Double Ambig)
 &rst
  ixpk= 2763, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1002,1003, 969, 970,
 igr2=1090,1091,1090,1091,
 &end
#
#    0 AMB  20-2:2765    72 SER  HB-         4.50    (#   2765:20  Single Ambig)
 &rst
  ixpk= 2765, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 980, 981, 740, 741,
 igr2=1090,1091,
 &end
#
#  125 VAL  MGY         127 SER  HB+         5.50    (#   2766:20  Unique         4.30, 7.67 A)
 &rst
  ixpk= 2766, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1892,1893,1894,1896,1897,1898,
 igr2=1917,1918,
 &end
#
#    0 AMB  20-2:2767     0 AMB  20-1:2767   6.50    (#   2767:20  Double Ambig)
 &rst
  ixpk= 2767, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.81, r4=12.31,
 igr1= 985, 986, 987, 989, 990, 991, 743, 744, 745,
 igr2=1090,1091,1090,1091,
 &end
#
#   65 GLN  HB+          72 SER  HB+         4.50    (#   2768:20  Unique         2.44, 5.61 A)
 &rst
  ixpk= 2768, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 999,1000,
 igr2=1090,1091,
 &end
#
#    0 AMB  20-2:2769     0 AMB  20-1:2769   5.50    (#   2769:20  Double Ambig)
 &rst
  ixpk= 2769, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 980, 981, 740, 741, 710, 711,
 igr2=1090,1091,1090,1091,1090,1091,
 &end
#
#  108 PHE  HE          126 CYS  HB+         5.50    (#   2771:20  Unique         2.89, 4.71 A)
 &rst
  ixpk= 2771, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1648,1652,
 igr2=1906,1907,
 &end
#
#   93 ASN  HB-          93 ASN  HA          4.50    (#   2777:20  Unique         2.38, 2.72 A)
 &rst
  ixpk= 2777, nxpk= 20, iat=  -1,1415, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1417,1418,
 &end
#
#    0 AMB  20-2:2778     0 AMB  20-1:2778   4.50    (#   2778:20  Double Ambig)
 &rst
  ixpk= 2778, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 760, 761, 762, 710, 711,
 igr2=1415,1116,
 &end
#
#   78 GLU  HN           77 ASP  HB-         4.50    (#   2779:20  Unique         2.36, 3.55 A)
 &rst
  ixpk= 2779, nxpk= 20, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1168,1169,
 &end
#
#   77 ASP  HA           77 ASP  HB-         3.50    (#   2781:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 2781, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1168,1169,
 &end
#
#  112 MET  ME           77 ASP  HB-         5.50    (#   2782:20  Unique         6.07, 7.53 A)
 &rst
  ixpk= 2782, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1718,1719,1720,
 igr2=1168,1169,
 &end
#
#   77 ASP  HA           78 GLU  HG+         5.50    (#   2786:20  Unique         3.85, 4.91 A)
 &rst
  ixpk= 2786, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1183,1184,
 &end
#
#   77 ASP  HA           78 GLU  HG-         4.50    (#   2787:20  Unique         3.85, 4.91 A)
 &rst
  ixpk= 2787, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1183,1184,
 &end
#
#   80 LEU  HN           79 GLU  HA          3.50    (#   2788:20  Unique         2.87, 3.08 A)
 &rst
  ixpk= 2788, nxpk= 20, iat=1206,1193, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  115 ALA  HN           79 GLU  HB-         6.50    (#   2790:20  Unique         3.29, 4.47 A)
 &rst
  ixpk= 2790, nxpk= 20, iat=1748,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1195,1196,
 &end
#
#    0 AMB  20-2:2791     0 AMB  20-1:2791   6.50    (#   2791:20  Double Ambig)
 &rst
  ixpk= 2791, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1748,1176,
 igr2=1195,1196,1195,1196,
 &end
#
#   79 GLU  HA           79 GLU  HB+         3.50    (#   2792:20  Unique         2.38, 2.68 A)
 &rst
  ixpk= 2792, nxpk= 20, iat=1193,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1195,1196,
 &end
#
#   79 GLU  HA           79 GLU  HB-         3.50    (#   2793:20  Unique         2.38, 2.68 A)
 &rst
  ixpk= 2793, nxpk= 20, iat=1193,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1195,1196,
 &end
#
#    9 ALA  HA           79 GLU  HB-         5.50    (#   2794:20  Unique         2.35, 3.67 A)
 &rst
  ixpk= 2794, nxpk= 20, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1195,1196,
 &end
#
#   80 LEU  MDX          79 GLU  HB-         6.50    (#   2795:20  Unique         2.67, 6.26 A)
 &rst
  ixpk= 2795, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1215,1216,1217,1219,1220,1221,
 igr2=1195,1196,
 &end
#
#    0 AMB  20-2:2796    79 GLU  HB-         6.50    (#   2796:20  Single Ambig)
 &rst
  ixpk= 2796, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.09, r4=10.59,
 igr1=1213, 116, 117, 118, 120, 121, 122,
 igr2=1195,1196,
 &end
#
#    0 AMB  20-2:2799     0 AMB  20-1:2799   3.50    (#   2799:20  Double Ambig)
 &rst
  ixpk= 2799, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1195,1196, 171, 172,
 igr2=1198,1199,1198,1199,
 &end
#
#    0 AMB  20-2:2800    79 GLU  HG-         3.50    (#   2800:20  Single Ambig)
 &rst
  ixpk= 2800, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1195,1196, 171, 172,
 igr2=1198,1199,
 &end
#
#   81 SER  HN           80 LEU  HB-         5.50    (#   2803:20  Unique         2.37, 3.35 A)
 &rst
  ixpk= 2803, nxpk= 20, iat=1225,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1210,1211,
 &end
#
#   80 LEU  HG           80 LEU  HB-         4.50    (#   2807:20  Unique         2.30, 2.65 A)
 &rst
  ixpk= 2807, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1210,1211,
 &end
#
#   80 LEU  HG           80 LEU  HB+         4.50    (#   2808:20  Unique         2.30, 2.65 A)
 &rst
  ixpk= 2808, nxpk= 20, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1210,1211,
 &end
#
#    0 AMB  20-2:2809    80 LEU  HG          5.50    (#   2809:20  Single Ambig)
 &rst
  ixpk= 2809, nxpk= 20, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 237, 164,
 &end
#
#   80 LEU  HA           80 LEU  HG          5.50    (#   2810:20  Unique         3.06, 3.37 A)
 &rst
  ixpk= 2810, nxpk= 20, iat=1208,1213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 ARG  HD-          80 LEU  HG          6.50    (#   2812:20  Unique         4.60, 5.99 A)
 &rst
  ixpk= 2812, nxpk= 20, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 174, 175,
 &end
#
#    9 ALA  HA           80 LEU  MDX         5.50    (#   2814:20  Unique         2.26, 4.49 A)
 &rst
  ixpk= 2814, nxpk= 20, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#   82 ILE  QD1          80 LEU  MDX         5.50    (#   2815:20  Unique         2.53, 5.06 A)
 &rst
  ixpk= 2815, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1249,1250,1251,
 igr2=1215,1216,1217,1219,1220,1221,
 &end
#
#    0 AMB  20-2:2816     0 AMB  20-1:2816   5.50    (#   2816:20  Double Ambig)
 &rst
  ixpk= 2816, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 237,2011, 222,
 igr2=1215,1216,1217,1219,1220,1221,1876,1877,1878,1880,
      1881,1882,
 &end
#
#   80 LEU  HB+          81 SER  HA          6.50    (#   2817:20  Unique         4.02, 4.51 A)
 &rst
  ixpk= 2817, nxpk= 20, iat=  -1,1227, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1210,1211,
 &end
#
#  113 ALA  HN           82 ILE  HA          6.50    (#   2819:20  Unique         3.29, 3.65 A)
 &rst
  ixpk= 2819, nxpk= 20, iat=1724,1238, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   82 ILE  HB           82 ILE  HA          5.50    (#   2820:20  Unique         2.96, 2.97 A)
 &rst
  ixpk= 2820, nxpk= 20, iat=1240,1238, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  110 LEU  MDX          82 ILE  HA          5.50    (#   2821:20  Unique         3.88, 5.98 A)
 &rst
  ixpk= 2821, nxpk= 20, iat=  -1,1238, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1678,1679,1680,1682,1683,1684,
 &end
#
#   82 ILE  HG1-         82 ILE  HA          6.50    (#   2822:20  Unique         2.32, 3.00 A)
 &rst
  ixpk= 2822, nxpk= 20, iat=  -1,1238, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1246,1247,
 &end
#
#   83 HIS  HN           82 ILE  HB          6.50    (#   2823:20  Unique         4.20, 4.33 A)
 &rst
  ixpk= 2823, nxpk= 20, iat=1255,1240, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  20-2:2824    82 ILE  HB          6.50    (#   2824:20  Single Ambig)
 &rst
  ixpk= 2824, nxpk= 20, iat=  -1,1240, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1229,1230,1229,1230,
 &end
#
#  111 LEU  HN           82 ILE  QD1         6.50    (#   2826:20  Unique         6.27, 7.18 A)
 &rst
  ixpk= 2826, nxpk= 20, iat=1688,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1249,1250,1251,
 &end
#
#   82 ILE  HN           82 ILE  QD1         5.50    (#   2827:20  Unique         3.16, 3.92 A)
 &rst
  ixpk= 2827, nxpk= 20, iat=1236,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1249,1250,1251,
 &end
#
#    0 AMB  20-2:2831    82 ILE  QG2         6.50    (#   2831:20  Single Ambig)
 &rst
  ixpk= 2831, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1157,1268,
 igr2=1242,1243,1244,
 &end
#
#    0 AMB  20-2:2832    82 ILE  QG2         5.50    (#   2832:20  Single Ambig)
 &rst
  ixpk= 2832, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 620,1709,
 igr2=1242,1243,1244,
 &end
#
#  112 MET  HG-          82 ILE  QG2         5.50    (#   2833:20  Unique         4.16, 5.87 A)
 &rst
  ixpk= 2833, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1714,1715,
 igr2=1242,1243,1244,
 &end
#
#  112 MET  ME           82 ILE  QG2         6.50    (#   2834:20  Unique         4.99, 7.27 A)
 &rst
  ixpk= 2834, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.37, r4= 9.87,
 igr1=1718,1719,1720,
 igr2=1242,1243,1244,
 &end
#
#    0 AMB  20-2:2835    82 ILE  QG2         5.50    (#   2835:20  Single Ambig)
 &rst
  ixpk= 2835, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=1876,1877,1878,1880,1881,1882,1215,1216,1217,1219,
      1220,1221,1481,1482,1483,1485,1486,1487,
 igr2=1242,1243,1244,
 &end
#
#   83 HIS  HN           83 HIS  HB+         4.50    (#   2837:20  Unique         2.59, 3.30 A)
 &rst
  ixpk= 2837, nxpk= 20, iat=1255,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1259,1260,
 &end
#
#   84 LEU  HN           83 HIS  HB-         6.50    (#   2838:20  Unique         2.68, 3.74 A)
 &rst
  ixpk= 2838, nxpk= 20, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1259,1260,
 &end
#
#  111 LEU  HB+          83 HIS  HB+         5.50    (#   2839:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 2839, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1692,1693,
 igr2=1259,1260,
 &end
#
#  111 LEU  HB+          83 HIS  HB-         5.50    (#   2840:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 2840, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1692,1693,
 igr2=1259,1260,
 &end
#
#   85 GLN  HN           84 LEU  HB+         5.50    (#   2842:20  Unique         2.20, 3.78 A)
 &rst
  ixpk= 2842, nxpk= 20, iat=1291,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1276,1277,
 &end
#
#    0 AMB  20-2:2847    84 LEU  HG          3.50    (#   2847:20  Single Ambig)
 &rst
  ixpk= 2847, nxpk= 20, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1276,1277,1462,1463,
 &end
#
#  110 LEU  HN           84 LEU  MDX         6.50    (#   2848:20  Unique         4.04, 6.48 A)
 &rst
  ixpk= 2848, nxpk= 20, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:2849    84 LEU  MDX         5.50    (#   2849:20  Single Ambig)
 &rst
  ixpk= 2849, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 620,1660,1690,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   89 PRO  HD+          84 LEU  MDX         6.50    (#   2851:20  Unique         2.73, 7.15 A)
 &rst
  ixpk= 2851, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1365,1366,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:2852    84 LEU  MDX         5.50    (#   2852:20  Single Ambig)
 &rst
  ixpk= 2852, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1298,1299,1298,1299,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:2853    84 LEU  MDX         6.50    (#   2853:20  Single Ambig)
 &rst
  ixpk= 2853, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1= 622, 623,1465,1466,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   85 GLN  HN           84 LEU  MDY         6.50    (#   2854:20  Unique         1.92, 4.04 A)
 &rst
  ixpk= 2854, nxpk= 20, iat=1291,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:2856    84 LEU  MDY         5.50    (#   2856:20  Single Ambig)
 &rst
  ixpk= 2856, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1374,1293,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  20-2:2857    84 LEU  MDY         6.50    (#   2857:20  Single Ambig)
 &rst
  ixpk= 2857, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1=1355,1356,1355,1356,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  HB+          85 GLN  HA          4.50    (#   2858:20  Unique         4.12, 5.13 A)
 &rst
  ixpk= 2858, nxpk= 20, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1276,1277,
 &end
#
#   85 GLN  HN           85 GLN  HB+         5.50    (#   2859:20  Unique         2.76, 3.44 A)
 &rst
  ixpk= 2859, nxpk= 20, iat=1291,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1295,1296,
 &end
#
#   85 GLN  HN           85 GLN  HB-         4.50    (#   2860:20  Unique         2.76, 3.44 A)
 &rst
  ixpk= 2860, nxpk= 20, iat=1291,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1295,1296,
 &end
#
#    0 AMB  20-2:2864     0 AMB  20-1:2864   5.50    (#   2864:20  Double Ambig)
 &rst
  ixpk= 2864, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1303,1304,1303,1304,
 igr2=1298,1299,1298,1299,
 &end
#
#   87 PHE  HD           86 PRO  HD+         5.50    (#   2865:20  Unique         2.39, 5.43 A)
 &rst
  ixpk= 2865, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1330,1338,
 igr2=1309,1310,
 &end
#
#   87 PHE  HN           86 PRO  HD+         5.50    (#   2867:20  Unique         2.56, 3.37 A)
 &rst
  ixpk= 2867, nxpk= 20, iat=1322,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1309,1310,
 &end
#
#   87 PHE  HN           86 PRO  HD-         5.50    (#   2868:20  Unique         2.56, 3.37 A)
 &rst
  ixpk= 2868, nxpk= 20, iat=1322,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1309,1310,
 &end
#
#  108 PHE  HA           86 PRO  HD+         5.50    (#   2869:20  Unique         2.00, 2.67 A)
 &rst
  ixpk= 2869, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1309,1310,
 &end
#
#  108 PHE  HA           86 PRO  HD-         5.50    (#   2870:20  Unique         2.00, 2.67 A)
 &rst
  ixpk= 2870, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1309,1310,
 &end
#
#   86 PRO  HA           86 PRO  HD+         5.50    (#   2871:20  Unique         3.62, 3.86 A)
 &rst
  ixpk= 2871, nxpk= 20, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1309,1310,
 &end
#
#   87 PHE  HB-          87 PHE  HA          6.50    (#   2874:20  Unique         2.26, 2.67 A)
 &rst
  ixpk= 2874, nxpk= 20, iat=  -1,1324, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1326,1327,
 &end
#
#   87 PHE  HB+          87 PHE  HA          5.50    (#   2875:20  Unique         2.26, 2.67 A)
 &rst
  ixpk= 2875, nxpk= 20, iat=  -1,1324, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1326,1327,
 &end
#
#   96 GLN  HA           87 PHE  HB+         6.50    (#   2876:20  Unique         2.76, 4.56 A)
 &rst
  ixpk= 2876, nxpk= 20, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1326,1327,
 &end
#
#   96 GLN  HA           87 PHE  HB-         6.50    (#   2877:20  Unique         2.76, 4.56 A)
 &rst
  ixpk= 2877, nxpk= 20, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1326,1327,
 &end
#
#   96 GLN  HG+          87 PHE  HB-         6.50    (#   2878:20  Unique         2.19, 3.61 A)
 &rst
  ixpk= 2878, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1465,1466,
 igr2=1326,1327,
 &end
#
#    0 AMB  20-2:2879    87 PHE  HB-         6.50    (#   2879:20  Single Ambig)
 &rst
  ixpk= 2879, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1315,1316,1315,1316,1434,1435,
 igr2=1326,1327,
 &end
#
#    0 AMB  20-2:2880     0 AMB  20-1:2880   6.50    (#   2880:20  Double Ambig)
 &rst
  ixpk= 2880, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.81, r4=12.31,
 igr1=1315,1316,1315,1316,1434,1435,
 igr2=1326,1327,1326,1327,1326,1327,
 &end
#
#    0 AMB  20-2:2881    87 PHE  HB-         6.50    (#   2881:20  Single Ambig)
 &rst
  ixpk= 2881, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1352,1353,1346,1347,
 igr2=1326,1327,
 &end
#
#   88 LYS  HD+          87 PHE  HB+         5.50    (#   2882:20  Unique         3.41, 6.22 A)
 &rst
  ixpk= 2882, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1352,1353,
 igr2=1326,1327,
 &end
#
#   88 LYS  HN           88 LYS  HA          6.50    (#   2885:20  Unique         2.36, 2.80 A)
 &rst
  ixpk= 2885, nxpk= 20, iat=1342,1344, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   89 PRO  HD+          88 LYS  HB+         4.50    (#   2886:20  Unique         2.30, 4.00 A)
 &rst
  ixpk= 2886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1365,1366,
 igr2=1346,1347,
 &end
#
#   87 PHE  HB-          88 LYS  HB+         6.50    (#   2887:20  Unique         4.24, 6.22 A)
 &rst
  ixpk= 2887, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1326,1327,
 igr2=1346,1347,
 &end
#
#    0 AMB  20-2:2888    88 LYS  HB-         5.50    (#   2888:20  Single Ambig)
 &rst
  ixpk= 2888, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1355,1356,1355,1356,
 igr2=1346,1347,
 &end
#
#   89 PRO  HD+          88 LYS  HG+         4.50    (#   2889:20  Unique         3.59, 5.37 A)
 &rst
  ixpk= 2889, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1365,1366,
 igr2=1349,1350,
 &end
#
#   88 LYS  HN            0 AMB  20-1:2893   5.50    (#   2893:20  Single Ambig)
 &rst
  ixpk= 2893, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1355,1356,1355,1356,
 &end
#
#   84 LEU  MDY          89 PRO  HB-         6.50    (#   2899:20  Unique         2.40, 6.23 A)
 &rst
  ixpk= 2899, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1371,1372,
 &end
#
#   84 LEU  MDY          89 PRO  HB+         6.50    (#   2900:20  Unique         2.40, 6.23 A)
 &rst
  ixpk= 2900, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1371,1372,
 &end
#
#    0 AMB  20-2:2901     0 AMB  20-1:2901   5.50    (#   2901:20  Double Ambig)
 &rst
  ixpk= 2901, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 622, 623,1465,1466,
 igr2=1371,1372,1371,1372,
 &end
#
#   43 SER  HA           89 PRO  HB+         5.50    (#   2902:20  Unique         2.42, 4.07 A)
 &rst
  ixpk= 2902, nxpk= 20, iat= 640,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1371,1372,
 &end
#
#   84 LEU  HN           89 PRO  HB+         5.50    (#   2903:20  Unique         1.92, 3.24 A)
 &rst
  ixpk= 2903, nxpk= 20, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1371,1372,
 &end
#
#   84 LEU  HN           89 PRO  HB-         4.50    (#   2904:20  Unique         1.92, 3.24 A)
 &rst
  ixpk= 2904, nxpk= 20, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1371,1372,
 &end
#
#   84 LEU  MDY          89 PRO  HD+         5.50    (#   2905:20  Unique         2.73, 7.15 A)
 &rst
  ixpk= 2905, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1281,1282,1283,1285,1286,1287,
 igr2=1365,1366,
 &end
#
#   43 SER  HA           91 ASP  HA          6.50    (#   2906:20  Unique         3.21, 4.40 A)
 &rst
  ixpk= 2906, nxpk= 20, iat= 640,1392, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   90 ASP  HB-          91 ASP  HA          5.50    (#   2907:20  Unique         4.85, 5.59 A)
 &rst
  ixpk= 2907, nxpk= 20, iat=  -1,1392, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1382,1383,
 &end
#
#   50 MET  ME           93 ASN  HB-         6.50    (#   2917:20  Unique         4.45, 6.61 A)
 &rst
  ixpk= 2917, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 760, 761, 762,
 igr2=1417,1418,
 &end
#
#   61 TRP  HD1          94 GLN  HA          6.50    (#   2919:20  Unique         3.13, 3.62 A)
 &rst
  ixpk= 2919, nxpk= 20, iat= 930,1429, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   95 PRO  HD-          94 GLN  HA          4.50    (#   2920:20  Unique         2.38, 2.54 A)
 &rst
  ixpk= 2920, nxpk= 20, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1445,1446,
 &end
#
#   95 PRO  HG+          94 GLN  HA          5.50    (#   2921:20  Unique         4.55, 4.68 A)
 &rst
  ixpk= 2921, nxpk= 20, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1448,1449,
 &end
#
#   94 GLN  HE2+         95 PRO  HA          5.50    (#   2925:20  Unique         4.85, 5.87 A)
 &rst
  ixpk= 2925, nxpk= 20, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1439,1440,
 &end
#
#   41 HIS  HD2          95 PRO  HA          5.50    (#   2926:20  Unique         3.26, 3.80 A)
 &rst
  ixpk= 2926, nxpk= 20, iat= 614,1454, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2928    95 PRO  HA          5.50    (#   2928:20  Single Ambig)
 &rst
  ixpk= 2928, nxpk= 20, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1448,1449,1462,1463,
 &end
#
#   42 PHE  HN           95 PRO  HB-         5.50    (#   2929:20  Unique         5.69, 6.11 A)
 &rst
  ixpk= 2929, nxpk= 20, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1451,1452,
 &end
#
#   61 TRP  HZ2          95 PRO  HB-         6.50    (#   2930:20  Unique         5.02, 5.66 A)
 &rst
  ixpk= 2930, nxpk= 20, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1451,1452,
 &end
#
#   98 VAL  HA           95 PRO  HB+         6.50    (#   2932:20  Unique         4.09, 4.97 A)
 &rst
  ixpk= 2932, nxpk= 20, iat=1493,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1451,1452,
 &end
#
#   95 PRO  HA           95 PRO  HB+         4.50    (#   2934:20  Unique         2.28, 2.52 A)
 &rst
  ixpk= 2934, nxpk= 20, iat=1454,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1451,1452,
 &end
#
#   95 PRO  HB+          95 PRO  HG+         5.50    (#   2935:20  Unique         2.35, 2.64 A)
 &rst
  ixpk= 2935, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1451,1452,
 igr2=1448,1449,
 &end
#
#   95 PRO  HD-          95 PRO  HG-         5.50    (#   2937:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 2937, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1445,1446,
 igr2=1448,1449,
 &end
#
#   95 PRO  HG+          95 PRO  HD-         6.50    (#   2938:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 2938, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1448,1449,
 igr2=1445,1446,
 &end
#
#   95 PRO  HG-          95 PRO  HD-         6.50    (#   2939:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 2939, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1448,1449,
 igr2=1445,1446,
 &end
#
#   95 PRO  HG-          95 PRO  HD+         5.50    (#   2940:20  Unique         2.29, 2.60 A)
 &rst
  ixpk= 2940, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1448,1449,
 igr2=1445,1446,
 &end
#
#   87 PHE  HZ           96 GLN  HA          5.50    (#   2942:20  Unique         4.31, 5.46 A)
 &rst
  ixpk= 2942, nxpk= 20, iat=1334,1460, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 PHE  HB+          96 GLN  HA          6.50    (#   2943:20  Unique         2.76, 4.56 A)
 &rst
  ixpk= 2943, nxpk= 20, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1326,1327,
 &end
#
#   96 GLN  HN           96 GLN  HB-         6.50    (#   2944:20  Unique         2.22, 3.01 A)
 &rst
  ixpk= 2944, nxpk= 20, iat=1458,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1462,1463,
 &end
#
#   96 GLN  HN           96 GLN  HB+         6.50    (#   2945:20  Unique         2.22, 3.01 A)
 &rst
  ixpk= 2945, nxpk= 20, iat=1458,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1462,1463,
 &end
#
#   94 GLN  HE2+         96 GLN  HB-         6.50    (#   2946:20  Unique         5.51, 6.71 A)
 &rst
  ixpk= 2946, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1439,1440,
 igr2=1462,1463,
 &end
#
#   61 TRP  HZ2          95 PRO  HG+         5.50    (#   2947:20  Unique         3.15, 3.58 A)
 &rst
  ixpk= 2947, nxpk= 20, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1448,1449,
 &end
#
#   96 GLN  HA           96 GLN  HB-         4.50    (#   2948:20  Unique         2.34, 2.79 A)
 &rst
  ixpk= 2948, nxpk= 20, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1462,1463,
 &end
#
#   96 GLN  HA           96 GLN  HB+         4.50    (#   2949:20  Unique         2.34, 2.79 A)
 &rst
  ixpk= 2949, nxpk= 20, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1462,1463,
 &end
#
#   96 GLN  HN           96 GLN  HG+         6.50    (#   2950:20  Unique         2.29, 4.02 A)
 &rst
  ixpk= 2950, nxpk= 20, iat=1458,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1465,1466,
 &end
#
#   96 GLN  HE2-          0 AMB  20-1:2951   5.50    (#   2951:20  Single Ambig)
 &rst
  ixpk= 2951, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1470,1471,
 igr2=1465,1466,1465,1466,
 &end
#
#   96 GLN  HA           96 GLN  HG-         5.50    (#   2952:20  Unique         2.31, 3.03 A)
 &rst
  ixpk= 2952, nxpk= 20, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1465,1466,
 &end
#
#  106 THR  HN           97 VAL  HA          5.50    (#   2953:20  Unique         4.48, 4.77 A)
 &rst
  ixpk= 2953, nxpk= 20, iat=1610,1477, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  HB           97 VAL  HA          6.50    (#   2954:20  Unique         5.15, 5.27 A)
 &rst
  ixpk= 2954, nxpk= 20, iat= 586,1477, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  105 ILE  QG2          97 VAL  HA          5.50    (#   2955:20  Unique         4.67, 5.59 A)
 &rst
  ixpk= 2955, nxpk= 20, iat=  -1,1477, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1597,1598,1599,
 &end
#
#   40 ILE  HG1-         97 VAL  HB          4.50    (#   2956:20  Unique         3.56, 4.51 A)
 &rst
  ixpk= 2956, nxpk= 20, iat=  -1,1479, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 592, 593,
 &end
#
#   40 ILE  QG2          97 VAL  HB          5.50    (#   2957:20  Unique         3.99, 4.67 A)
 &rst
  ixpk= 2957, nxpk= 20, iat=  -1,1479, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 588, 589, 590,
 &end
#
#  105 ILE  QG2          97 VAL  MGY         4.50    (#   2958:20  Unique         2.70, 4.98 A)
 &rst
  ixpk= 2958, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1597,1598,1599,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   40 ILE  QG2          97 VAL  MGY         5.50    (#   2959:20  Unique         4.70, 6.34 A)
 &rst
  ixpk= 2959, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 588, 589, 590,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#   99 ILE  HB           98 VAL  HA          5.50    (#   2962:20  Unique         4.26, 4.34 A)
 &rst
  ixpk= 2962, nxpk= 20, iat=1511,1493, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 ILE  QD1          98 VAL  HA          6.50    (#   2963:20  Unique         2.33, 3.52 A)
 &rst
  ixpk= 2963, nxpk= 20, iat=  -1,1493, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1520,1521,1522,
 &end
#
#   59 TRP  HH2          98 VAL  MGY         4.50    (#   2964:20  Unique         2.45, 4.78 A)
 &rst
  ixpk= 2964, nxpk= 20, iat= 889,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1497,1498,1499,1501,1502,1503,
 &end
#
#  100 LEU  HA           99 ILE  HB          5.50    (#   2965:20  Unique         4.94, 5.03 A)
 &rst
  ixpk= 2965, nxpk= 20, iat=1528,1511, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 ALA  MB           99 ILE  HB          4.50    (#   2966:20  Unique         2.82, 4.10 A)
 &rst
  ixpk= 2966, nxpk= 20, iat=  -1,1511, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 471, 472, 473,
 &end
#
#   99 ILE  HN           99 ILE  HG1-        5.50    (#   2967:20  Unique         3.59, 4.00 A)
 &rst
  ixpk= 2967, nxpk= 20, iat=1507,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1517,1518,
 &end
#
#  105 ILE  HA           99 ILE  HG1+        5.50    (#   2968:20  Unique         3.67, 4.60 A)
 &rst
  ixpk= 2968, nxpk= 20, iat=1593,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1517,1518,
 &end
#
#  105 ILE  HA           99 ILE  HG1-        5.50    (#   2969:20  Unique         3.67, 4.60 A)
 &rst
  ixpk= 2969, nxpk= 20, iat=1593,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1517,1518,
 &end
#
#  105 ILE  QG2          99 ILE  HG1-        3.50    (#   2970:20  Unique         2.16, 3.98 A)
 &rst
  ixpk= 2970, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1597,1598,1599,
 igr2=1517,1518,
 &end
#
#   38 VAL  HN           99 ILE  QD1         5.50    (#   2972:20  Unique         4.31, 5.17 A)
 &rst
  ixpk= 2972, nxpk= 20, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1520,1521,1522,
 &end
#
#    0 AMB  20-2:2973    99 ILE  QD1         5.50    (#   2973:20  Single Ambig)
 &rst
  ixpk= 2973, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 412, 443,
 igr2=1520,1521,1522,
 &end
#
#    0 AMB  20-2:2975    99 ILE  QD1         6.50    (#   2975:20  Single Ambig)
 &rst
  ixpk= 2975, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1593, 555,
 igr2=1520,1521,1522,
 &end
#
#   27 ALA  HA           99 ILE  QD1         6.50    (#   2976:20  Unique         4.58, 5.73 A)
 &rst
  ixpk= 2976, nxpk= 20, iat= 404,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1520,1521,1522,
 &end
#
#   99 ILE  HN           99 ILE  QG2         6.50    (#   2978:20  Unique         4.34, 4.62 A)
 &rst
  ixpk= 2978, nxpk= 20, iat=1507,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1513,1514,1515,
 &end
#
#   10 ASN  HA          121 LEU  MDX         5.50    (#   2980:20  Unique         2.00, 3.98 A)
 &rst
  ixpk= 2980, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  101 ALA  HA           99 ILE  QG2         5.50    (#   2981:20  Unique         4.15, 5.45 A)
 &rst
  ixpk= 2981, nxpk= 20, iat=1547,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1513,1514,1515,
 &end
#
#  100 LEU  HB+         100 LEU  HA          5.50    (#   2983:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 2983, nxpk= 20, iat=  -1,1528, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1530,1531,
 &end
#
#  100 LEU  HN          100 LEU  HB-         4.50    (#   2984:20  Unique         2.30, 3.11 A)
 &rst
  ixpk= 2984, nxpk= 20, iat=1526,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1530,1531,
 &end
#
#  102 ASP  HN          100 LEU  HB-         5.50    (#   2985:20  Unique         2.67, 3.06 A)
 &rst
  ixpk= 2985, nxpk= 20, iat=1555,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1530,1531,
 &end
#
#  100 LEU  HG          100 LEU  HB+         4.50    (#   2986:20  Unique         2.32, 2.57 A)
 &rst
  ixpk= 2986, nxpk= 20, iat=1533,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1530,1531,
 &end
#
#  101 ALA  MB          100 LEU  HB-         6.50    (#   2987:20  Unique         4.08, 5.47 A)
 &rst
  ixpk= 2987, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1549,1550,1551,
 igr2=1530,1531,
 &end
#
#   38 VAL  HN          100 LEU  MDX         5.50    (#   2988:20  Unique         4.75, 6.83 A)
 &rst
  ixpk= 2988, nxpk= 20, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#  101 ALA  HN          100 LEU  MDX         4.50    (#   2989:20  Unique         3.67, 5.04 A)
 &rst
  ixpk= 2989, nxpk= 20, iat=1545,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#  102 ASP  HN          100 LEU  MDX         5.50    (#   2990:20  Unique         4.24, 5.93 A)
 &rst
  ixpk= 2990, nxpk= 20, iat=1555,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#  102 ASP  HB+         100 LEU  MDX         5.50    (#   2991:20  Unique         3.81, 7.50 A)
 &rst
  ixpk= 2991, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1559,1560,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#    0 AMB  20-2:2992   100 LEU  MDX         3.50    (#   2992:20  Single Ambig)
 &rst
  ixpk= 2992, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 549, 550, 552, 553,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#  100 LEU  HB+         100 LEU  MDX         2.80    (#   2993:20  Unique         2.38, 3.45 A)
 &rst
  ixpk= 2993, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1530,1531,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#  105 ILE  QG2         100 LEU  MDX         5.50    (#   2994:20  Unique         4.91, 8.45 A)
 &rst
  ixpk= 2994, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1597,1598,1599,
 igr2=1535,1536,1537,1539,1540,1541,
 &end
#
#   32 THR  HA          101 ALA  HA          6.50    (#   2995:20  Unique         2.93, 3.38 A)
 &rst
  ixpk= 2995, nxpk= 20, iat= 479,1547, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  100 LEU  HB-         101 ALA  HA          5.50    (#   2999:20  Unique         4.79, 5.08 A)
 &rst
  ixpk= 2999, nxpk= 20, iat=  -1,1547, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1530,1531,
 &end
#
#   99 ILE  QG2         101 ALA  HA          5.50    (#   3000:20  Unique         4.15, 5.45 A)
 &rst
  ixpk= 3000, nxpk= 20, iat=  -1,1547, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1513,1514,1515,
 &end
#
#  103 GLY  HN          102 ASP  HB-         5.50    (#   3002:20  Unique         3.48, 4.28 A)
 &rst
  ixpk= 3002, nxpk= 20, iat=1567,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1559,1560,
 &end
#
#  101 ALA  HN          104 GLN  HG+         6.50    (#   3010:20  Unique         5.24, 7.35 A)
 &rst
  ixpk= 3010, nxpk= 20, iat=1545,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1581,1582,
 &end
#
#  126 CYS  HB-         105 ILE  QD1         6.50    (#   3016:20  Unique         5.94, 7.84 A)
 &rst
  ixpk= 3016, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1906,1907,
 igr2=1604,1605,1606,
 &end
#
#   98 VAL  HN          105 ILE  QG2         6.50    (#   3017:20  Unique         3.76, 4.56 A)
 &rst
  ixpk= 3017, nxpk= 20, iat=1491,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1597,1598,1599,
 &end
#
#  108 PHE  HE          105 ILE  QG2         4.50    (#   3018:20  Unique         2.32, 5.08 A)
 &rst
  ixpk= 3018, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1648,1652,
 igr2=1597,1598,1599,
 &end
#
#    0 AMB  20-2:3020     0 AMB  20-1:3020   4.50    (#   3020:20  Double Ambig)
 &rst
  ixpk= 3020, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 425, 426, 427,1822,
 igr2=1597,1598,1599,1752,1753,1754,
 &end
#
#   98 VAL  HN          106 THR  HA          6.50    (#   3021:20  Unique         4.53, 4.76 A)
 &rst
  ixpk= 3021, nxpk= 20, iat=1491,1612, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  105 ILE  QG2         106 THR  HA          6.50    (#   3023:20  Unique         4.40, 5.45 A)
 &rst
  ixpk= 3023, nxpk= 20, iat=  -1,1612, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1597,1598,1599,
 &end
#
#  108 PHE  HD          106 THR  HB          5.50    (#   3024:20  Unique         3.33, 5.70 A)
 &rst
  ixpk= 3024, nxpk= 20, iat=  -1,1614, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1646,1654,
 &end
#
#  105 ILE  HA          106 THR  HB          6.50    (#   3025:20  Unique         4.47, 5.63 A)
 &rst
  ixpk= 3025, nxpk= 20, iat=1593,1614, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  106 THR  HA          106 THR  HB          4.50    (#   3026:20  Unique         2.48, 2.65 A)
 &rst
  ixpk= 3026, nxpk= 20, iat=1612,1614, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  108 PHE  HD          106 THR  MG2         5.50    (#   3027:20  Unique         3.20, 7.48 A)
 &rst
  ixpk= 3027, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1646,1654,
 igr2=1616,1617,1618,
 &end
#
#  105 ILE  HA          106 THR  MG2         6.50    (#   3030:20  Unique         4.19, 5.40 A)
 &rst
  ixpk= 3030, nxpk= 20, iat=1593,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1616,1617,1618,
 &end
#
#  108 PHE  HB+         106 THR  MG2         5.50    (#   3031:20  Unique         2.91, 7.04 A)
 &rst
  ixpk= 3031, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1642,1643,
 igr2=1616,1617,1618,
 &end
#
#  126 CYS  HB-         106 THR  MG2         6.50    (#   3032:20  Unique         5.92, 8.24 A)
 &rst
  ixpk= 3032, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1906,1907,
 igr2=1616,1617,1618,
 &end
#
#    0 AMB  20-2:3034   106 THR  MG2         5.50    (#   3034:20  Single Ambig)
 &rst
  ixpk= 3034, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1906,1907, 552, 553,1601,1602,1601,1602,
 igr2=1616,1617,1618,
 &end
#
#   37 PRO  HB-         106 THR  MG2         6.50    (#   3035:20  Unique         5.94, 7.73 A)
 &rst
  ixpk= 3035, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 552, 553,
 igr2=1616,1617,1618,
 &end
#
#  105 ILE  QG2         106 THR  MG2         5.50    (#   3037:20  Unique         3.53, 6.12 A)
 &rst
  ixpk= 3037, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1597,1598,1599,
 igr2=1616,1617,1618,
 &end
#
#  105 ILE  HB          106 THR  MG2         6.50    (#   3038:20  Unique         5.73, 6.91 A)
 &rst
  ixpk= 3038, nxpk= 20, iat=1595,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1616,1617,1618,
 &end
#
#   97 VAL  MGX         106 THR  MG2         4.50    (#   3039:20  Unique         2.39, 6.52 A)
 &rst
  ixpk= 3039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1481,1482,1483,1485,1486,1487,
 igr2=1616,1617,1618,
 &end
#
#  107 PRO  HB-         107 PRO  HA          3.50    (#   3040:20  Unique         2.27, 2.63 A)
 &rst
  ixpk= 3040, nxpk= 20, iat=  -1,1634, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1631,1632,
 &end
#
#    0 AMB  20-2:3042   108 PHE  HA          5.50    (#   3042:20  Single Ambig)
 &rst
  ixpk= 3042, nxpk= 20, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1312,1313,1295,1296,
 &end
#
#   97 VAL  MGY         108 PHE  HA          6.50    (#   3043:20  Unique         5.20, 7.24 A)
 &rst
  ixpk= 3043, nxpk= 20, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   87 PHE  HZ          108 PHE  HB+         6.50    (#   3045:20  Unique         2.27, 5.36 A)
 &rst
  ixpk= 3045, nxpk= 20, iat=1334,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1642,1643,
 &end
#
#   97 VAL  MGY         108 PHE  HB-         6.50    (#   3046:20  Unique         2.74, 5.24 A)
 &rst
  ixpk= 3046, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1481,1482,1483,1485,1486,1487,
 igr2=1642,1643,
 &end
#
#   97 VAL  MGY         108 PHE  HB+         5.50    (#   3047:20  Unique         2.74, 5.24 A)
 &rst
  ixpk= 3047, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1481,1482,1483,1485,1486,1487,
 igr2=1642,1643,
 &end
#
#  108 PHE  HD          109 SER  HA          5.50    (#   3048:20  Unique         3.55, 4.95 A)
 &rst
  ixpk= 3048, nxpk= 20, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1646,1654,
 &end
#
#  108 PHE  HA          109 SER  HA          4.50    (#   3049:20  Unique         4.45, 4.52 A)
 &rst
  ixpk= 3049, nxpk= 20, iat=1640,1660, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  123 THR  MG2         109 SER  HA          5.50    (#   3050:20  Unique         4.03, 5.07 A)
 &rst
  ixpk= 3050, nxpk= 20, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1859,1860,1861,
 &end
#
#   85 GLN  HN            0 AMB  20-1:3051   5.50    (#   3051:20  Single Ambig)
 &rst
  ixpk= 3051, nxpk= 20, iat=1291,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1662,1663,1662,1663,
 &end
#
#  108 PHE  HD            0 AMB  20-1:3052   6.50    (#   3052:20  Single Ambig)
 &rst
  ixpk= 3052, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1646,1654,
 igr2=1662,1663,1662,1663,
 &end
#
#    0 AMB  20-2:3054     0 AMB  20-1:3054   4.50    (#   3054:20  Double Ambig)
 &rst
  ixpk= 3054, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2128,2129,2128,2129,2128,2129,
 igr2=1662,1663,1662,1663,1662,1663,
 &end
#
#    0 AMB  20-2:3055     0 AMB  20-1:3055   5.50    (#   3055:20  Double Ambig)
 &rst
  ixpk= 3055, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.85, r4=12.35,
 igr1=1692,1693,2125,2126,2075,2076,2075,2076,2075,2076,
      
 igr2=1662,1663,1662,1663,1662,1663,1662,1663,1662,1663,
      
 &end
#
#    0 AMB  20-2:3057   110 LEU  HB-         5.50    (#   3057:20  Single Ambig)
 &rst
  ixpk= 3057, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1688,1902,
 igr2=1673,1674,
 &end
#
#    0 AMB  20-2:3058     0 AMB  20-1:3058   5.50    (#   3058:20  Double Ambig)
 &rst
  ixpk= 3058, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1688,1902,
 igr2=1673,1674,1673,1674,
 &end
#
#  108 PHE  HE          110 LEU  HB-         5.50    (#   3059:20  Unique         2.15, 4.47 A)
 &rst
  ixpk= 3059, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1648,1652,
 igr2=1673,1674,
 &end
#
#  108 PHE  HE          110 LEU  HB+         5.50    (#   3060:20  Unique         2.15, 4.47 A)
 &rst
  ixpk= 3060, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1648,1652,
 igr2=1673,1674,
 &end
#
#    0 AMB  20-2:3061   110 LEU  MDX         5.50    (#   3061:20  Single Ambig)
 &rst
  ixpk= 3061, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1157,1268,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  123 THR  HA          110 LEU  MDX         6.50    (#   3062:20  Unique         5.24, 6.85 A)
 &rst
  ixpk= 3062, nxpk= 20, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#   82 ILE  HA          110 LEU  MDX         5.50    (#   3063:20  Unique         3.88, 5.98 A)
 &rst
  ixpk= 3063, nxpk= 20, iat=1238,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#   17 ALA  HA          110 LEU  MDX         6.50    (#   3064:20  Unique         4.53, 6.54 A)
 &rst
  ixpk= 3064, nxpk= 20, iat= 253,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  20-2:3066   110 LEU  MDX         4.50    (#   3066:20  Single Ambig)
 &rst
  ixpk= 3066, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1=1876,1877,1878,1880,1881,1882,1876,1877,1878,1880,
      1881,1882,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  111 LEU  HN          111 LEU  HA          4.50    (#   3068:20  Unique         2.94, 2.97 A)
 &rst
  ixpk= 3068, nxpk= 20, iat=1688,1690, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  110 LEU  MDX           0 AMB  20-1:3070   5.50    (#   3070:20  Single Ambig)
 &rst
  ixpk= 3070, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1678,1679,1680,1682,1683,1684,
 igr2=1690,1709,
 &end
#
#   83 HIS  HB-         111 LEU  HB-         4.50    (#   3072:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 3072, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1259,1260,
 igr2=1692,1693,
 &end
#
#   83 HIS  HB-         111 LEU  HB+         4.50    (#   3073:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 3073, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1259,1260,
 igr2=1692,1693,
 &end
#
#   83 HIS  HB+         111 LEU  HB-         4.50    (#   3074:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 3074, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1259,1260,
 igr2=1692,1693,
 &end
#
#   83 HIS  HB+         111 LEU  HB+         4.50    (#   3075:20  Unique         2.17, 3.83 A)
 &rst
  ixpk= 3075, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1259,1260,
 igr2=1692,1693,
 &end
#
#  111 LEU  HG          111 LEU  HB-         3.50    (#   3076:20  Unique         2.37, 2.83 A)
 &rst
  ixpk= 3076, nxpk= 20, iat=1695,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1692,1693,
 &end
#
#  111 LEU  HG          111 LEU  HB+         3.50    (#   3077:20  Unique         2.37, 2.83 A)
 &rst
  ixpk= 3077, nxpk= 20, iat=1695,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1692,1693,
 &end
#
#   83 HIS  HD2         111 LEU  HG          5.50    (#   3078:20  Unique         4.76, 5.02 A)
 &rst
  ixpk= 3078, nxpk= 20, iat=1268,1695, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   83 HIS  HB-         111 LEU  HG          6.50    (#   3079:20  Unique         4.58, 5.76 A)
 &rst
  ixpk= 3079, nxpk= 20, iat=  -1,1695, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1259,1260,
 &end
#
#  120 PRO  HB-         111 LEU  HG          4.50    (#   3080:20  Unique         3.07, 4.17 A)
 &rst
  ixpk= 3080, nxpk= 20, iat=  -1,1695, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1808,1809,
 &end
#
#  120 PRO  HG+         111 LEU  HG          5.50    (#   3081:20  Unique         4.30, 5.29 A)
 &rst
  ixpk= 3081, nxpk= 20, iat=  -1,1695, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1805,1806,
 &end
#
#  123 THR  MG2         111 LEU  HG          3.50    (#   3083:20  Unique         2.54, 4.39 A)
 &rst
  ixpk= 3083, nxpk= 20, iat=  -1,1695, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1859,1860,1861,
 &end
#
#   83 HIS  HD2         111 LEU  MDX         6.50    (#   3084:20  Unique         2.37, 4.52 A)
 &rst
  ixpk= 3084, nxpk= 20, iat=1268,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  113 ALA  HN          111 LEU  MDY         6.50    (#   3086:20  Unique         3.21, 6.03 A)
 &rst
  ixpk= 3086, nxpk= 20, iat=1724,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  112 MET  HN          111 LEU  MDY         5.50    (#   3087:20  Unique         1.84, 4.28 A)
 &rst
  ixpk= 3087, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#    0 AMB  20-2:3089   111 LEU  MDY         5.50    (#   3089:20  Single Ambig)
 &rst
  ixpk= 3089, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1802,1803,1802,1803,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  120 PRO  HB-         111 LEU  MDY         4.50    (#   3092:20  Unique         2.17, 4.25 A)
 &rst
  ixpk= 3092, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1808,1809,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  112 MET  HN            0 AMB  20-1:3093   5.50    (#   3093:20  Single Ambig)
 &rst
  ixpk= 3093, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1711,1712,1711,1712,
 &end
#
#  113 ALA  HN            0 AMB  20-1:3094   6.50    (#   3094:20  Single Ambig)
 &rst
  ixpk= 3094, nxpk= 20, iat=1724,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr2=1711,1712,1711,1712,
 &end
#
#  112 MET  HN          112 MET  ME          6.50    (#   3095:20  Unique         5.18, 6.08 A)
 &rst
  ixpk= 3095, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1718,1719,1720,
 &end
#
#    0 AMB  20-2:3096   112 MET  ME          6.50    (#   3096:20  Single Ambig)
 &rst
  ixpk= 3096, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 188,1886,
 igr2=1718,1719,1720,
 &end
#
#   16 THR  HN          112 MET  ME          6.50    (#   3097:20  Unique         4.17, 5.50 A)
 &rst
  ixpk= 3097, nxpk= 20, iat= 237,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1718,1719,1720,
 &end
#
#    0 AMB  20-2:3099   112 MET  ME          6.50    (#   3099:20  Single Ambig)
 &rst
  ixpk= 3099, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 200, 297,
 igr2=1718,1719,1720,
 &end
#
#   20 PHE  HB-         112 MET  ME          5.50    (#   3100:20  Unique         3.49, 5.21 A)
 &rst
  ixpk= 3100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 299, 300,
 igr2=1718,1719,1720,
 &end
#
#   77 ASP  HB-         112 MET  ME          6.50    (#   3101:20  Unique         6.07, 7.53 A)
 &rst
  ixpk= 3101, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1168,1169,
 igr2=1718,1719,1720,
 &end
#
#  113 ALA  HN          113 ALA  HA          6.50    (#   3103:20  Unique         2.95, 2.98 A)
 &rst
  ixpk= 3103, nxpk= 20, iat=1724,1726, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  121 LEU  HG          113 ALA  HA          5.50    (#   3104:20  Unique         4.55, 4.98 A)
 &rst
  ixpk= 3104, nxpk= 20, iat=1822,1726, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 LEU  MDY         113 ALA  HA          6.50    (#   3105:20  Unique         2.09, 4.68 A)
 &rst
  ixpk= 3105, nxpk= 20, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1824,1825,1826,1828,1829,1830,
 &end
#
#  112 MET  HN          113 ALA  MB          6.50    (#   3106:20  Unique         4.87, 6.02 A)
 &rst
  ixpk= 3106, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=1728,1729,1730,
 &end
#
#   80 LEU  HN          114 ASN  HA          6.50    (#   3107:20  Unique         5.33, 5.53 A)
 &rst
  ixpk= 3107, nxpk= 20, iat=1206,1736, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  114 ASN  HD2+        114 ASN  HA          6.50    (#   3108:20  Unique         3.81, 4.45 A)
 &rst
  ixpk= 3108, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1743,1744,
 &end
#
#    0 AMB  20-2:3109   114 ASN  HB-         5.50    (#   3109:20  Single Ambig)
 &rst
  ixpk= 3109, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1779,1758,
 igr2=1738,1739,
 &end
#
#    0 AMB  20-2:3110     0 AMB  20-1:3110   6.50    (#   3110:20  Double Ambig)
 &rst
  ixpk= 3110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1779,1758,
 igr2=1738,1739,1738,1739,
 &end
#
#  119 GLU  HN          114 ASN  HB+         5.50    (#   3111:20  Unique         2.74, 3.83 A)
 &rst
  ixpk= 3111, nxpk= 20, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1738,1739,
 &end
#
#  114 ASN  HD2+        114 ASN  HB-         5.50    (#   3112:20  Unique         2.21, 3.14 A)
 &rst
  ixpk= 3112, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1743,1744,
 igr2=1738,1739,
 &end
#
#  119 GLU  HB-         114 ASN  HB+         5.50    (#   3113:20  Unique         2.92, 4.74 A)
 &rst
  ixpk= 3113, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1790,1791,
 igr2=1738,1739,
 &end
#
#  121 LEU  HG          114 ASN  HB-         5.50    (#   3114:20  Unique         2.80, 4.24 A)
 &rst
  ixpk= 3114, nxpk= 20, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1738,1739,
 &end
#
#  113 ALA  MB          114 ASN  HB+         6.50    (#   3115:20  Unique         4.50, 5.86 A)
 &rst
  ixpk= 3115, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1728,1729,1730,
 igr2=1738,1739,
 &end
#
#    0 AMB  20-2:3117     0 AMB  20-1:3117   6.50    (#   3117:20  Double Ambig)
 &rst
  ixpk= 3117, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
 igr1=1236, 402,1545,
 igr2=1752,1753,1754,1597,1598,1599,
 &end
#
#  118 GLY  HN          117 THR  HA          5.50    (#   3120:20  Unique         3.50, 3.53 A)
 &rst
  ixpk= 3120, nxpk= 20, iat=1779,1767, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  118 GLY  HN          117 THR  HB          5.50    (#   3121:20  Unique         2.87, 3.66 A)
 &rst
  ixpk= 3121, nxpk= 20, iat=1779,1769, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  119 GLU  HN          118 GLY  HA-         5.50    (#   3123:20  Unique         3.41, 7.45 A)
 &rst
  ixpk= 3123, nxpk= 20, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1781,1782,
 &end
#
#  119 GLU  HN          118 GLY  HA+         5.50    (#   3124:20  Unique         3.41, 7.45 A)
 &rst
  ixpk= 3124, nxpk= 20, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1781,1782,
 &end
#
#  117 THR  HN          118 GLY  HA+         5.50    (#   3125:20  Unique         4.89, 7.78 A)
 &rst
  ixpk= 3125, nxpk= 20, iat=1765,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1781,1782,
 &end
#
#  113 ALA  MB          118 GLY  HA+         4.50    (#   3126:20  Unique         4.25,10.67 A)
 &rst
  ixpk= 3126, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1728,1729,1730,
 igr2=1781,1782,
 &end
#
#  118 GLY  HN          119 GLU  HA          6.50    (#   3127:20  Unique         5.13, 5.18 A)
 &rst
  ixpk= 3127, nxpk= 20, iat=1779,1788, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  133 ASP  HB+         127 SER  HB-         6.50    (#   3128:20  Unique         4.86, 6.82 A)
 &rst
  ixpk= 3128, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=2003,2004,
 igr2=1917,1918,
 &end
#
#    0 AMB  20-2:3129   120 PRO  HA          4.50    (#   3129:20  Single Ambig)
 &rst
  ixpk= 3129, nxpk= 20, iat=  -1,1811, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1819,1820,2065,2066,2067,
 &end
#
#    0 AMB  20-2:3130   120 PRO  HA          3.50    (#   3130:20  Single Ambig)
 &rst
  ixpk= 3130, nxpk= 20, iat=  -1,1811, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1697,1698,1699,1701,1702,1703,1824,1825,1826,1828,
      1829,1830,
 &end
#
#    0 AMB  20-2:3132     0 AMB  20-1:3132   4.50    (#   3132:20  Double Ambig)
 &rst
  ixpk= 3132, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1793,1794,1793,1794,1793,1794,
 igr2=1802,1803,1802,1803,1802,1803,
 &end
#
#  121 LEU  HN          121 LEU  HB-         5.50    (#   3133:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 3133, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1819,1820,
 &end
#
#  121 LEU  HN          121 LEU  HB+         5.50    (#   3134:20  Unique         2.34, 3.07 A)
 &rst
  ixpk= 3134, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1819,1820,
 &end
#
#  121 LEU  HA          121 LEU  HB-         5.50    (#   3137:20  Unique         2.27, 2.73 A)
 &rst
  ixpk= 3137, nxpk= 20, iat=1817,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1819,1820,
 &end
#
#   10 ASN  HA          121 LEU  HB+         6.50    (#   3138:20  Unique         2.29, 3.62 A)
 &rst
  ixpk= 3138, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1819,1820,
 &end
#
#  120 PRO  HB-         121 LEU  HB-         6.50    (#   3140:20  Unique         5.36, 6.34 A)
 &rst
  ixpk= 3140, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1808,1809,
 igr2=1819,1820,
 &end
#
#  122 LEU  HB-         121 LEU  HB-         4.50    (#   3141:20  Unique         2.54, 4.32 A)
 &rst
  ixpk= 3141, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1838,1839,
 igr2=1819,1820,
 &end
#
#  121 LEU  HN          121 LEU  HG          4.50    (#   3144:20  Unique         4.03, 4.34 A)
 &rst
  ixpk= 3144, nxpk= 20, iat=1815,1822, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    9 ALA  HA          121 LEU  HG          5.50    (#   3149:20  Unique         4.40, 4.85 A)
 &rst
  ixpk= 3149, nxpk= 20, iat= 128,1822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  114 ASN  HB-         121 LEU  HG          5.50    (#   3150:20  Unique         2.80, 4.24 A)
 &rst
  ixpk= 3150, nxpk= 20, iat=  -1,1822, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1738,1739,
 &end
#
#    0 AMB  20-2:3152   121 LEU  HG          6.50    (#   3152:20  Single Ambig)
 &rst
  ixpk= 3152, nxpk= 20, iat=  -1,1822, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1793,1794,1793,1794,1195,1196,1714,1715,
 &end
#
#   10 ASN  HN          121 LEU  MDX         6.50    (#   3154:20  Unique         3.31, 4.97 A)
 &rst
  ixpk= 3154, nxpk= 20, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1824,1825,1826,1828,1829,1830,
 &end
#
#  136 LEU  HA          122 LEU  HB-         5.50    (#   3156:20  Unique         3.82, 4.97 A)
 &rst
  ixpk= 3156, nxpk= 20, iat=2044,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1838,1839,
 &end
#
#  136 LEU  HA          122 LEU  HB+         5.50    (#   3157:20  Unique         3.82, 4.97 A)
 &rst
  ixpk= 3157, nxpk= 20, iat=2044,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1838,1839,
 &end
#
#  124 LEU  MDX         122 LEU  HB-         4.50    (#   3158:20  Unique         2.50, 6.00 A)
 &rst
  ixpk= 3158, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1876,1877,1878,1880,1881,1882,
 igr2=1838,1839,
 &end
#
#    0 AMB  20-2:3159     0 AMB  20-1:3159   4.50    (#   3159:20  Double Ambig)
 &rst
  ixpk= 3159, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1876,1877,1878,1880,1881,1882,2051,2052,2053,2055,
      2056,2057,
 igr2=1838,1839,1838,1839,
 &end
#
#  134 GLN  HA          124 LEU  HG          4.50    (#   3160:20  Unique         2.20, 3.15 A)
 &rst
  ixpk= 3160, nxpk= 20, iat=2013,1874, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  136 LEU  HA          122 LEU  HG          5.50    (#   3161:20  Unique         2.54, 3.58 A)
 &rst
  ixpk= 3161, nxpk= 20, iat=2044,1841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 LEU  HN          122 LEU  MDX         6.50    (#   3162:20  Unique         4.59, 7.06 A)
 &rst
  ixpk= 3162, nxpk= 20, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#    0 AMB  20-2:3163   122 LEU  MDX         6.50    (#   3163:20  Single Ambig)
 &rst
  ixpk= 3163, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 261, 136,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#  134 GLN  HE2+        122 LEU  MDX         6.50    (#   3164:20  Unique         1.86, 4.05 A)
 &rst
  ixpk= 3164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=2023,2024,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#  134 GLN  HE2-        122 LEU  MDX         5.50    (#   3165:20  Unique         1.86, 4.05 A)
 &rst
  ixpk= 3165, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2023,2024,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#  134 GLN  HA          122 LEU  MDX         4.50    (#   3166:20  Unique         3.54, 5.57 A)
 &rst
  ixpk= 3166, nxpk= 20, iat=2013,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#  136 LEU  HA          122 LEU  MDX         4.50    (#   3167:20  Unique         2.21, 5.03 A)
 &rst
  ixpk= 3167, nxpk= 20, iat=2044,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#   10 ASN  HB+         122 LEU  MDX         5.50    (#   3168:20  Unique         6.21, 8.93 A)
 &rst
  ixpk= 3168, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 140, 141,
 igr2=1843,1844,1845,1847,1848,1849,
 &end
#
#    0 AMB  20-2:3170   123 THR  HB          5.50    (#   3170:20  Single Ambig)
 &rst
  ixpk= 3170, nxpk= 20, iat=  -1,1857, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2044,2123,
 &end
#
#    0 AMB  20-2:3172   123 THR  HB          5.50    (#   3172:20  Single Ambig)
 &rst
  ixpk= 3172, nxpk= 20, iat=  -1,1857, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2075,2076,2075,2076,2125,2126,
 &end
#
#  123 THR  HA          123 THR  MG2         3.50    (#   3173:20  Unique         2.35, 3.05 A)
 &rst
  ixpk= 3173, nxpk= 20, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1859,1860,1861,
 &end
#
#   83 HIS  HB+         123 THR  MG2         6.50    (#   3174:20  Unique         6.17, 8.18 A)
 &rst
  ixpk= 3174, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1259,1260,
 igr2=1859,1860,1861,
 &end
#
#  139 ASP  HB-         123 THR  MG2         6.50    (#   3175:20  Unique         6.72, 8.73 A)
 &rst
  ixpk= 3175, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=2099,2100,
 igr2=1859,1860,1861,
 &end
#
#  111 LEU  HB+         123 THR  MG2         3.50    (#   3176:20  Unique         2.32, 4.52 A)
 &rst
  ixpk= 3176, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1692,1693,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:3177     0 AMB  20-1:3177   3.50    (#   3177:20  Double Ambig)
 &rst
  ixpk= 3177, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1=2125,2126,1495,1616,1617,1618,
 igr2=1859,1860,1861,1497,1498,1499,1501,1502,1503,
 &end
#
#  135 THR  MG2         124 LEU  HA          5.50    (#   3180:20  Unique         4.10, 5.53 A)
 &rst
  ixpk= 3180, nxpk= 20, iat=  -1,1869, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2034,2035,2036,
 &end
#
#  110 LEU  HN          124 LEU  HB-         5.50    (#   3181:20  Unique         3.15, 3.84 A)
 &rst
  ixpk= 3181, nxpk= 20, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1871,1872,
 &end
#
#    0 AMB  20-2:3183     0 AMB  20-1:3183   3.50    (#   3183:20  Double Ambig)
 &rst
  ixpk= 3183, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1874,1987,
 igr2=1871,1872,1871,1872,
 &end
#
#    0 AMB  20-2:3184   124 LEU  HB-         3.50    (#   3184:20  Single Ambig)
 &rst
  ixpk= 3184, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1876,1877,1878,1880,1881,1882,1876,1877,1878,1880,
      1881,1882,
 igr2=1871,1872,
 &end
#
#    0 AMB  20-2:3185     0 AMB  20-1:3185   3.50    (#   3185:20  Double Ambig)
 &rst
  ixpk= 3185, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1876,1877,1878,1880,1881,1882,1876,1877,1878,1880,
      1881,1882,
 igr2=1871,1872,1871,1872,
 &end
#
#  134 GLN  HE2+        124 LEU  MDX         6.50    (#   3186:20  Unique         2.77, 5.72 A)
 &rst
  ixpk= 3186, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=2023,2024,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#  133 ASP  HB+         124 LEU  MDX         5.50    (#   3187:20  Unique         5.86, 8.25 A)
 &rst
  ixpk= 3187, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2003,2004,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#    0 AMB  20-2:3188   124 LEU  MDY         5.50    (#   3188:20  Single Ambig)
 &rst
  ixpk= 3188, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1853,1886,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#   20 PHE  HB-         124 LEU  MDY         5.50    (#   3189:20  Unique         3.04, 5.65 A)
 &rst
  ixpk= 3189, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 299, 300,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#   20 PHE  HB+         124 LEU  MDY         5.50    (#   3190:20  Unique         3.04, 5.65 A)
 &rst
  ixpk= 3190, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 299, 300,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#  133 ASP  HB+         124 LEU  MDY         5.50    (#   3191:20  Unique         5.86, 8.25 A)
 &rst
  ixpk= 3191, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2003,2004,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#    0 AMB  20-2:3193   124 LEU  MDY         3.50    (#   3193:20  Single Ambig)
 &rst
  ixpk= 3193, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=2015,2016,2018,2019,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#  108 PHE  HN          125 VAL  HA          5.50    (#   3194:20  Unique         4.53, 4.74 A)
 &rst
  ixpk= 3194, nxpk= 20, iat=1638,1888, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 THR  MG2         125 VAL  HA          4.50    (#   3195:20  Unique         4.17, 5.50 A)
 &rst
  ixpk= 3195, nxpk= 20, iat=  -1,1888, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1859,1860,1861,
 &end
#
#  133 ASP  HN          125 VAL  HB          6.50    (#   3196:20  Unique         3.52, 3.71 A)
 &rst
  ixpk= 3196, nxpk= 20, iat=1999,1890, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  132 LEU  HA          125 VAL  MGX         5.50    (#   3202:20  Unique         5.66, 7.23 A)
 &rst
  ixpk= 3202, nxpk= 20, iat=1982,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  127 SER  HB+         125 VAL  MGX         5.50    (#   3203:20  Unique         4.30, 7.67 A)
 &rst
  ixpk= 3203, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1917,1918,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  107 PRO  HB+         125 VAL  MGX         5.50    (#   3208:20  Unique         5.67, 8.36 A)
 &rst
  ixpk= 3208, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1631,1632,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#    0 AMB  20-2:3210   125 VAL  MGX         4.50    (#   3210:20  Single Ambig)
 &rst
  ixpk= 3210, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2128,2129,2128,2129,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  111 LEU  HB+         125 VAL  MGX         5.50    (#   3211:20  Unique         5.90, 8.88 A)
 &rst
  ixpk= 3211, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1692,1693,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  140 THR  MG2         125 VAL  MGX         4.50    (#   3213:20  Unique         2.35, 5.52 A)
 &rst
  ixpk= 3213, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2113,2114,2115,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  124 LEU  HN          125 VAL  MGY         5.50    (#   3214:20  Unique         4.10, 6.11 A)
 &rst
  ixpk= 3214, nxpk= 20, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  110 LEU  HN          125 VAL  MGY         5.50    (#   3215:20  Unique         3.38, 5.47 A)
 &rst
  ixpk= 3215, nxpk= 20, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  108 PHE  HA          125 VAL  MGY         6.50    (#   3217:20  Unique         5.12, 7.15 A)
 &rst
  ixpk= 3217, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  125 VAL  HA          125 VAL  MGY         3.50    (#   3219:20  Unique         2.43, 3.16 A)
 &rst
  ixpk= 3219, nxpk= 20, iat=1888,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  123 THR  HB          125 VAL  MGY         4.50    (#   3220:20  Unique         3.48, 6.14 A)
 &rst
  ixpk= 3220, nxpk= 20, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#    0 AMB  20-2:3221   125 VAL  MGY         4.50    (#   3221:20  Single Ambig)
 &rst
  ixpk= 3221, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1987,2078,2079,2078,2079,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  126 CYS  HN          126 CYS  HA          4.50    (#   3222:20  Unique         2.98, 2.99 A)
 &rst
  ixpk= 3222, nxpk= 20, iat=1902,1904, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  133 ASP  HN          126 CYS  HA          5.50    (#   3223:20  Unique         3.49, 3.66 A)
 &rst
  ixpk= 3223, nxpk= 20, iat=1999,1904, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  128 GLY  HN          126 CYS  HA          5.50    (#   3224:20  Unique         3.30, 3.59 A)
 &rst
  ixpk= 3224, nxpk= 20, iat=1924,1904, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  132 LEU  MDX         126 CYS  HA          5.50    (#   3225:20  Unique         3.73, 4.52 A)
 &rst
  ixpk= 3225, nxpk= 20, iat=  -1,1904, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#  108 PHE  HN          126 CYS  HB-         6.50    (#   3226:20  Unique         1.62, 2.58 A)
 &rst
  ixpk= 3226, nxpk= 20, iat=1638,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1906,1907,
 &end
#
#  126 CYS  HA          126 CYS  HB-         5.50    (#   3228:20  Unique         2.37, 2.77 A)
 &rst
  ixpk= 3228, nxpk= 20, iat=1904,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1906,1907,
 &end
#
#  126 CYS  HA          127 SER  HB+         5.50    (#   3230:20  Unique         4.33, 5.14 A)
 &rst
  ixpk= 3230, nxpk= 20, iat=1904,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1917,1918,
 &end
#
#  107 PRO  HB+         127 SER  HB-         5.50    (#   3231:20  Unique         4.62, 6.96 A)
 &rst
  ixpk= 3231, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1631,1632,
 igr2=1917,1918,
 &end
#
#  129 SER  HN          129 SER  HA          6.50    (#   3233:20  Unique         2.94, 2.97 A)
 &rst
  ixpk= 3233, nxpk= 20, iat=1931,1933, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  105 ILE  QD1         129 SER  HA          5.50    (#   3234:20  Unique         2.36, 4.37 A)
 &rst
  ixpk= 3234, nxpk= 20, iat=  -1,1933, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1604,1605,1606,
 &end
#
#    0 AMB  20-2:3235     0 AMB  20-1:3235   6.50    (#   3235:20  Double Ambig)
 &rst
  ixpk= 3235, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.09, r4=10.59,
 igr1=1595, 772, 773, 774, 776, 777, 778,
 igr2=1944,1029,
 &end
#
#   28 ILE  QD1         130 TRP  HA          6.50    (#   3236:20  Unique         3.74, 4.61 A)
 &rst
  ixpk= 3236, nxpk= 20, iat=  -1,1944, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1= 425, 426, 427,
 &end
#
#  130 TRP  HD1           0 AMB  20-1:3238   4.50    (#   3238:20  Single Ambig)
 &rst
  ixpk= 3238, nxpk= 20, iat=1950,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1946,1947,1946,1947,
 &end
#
#    0 AMB  20-2:3239     0 AMB  20-1:3239   5.50    (#   3239:20  Double Ambig)
 &rst
  ixpk= 3239, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1935,1936,1935,1936,1935,1936,
 igr2=1946,1947,1946,1947,1946,1947,
 &end
#
#  131 PRO  HB-           0 AMB  20-1:3240   4.50    (#   3240:20  Single Ambig)
 &rst
  ixpk= 3240, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1973,1974,
 igr2=1946,1947,1946,1947,
 &end
#
#  130 TRP  HN          131 PRO  HA          5.50    (#   3242:20  Unique         4.72, 4.77 A)
 &rst
  ixpk= 3242, nxpk= 20, iat=1942,1976, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  131 PRO  HB+         131 PRO  HA          3.50    (#   3244:20  Unique         2.28, 2.54 A)
 &rst
  ixpk= 3244, nxpk= 20, iat=  -1,1976, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1973,1974,
 &end
#
#  131 PRO  HD-         131 PRO  HB+         4.50    (#   3246:20  Unique         2.82, 3.72 A)
 &rst
  ixpk= 3246, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1967,1968,
 igr2=1973,1974,
 &end
#
#  132 LEU  HN          131 PRO  HG+         6.50    (#   3248:20  Unique         3.84, 4.64 A)
 &rst
  ixpk= 3248, nxpk= 20, iat=1980,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1970,1971,
 &end
#
#  132 LEU  HN          131 PRO  HG-         6.50    (#   3249:20  Unique         3.84, 4.64 A)
 &rst
  ixpk= 3249, nxpk= 20, iat=1980,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1970,1971,
 &end
#
#    0 AMB  20-2:3250     0 AMB  20-1:3250   6.50    (#   3250:20  Double Ambig)
 &rst
  ixpk= 3250, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1944, 319,
 igr2=1970,1971,1970,1971,
 &end
#
#  131 PRO  HA          131 PRO  HG+         6.50    (#   3251:20  Unique         3.12, 3.90 A)
 &rst
  ixpk= 3251, nxpk= 20, iat=1976,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1970,1971,
 &end
#
#  131 PRO  HA          131 PRO  HG-         6.50    (#   3252:20  Unique         3.12, 3.90 A)
 &rst
  ixpk= 3252, nxpk= 20, iat=1976,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1970,1971,
 &end
#
#  130 TRP  HD1         131 PRO  HD+         6.50    (#   3253:20  Unique         3.52, 4.55 A)
 &rst
  ixpk= 3253, nxpk= 20, iat=1950,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1967,1968,
 &end
#
#  130 TRP  HD1         131 PRO  HD-         6.50    (#   3254:20  Unique         3.52, 4.55 A)
 &rst
  ixpk= 3254, nxpk= 20, iat=1950,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1967,1968,
 &end
#
#    0 AMB  20-2:3256     0 AMB  20-1:3256   5.50    (#   3256:20  Double Ambig)
 &rst
  ixpk= 3256, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1946,1947,1946,1947,
 igr2=1967,1968,1967,1968,
 &end
#
#    0 AMB  20-2:3257   131 PRO  HD-         5.50    (#   3257:20  Single Ambig)
 &rst
  ixpk= 3257, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1946,1947,1946,1947,
 igr2=1967,1968,
 &end
#
#  133 ASP  HN          132 LEU  HG          6.50    (#   3259:20  Unique         2.65, 3.29 A)
 &rst
  ixpk= 3259, nxpk= 20, iat=1999,1987, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  126 CYS  HA          132 LEU  HG          5.50    (#   3260:20  Unique         2.13, 2.51 A)
 &rst
  ixpk= 3260, nxpk= 20, iat=1904,1987, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HA            0 AMB  20-1:3261   5.50    (#   3261:20  Single Ambig)
 &rst
  ixpk= 3261, nxpk= 20, iat=1944,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1989,1990,1991,1993,1994,1995, 358, 359, 360, 362,
       363, 364,
 &end
#
#  126 CYS  HB-         132 LEU  MDX         4.50    (#   3262:20  Unique         2.15, 4.14 A)
 &rst
  ixpk= 3262, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1906,1907,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  109 SER  HN          132 LEU  MDY         6.50    (#   3264:20  Unique         5.84, 7.82 A)
 &rst
  ixpk= 3264, nxpk= 20, iat=1658,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#    0 AMB  20-2:3266   132 LEU  MDY         4.50    (#   3266:20  Single Ambig)
 &rst
  ixpk= 3266, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1904,1660,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  125 VAL  HA          133 ASP  HB+         6.50    (#   3272:20  Unique         4.28, 5.28 A)
 &rst
  ixpk= 3272, nxpk= 20, iat=1888,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=2003,2004,
 &end
#
#  135 THR  MG2         133 ASP  HB-         5.50    (#   3275:20  Unique         5.02, 7.06 A)
 &rst
  ixpk= 3275, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2034,2035,2036,
 igr2=2003,2004,
 &end
#
#  135 THR  MG2         134 GLN  HA          5.50    (#   3277:20  Unique         3.97, 5.13 A)
 &rst
  ixpk= 3277, nxpk= 20, iat=  -1,2013, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2034,2035,2036,
 &end
#
#  135 THR  HN          134 GLN  HB-         5.50    (#   3278:20  Unique         2.85, 3.94 A)
 &rst
  ixpk= 3278, nxpk= 20, iat=2028,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2015,2016,
 &end
#
#  134 GLN  HE2+        134 GLN  HB-         6.50    (#   3279:20  Unique         2.40, 3.97 A)
 &rst
  ixpk= 3279, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=2023,2024,
 igr2=2015,2016,
 &end
#
#  134 GLN  HE2+        134 GLN  HB+         5.50    (#   3280:20  Unique         2.40, 3.97 A)
 &rst
  ixpk= 3280, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2023,2024,
 igr2=2015,2016,
 &end
#
#    0 AMB  20-2:3282     0 AMB  20-1:3282   4.50    (#   3282:20  Double Ambig)
 &rst
  ixpk= 3282, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 786, 787,1874,
 igr2= 532, 533,2015,2016,
 &end
#
#  122 LEU  MDX         134 GLN  HB-         5.50    (#   3283:20  Unique         2.48, 5.53 A)
 &rst
  ixpk= 3283, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1843,1844,1845,1847,1848,1849,
 igr2=2015,2016,
 &end
#
#  122 LEU  MDX         134 GLN  HB+         4.50    (#   3284:20  Unique         2.48, 5.53 A)
 &rst
  ixpk= 3284, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1843,1844,1845,1847,1848,1849,
 igr2=2015,2016,
 &end
#
#  134 GLN  HE2-        134 GLN  HG-         5.50    (#   3285:20  Unique         2.35, 3.35 A)
 &rst
  ixpk= 3285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2023,2024,
 igr2=2018,2019,
 &end
#
#  134 GLN  HE2-        134 GLN  HG+         4.50    (#   3286:20  Unique         2.35, 3.35 A)
 &rst
  ixpk= 3286, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2023,2024,
 igr2=2018,2019,
 &end
#
#  134 GLN  HN          134 GLN  HG-         5.50    (#   3287:20  Unique         2.75, 4.03 A)
 &rst
  ixpk= 3287, nxpk= 20, iat=2011,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#  134 GLN  HN          134 GLN  HG+         4.50    (#   3288:20  Unique         2.75, 4.03 A)
 &rst
  ixpk= 3288, nxpk= 20, iat=2011,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2018,2019,
 &end
#
#    0 AMB  20-2:3289   135 THR  HA          5.50    (#   3289:20  Single Ambig)
 &rst
  ixpk= 3289, nxpk= 20, iat=  -1,2030, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2046,2047,1838,1839,
 &end
#
#  123 THR  HA          135 THR  MG2         5.50    (#   3292:20  Unique         4.19, 5.28 A)
 &rst
  ixpk= 3292, nxpk= 20, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2034,2035,2036,
 &end
#
#  122 LEU  HA          136 LEU  HA          6.50    (#   3293:20  Unique         2.18, 2.52 A)
 &rst
  ixpk= 3293, nxpk= 20, iat=1836,2044, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  104 GLN  HE2-        100 LEU  HG          5.50    (#   3296:20  Unique         3.35, 4.95 A)
 &rst
  ixpk= 3296, nxpk= 20, iat=  -1,1533, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1586,1587,
 &end
#
#   30 ARG  HD-          26 LEU  MDY         5.50    (#   3299:20  Unique         2.40, 5.98 A)
 &rst
  ixpk= 3299, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 453, 454,
 igr2= 392, 393, 394, 396, 397, 398,
 &end
#
#  120 PRO  HG-         137 ALA  HA          5.50    (#   3302:20  Unique         3.49, 4.98 A)
 &rst
  ixpk= 3302, nxpk= 20, iat=  -1,2063, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1805,1806,
 &end
#
#    0 AMB  20-2:3303   137 ALA  HA          4.50    (#   3303:20  Single Ambig)
 &rst
  ixpk= 3303, nxpk= 20, iat=  -1,2063, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1808,1809,2075,2076,
 &end
#
#    0 AMB  20-2:3304   137 ALA  HA          4.50    (#   3304:20  Single Ambig)
 &rst
  ixpk= 3304, nxpk= 20, iat=  -1,2063, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2078,2079,2078,2079,
 &end
#
#    0 AMB  20-2:3305   137 ALA  HA          6.50    (#   3305:20  Single Ambig)
 &rst
  ixpk= 3305, nxpk= 20, iat=  -1,2063, r1= 1.30, r2= 1.80, r3= 8.99, r4= 9.49,
 igr1=2049,1876,1877,1878,1880,1881,1882,
 &end
#
#  121 LEU  HN          137 ALA  MB          6.50    (#   3306:20  Unique         3.53, 5.87 A)
 &rst
  ixpk= 3306, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=2065,2066,2067,
 &end
#
#    0 AMB  20-2:3307   137 ALA  MB          5.50    (#   3307:20  Single Ambig)
 &rst
  ixpk= 3307, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2081,2082,2081,2082,
 igr2=2065,2066,2067,
 &end
#
#    0 AMB  20-2:3309     0 AMB  20-1:3309   4.50    (#   3309:20  Double Ambig)
 &rst
  ixpk= 3309, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 110,2071,
 igr2=  66,  67,2078,2079,2078,2079,
 &end
#
#    0 AMB  20-2:3310     0 AMB  20-1:3310   6.50    (#   3310:20  Double Ambig)
 &rst
  ixpk= 3310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
 igr1=2095,2071,2121,
 igr2=2081,2082,2081,2082,2081,2082,
 &end
#
#  138 ARG  HA            0 AMB  20-1:3316   4.50    (#   3316:20  Single Ambig)
 &rst
  ixpk= 3316, nxpk= 20, iat=2073,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2081,2082,2081,2082,
 &end
#
#  123 THR  HB            0 AMB  20-1:3318   4.50    (#   3318:20  Single Ambig)
 &rst
  ixpk= 3318, nxpk= 20, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2081,2082,2081,2082,
 &end
#
#  111 LEU  MDX           0 AMB  20-1:3322   5.50    (#   3322:20  Single Ambig)
 &rst
  ixpk= 3322, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1697,1698,1699,1701,1702,1703,
 igr2=2081,2082,2081,2082,
 &end
#
#  136 LEU  HB-         139 ASP  HB-         5.50    (#   3323:20  Unique         3.81, 5.27 A)
 &rst
  ixpk= 3323, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2046,2047,
 igr2=2099,2100,
 &end
#
#  141 ARG  HN            0 AMB  20-1:3327   4.50    (#   3327:20  Single Ambig)
 &rst
  ixpk= 3327, nxpk= 20, iat=2121,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2128,2129,2128,2129,
 &end
#
#  136 LEU  HN          135 THR  HA          4.50    (#   3328:20  Unique         2.27, 2.35 A)
 &rst
  ixpk= 3328, nxpk= 20, iat=2042,2030, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  126 CYS  HN          109 SER  HA          4.50    (#   3329:20  Unique         3.36, 3.50 A)
 &rst
  ixpk= 3329, nxpk= 20, iat=1902,1660, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 MET  HA           50 MET  HB-         6.50    (#   3330:20  Unique         2.42, 2.76 A)
 &rst
  ixpk= 3330, nxpk= 20, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 753, 754,
 &end
#
#   50 MET  ME           50 MET  HB-         6.50    (#   3331:20  Unique         2.25, 3.75 A)
 &rst
  ixpk= 3331, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 760, 761, 762,
 igr2= 753, 754,
 &end
#
#  124 LEU  HN          124 LEU  MDY         6.50    (#   3332:20  Unique         2.91, 4.52 A)
 &rst
  ixpk= 3332, nxpk= 20, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#   87 PHE  HD           84 LEU  MDX         6.50    (#   3333:20  Unique         2.64, 6.39 A)
 &rst
  ixpk= 3333, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1330,1338,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   82 ILE  QD1         112 MET  HG+         5.50    (#   3338:20  Unique         2.34, 4.01 A)
 &rst
  ixpk= 3338, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1249,1250,1251,
 igr2=1714,1715,
 &end
#
#   82 ILE  QD1         112 MET  HG-         5.50    (#   3339:20  Unique         2.34, 4.01 A)
 &rst
  ixpk= 3339, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1249,1250,1251,
 igr2=1714,1715,
 &end
#
#    0 AMB  20-2:3340     0 AMB  20-1:3340   5.50    (#   3340:20  Double Ambig)
 &rst
  ixpk= 3340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 igr2=1714,1715,1714,1715,
 &end
#
#  110 LEU  MDX         112 MET  HG-         5.50    (#   3341:20  Unique         2.85, 4.98 A)
 &rst
  ixpk= 3341, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1678,1679,1680,1682,1683,1684,
 igr2=1714,1715,
 &end
#
#  112 MET  HN          112 MET  HG+         5.50    (#   3342:20  Unique         2.74, 3.40 A)
 &rst
  ixpk= 3342, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1714,1715,
 &end
#
#  112 MET  HN          112 MET  HG-         5.50    (#   3343:20  Unique         2.74, 3.40 A)
 &rst
  ixpk= 3343, nxpk= 20, iat=1707,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1714,1715,
 &end
#
#   82 ILE  QD1          80 LEU  HA          5.50    (#   3344:20  Unique         4.53, 5.20 A)
 &rst
  ixpk= 3344, nxpk= 20, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1249,1250,1251,
 &end
#
#  121 LEU  HG           80 LEU  HA          6.50    (#   3345:20  Unique         5.79, 6.13 A)
 &rst
  ixpk= 3345, nxpk= 20, iat=1822,1208, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   87 PHE  HD           86 PRO  HG-         6.50    (#   3347:20  Unique         2.38, 5.68 A)
 &rst
  ixpk= 3347, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1330,1338,
 igr2=1312,1313,
 &end
#
#   87 PHE  HN           86 PRO  HG+         6.50    (#   3348:20  Unique         2.63, 3.79 A)
 &rst
  ixpk= 3348, nxpk= 20, iat=1322,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1312,1313,
 &end
#
#   86 PRO  HA           86 PRO  HG+         6.50    (#   3350:20  Unique         2.79, 3.85 A)
 &rst
  ixpk= 3350, nxpk= 20, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1312,1313,
 &end
#
#   86 PRO  HD-          86 PRO  HG+         4.50    (#   3351:20  Unique         2.33, 2.61 A)
 &rst
  ixpk= 3351, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1309,1310,
 igr2=1312,1313,
 &end
#
#   86 PRO  HD+          86 PRO  HG+         4.50    (#   3352:20  Unique         2.33, 2.61 A)
 &rst
  ixpk= 3352, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1309,1310,
 igr2=1312,1313,
 &end
#
#   86 PRO  HD+          86 PRO  HG-         4.50    (#   3353:20  Unique         2.33, 2.61 A)
 &rst
  ixpk= 3353, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1309,1310,
 igr2=1312,1313,
 &end
#
#   86 PRO  HD-          86 PRO  HG-         4.50    (#   3354:20  Unique         2.33, 2.61 A)
 &rst
  ixpk= 3354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1309,1310,
 igr2=1312,1313,
 &end
#
#  134 GLN  HE2-        136 LEU  MDX         5.50    (#   3355:20  Unique         4.36, 7.91 A)
 &rst
  ixpk= 3355, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2023,2024,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#    0 AMB  20-2:3356   136 LEU  MDX         4.50    (#   3356:20  Single Ambig)
 &rst
  ixpk= 3356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 208, 209, 208, 209,
 igr2=2051,2052,2053,2055,2056,2057,
 &end
#
#   25 GLU  HA           28 ILE  HG1+        4.50    (#   3360:20  Unique         1.95, 4.20 A)
 &rst
  ixpk= 3360, nxpk= 20, iat= 370,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 422, 423,
 &end
#
#    0 AMB  20-2:3361    27 ALA  MB          3.50    (#   3361:20  Single Ambig)
 &rst
  ixpk= 3361, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 563,1511,
 igr2= 406, 407, 408,
 &end
#
#   40 ILE  QD1          27 ALA  MB          4.50    (#   3363:20  Unique         2.37, 4.61 A)
 &rst
  ixpk= 3363, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 595, 596, 597,
 igr2= 406, 407, 408,
 &end
#
#   31 ALA  HN           28 ILE  HA          5.50    (#   3364:20  Unique         3.14, 3.35 A)
 &rst
  ixpk= 3364, nxpk= 20, iat= 467, 414, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  114 ASN  HD2-          9 ALA  MB          3.50    (#   3367:20  Unique         2.14, 3.83 A)
 &rst
  ixpk= 3367, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1743,1744,
 igr2= 130, 131, 132,
 &end
#
#  125 VAL  MGX         125 VAL  HA          3.50    (#   3369:20  Unique         2.43, 3.16 A)
 &rst
  ixpk= 3369, nxpk= 20, iat=  -1,1888, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#    0 AMB  20-2:3371     0 AMB  20-1:3371   4.50    (#   3371:20  Double Ambig)
 &rst
  ixpk= 3371, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 241,1166,
 igr2=1144,1145,1144,1145,
 &end
#
#   48 ARG  HA           48 ARG  HB+         5.50    (#   3375:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 3375, nxpk= 20, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 710, 711,
 &end
#
#    0 AMB  20-2:3376     0 AMB  20-1:3376   5.50    (#   3376:20  Double Ambig)
 &rst
  ixpk= 3376, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.64, r4=12.14,
 igr1= 983,1118,1119,1118,1119,1118,1119,1451,1452,
 igr2= 716, 717, 716, 717, 716, 717, 716, 717, 716, 717,
      
 &end
#
#    0 AMB  20-2:3377     0 AMB  20-1:3377   4.50    (#   3377:20  Double Ambig)
 &rst
  ixpk= 3377, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 740, 741, 710, 711,
 igr2= 716, 717, 716, 717, 716, 717,
 &end
#
#    0 AMB  20-2:3378     0 AMB  20-1:3378   4.50    (#   3378:20  Double Ambig)
 &rst
  ixpk= 3378, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 969, 970, 969, 970,1101,1102,
 igr2= 716, 717, 716, 717, 716, 717,
 &end
#
#  103 GLY  HN          102 ASP  HA          5.50    (#   2074:20  Unique)
 &rst
  ixpk= 2074, nxpk= 20, iat=1567,1557, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLY  HA+          28 ILE  QG2         4.50    (#   1702:20  Unique)
 &rst
  ixpk= 1702, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1569,1570,
 igr2= 418, 419, 420,
 &end
#
#  110 LEU  HN          125 VAL  MGX         4.50    (#    734:20  Unique)
 &rst
  ixpk= 734, nxpk= 20, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1892,1893,1894,1896,1897,1898,
 &end
#
#  111 LEU  HN          111 LEU  MDY         4.50    (#    958:20  Unique)
 &rst
  ixpk= 958, nxpk= 20, iat=1688,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1697,1698,1699,1701,1702,1703,
 &end
#
#  112 MET  HG-         110 LEU  MDX         3.50    (#    909:20  Unique)
 &rst
  ixpk= 909, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1714,1715,
 igr2=1678,1679,1680,1682,1683,1684,
 &end
#
#  124 LEU  HB-         124 LEU  MDY         3.50    (#   2125:20  Unique)
 &rst
  ixpk= 2125, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1871,1872,
 igr2=1876,1877,1878,1880,1881,1882,
 &end
#
#  127 SER  HA          107 PRO  HB-         4.50    (#    863:20  Unique)
 &rst
  ixpk= 863, nxpk= 20, iat=1915,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1631,1632,
 &end
#
#  129 SER  HB+         129 SER  HA          4.50    (#   1171:20  Unique)
 &rst
  ixpk= 1171, nxpk= 20, iat=  -1,1933, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1935,1936,
 &end
#
#  130 TRP  HA          131 PRO  HB-         4.50    (#   3247:20  Unique)
 &rst
  ixpk= 3247, nxpk= 20, iat=1944,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1973,1974,
 &end
#
#  130 TRP  HA          131 PRO  HB+         5.50    (#   3245:20  Unique)
 &rst
  ixpk= 3245, nxpk= 20, iat=1944,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1973,1974,
 &end
#
#   18 ALA  MB           15 GLU  HG+         4.50    (#   2399:20  Unique)
 &rst
  ixpk= 2399, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 265, 266, 267,
 igr2= 229, 230,
 &end
#
#   19 ARG  HB+          19 ARG  HD+         3.50    (#   1662:20  Unique)
 &rst
  ixpk= 1662, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 275, 276,
 igr2= 281, 282,
 &end
#
#   24 LEU  HB+          24 LEU  HA          3.50    (#    196:20  Unique)
 &rst
  ixpk= 196, nxpk= 20, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 353, 354,
 &end
#
#   39 GLY  HN           27 ALA  MB          6.50    (#   3357:20  Unique)
 &rst
  ixpk= 3357, nxpk= 20, iat= 575,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 406, 407, 408,
 &end
#
#   41 HIS  HN           50 MET  HG+         6.50    (#   2635:20  Unique)
 &rst
  ixpk= 2635, nxpk= 20, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 756, 757,
 &end
#
#   49 ILE  HB           64 LEU  HA          5.50    (#   1934:20  Unique)
 &rst
  ixpk= 1934, nxpk= 20, iat= 734, 978, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 ILE  HB           68 ALA  MB          5.50    (#   2749:20  Unique)
 &rst
  ixpk= 2749, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1043,1044,1045,
 &end
#
#   50 MET  HG+          64 LEU  HA          5.50    (#   2726:20  Unique)
 &rst
  ixpk= 2726, nxpk= 20, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 756, 757,
 &end
#
#   73 GLN  HA           73 GLN  HB+         3.50    (#   1610:20  Unique)
 &rst
  ixpk= 1610, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1101,1102,
 &end
#
#   81 SER  HN           80 LEU  HB+         4.50    (#   2804:20  Unique)
 &rst
  ixpk= 2804, nxpk= 20, iat=1225,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1210,1211,
 &end
#
#   84 LEU  HB-          84 LEU  MDX         3.50    (#   1368:20  Unique)
 &rst
  ixpk= 1368, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1276,1277,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  HG           84 LEU  MDX         3.50    (#   1369:20  Unique)
 &rst
  ixpk= 1369, nxpk= 20, iat=1279,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1281,1282,1283,1285,1286,1287,
 &end
#
#   86 PRO  HA           85 GLN  HB+         5.50    (#    469:20  Unique)
 &rst
  ixpk= 469, nxpk= 20, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1295,1296,
 &end
#
#   86 PRO  HA           85 GLN  HB-         5.50    (#    480:20  Unique)
 &rst
  ixpk= 480, nxpk= 20, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1295,1296,
 &end
#
#   87 PHE  HZ          108 PHE  HB-         5.50    (#   3044:20  Unique)
 &rst
  ixpk= 3044, nxpk= 20, iat=1334,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1642,1643,
 &end
#
#   90 ASP  HN           43 SER  HA          4.50    (#    387:20  Unique)
 &rst
  ixpk= 387, nxpk= 20, iat=1378, 640, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ASP  HN           89 PRO  HA          4.50    (#    685:20  Unique)
 &rst
  ixpk= 685, nxpk= 20, iat=1378,1374, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  131 PRO  HG-         131 PRO  HA          5.50    (#   2139:20  Unique    )
 &rst
  ixpk= 2139, nxpk= 20, iat=  -1,1976, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1970,1971,
 &end
#
#   87 PHE  HN           86 PRO  HD-         6.50    (#   2866:20  Unique)
 &rst
  ixpk= 2866, nxpk= 20, iat=1322,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1309,1310,
 &end
#
#  131 PRO  HG+         131 PRO  HB-         4.50    (#   2143:20  Unique)
 &rst
  ixpk= 2143, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1970,1971,
 igr2=1973,1974,
 &end
#
#  124 LEU  HN          110 LEU  HB-         6.50    (#   3056:20  Unique)
 &rst
  ixpk= 3056, nxpk= 20, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1673,1674,
 &end
#
#  104 GLN  HA          103 GLY  HA-         4.50    (#   3005:20  Unique)
 &rst
  ixpk= 3005, nxpk= 20, iat=1576,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1569,1570,
 &end
#
#   94 GLN  HN           94 GLN  HA          5.50    (#   2918:20  Unique)
 &rst
  ixpk= 2918, nxpk= 20, iat=1427,1429, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   53 GLY  HA-          62 VAL  MGX         5.50    (#   1887:20  Unique)
 &rst
  ixpk= 1887, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 798, 799,
 igr2= 952, 953, 954, 956, 957, 958,
 &end
#
#   20 PHE  HE           24 LEU  MDX         4.50    (#   1354:20  Unique)
 &rst
  ixpk= 1354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 305, 309,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#   24 LEU  HN           24 LEU  MDX         5.50    (#   1452:20  Unique)
 &rst
  ixpk= 1452, nxpk= 20, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 358, 359, 360, 362, 363, 364,
 &end
#
#  126 CYS  HA          132 LEU  MDX         4.50    (#   1454:20  Unique)
 &rst
  ixpk= 1454, nxpk= 20, iat=1904,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#  108 PHE  HD          132 LEU  MDY         5.50    (#   2177:20  Unique)
 &rst
  ixpk= 2177, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1646,1654,
 igr2=1989,1990,1991,1993,1994,1995,
 &end
#
#   14 ARG  HB+          14 ARG  HG-         2.80    (#   2666:20  Unique)
 &rst
  ixpk= 2666, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 202, 203,
 igr2= 205, 206,
 &end
#
#  132 LEU  MDX         132 LEU  HA          4.50    (#      2:20  Unique)
 &rst
  ixpk= 2, nxpk= 20, iat=  -1,1982, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#  133 ASP  HB+         132 LEU  HA          4.50    (#      4:20  Unique)
 &rst
  ixpk= 4, nxpk= 20, iat=  -1,1982, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2003,2004,
 &end
#
#   22 ALA  MB           22 ALA  HA          2.80    (#    181:20  Unique)
 &rst
  ixpk= 181, nxpk= 20, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 333, 334, 335,
 &end
#
#  100 LEU  HG          106 THR  HA          6.50    (#   3022:20  Unique)
 &rst
  ixpk= 3022, nxpk= 20, iat=1533,1612, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   97 VAL  HA           97 VAL  MGY         3.50    (#    502:20  Unique)
 &rst
  ixpk= 502, nxpk= 20, iat=1477,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1481,1482,1483,1485,1486,1487,
 &end
#
#  122 LEU  HB-         121 LEU  HB+         4.50    (#   3142:20  Unique)
 &rst
  ixpk= 3142, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1838,1839,
 igr2=1819,1820,
 &end
#
#   79 GLU  HB+          79 GLU  HA          4.50    (#     68:20  Unique)
 &rst
  ixpk= 68, nxpk= 20, iat=  -1,1193, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1195,1196,
 &end
#
#   99 ILE  QD1          99 ILE  HB          4.50    (#    747:20  Unique)
 &rst
  ixpk= 747, nxpk= 20, iat=  -1,1511, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1520,1521,1522,
 &end
#
#   96 GLN  HN           95 PRO  HA          5.50    (#   2037:20  Unique)
 &rst
  ixpk= 2037, nxpk= 20, iat=1458,1454, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 PRO  HD+          86 PRO  HB+         4.50    (#   1876:20  Unique)
 &rst
  ixpk= 1876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1309,1310,
 igr2=1315,1316,
 &end
#
#   41 HIS  HN           41 HIS  HA          5.50    (#   2567:20  Unique)
 &rst
  ixpk= 2567, nxpk= 20, iat= 601, 603, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  119 GLU  HB+         118 GLY  HN          4.50    (#      0:10  Unique         4.41, 5.10 A)
 &rst
  ixpk= 0, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1=1790,1791,
 &end
#
#  114 ASN  HB+         118 GLY  HN          4.50    (#      1:10  Unique         3.27, 4.39 A)
 &rst
  ixpk= 1, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1738,1739,
 &end
#
#  114 ASN  HB-         118 GLY  HN          4.50    (#      2:10  Unique         3.27, 4.39 A)
 &rst
  ixpk= 2, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1738,1739,
 &end
#
#  118 GLY  HA+         118 GLY  HN          3.50    (#      3:10  Unique         2.91, 6.95 A)
 &rst
  ixpk= 3, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1781,1782,
 &end
#
#    0 AMB  10-2:4      118 GLY  HN          5.50    (#      4:10  Single Ambig)
 &rst
  ixpk= 4, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1229,1230,1229,1230,
 &end
#
#    0 AMB  10-2:5      118 GLY  HN          4.50    (#      5:10  Single Ambig)
 &rst
  ixpk= 5, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1750,1760,1761,
 &end
#
#  118 GLY  HA-         118 GLY  HN          3.50    (#      6:10  Unique         2.91, 6.95 A)
 &rst
  ixpk= 6, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1781,1782,
 &end
#
#  117 THR  HB          118 GLY  HN          4.50    (#      7:10  Unique         2.87, 3.66 A)
 &rst
  ixpk= 7, nxpk= 10, iat=1769,1779, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  117 THR  HA          118 GLY  HN          4.50    (#      8:10  Unique         3.50, 3.53 A)
 &rst
  ixpk= 8, nxpk= 10, iat=1767,1779, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  117 THR  HN          118 GLY  HN          3.50    (#      9:10  Unique         2.13, 2.42 A)
 &rst
  ixpk= 9, nxpk= 10, iat=1765,1779, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  119 GLU  HN          118 GLY  HN          3.50    (#     10:10  Unique         2.42, 2.49 A)
 &rst
  ixpk= 10, nxpk= 10, iat=1786,1779, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    6 GLU  HA            7 ASP  HN          4.50    (#     13:10  Unique         2.16, 2.66 A)
 &rst
  ixpk= 13, nxpk= 10, iat=  85,  98, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 ASP  HB+           7 ASP  HN          5.50    (#     14:10  Unique         2.02, 2.76 A)
 &rst
  ixpk= 14, nxpk= 10, iat=  -1,  98, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 102, 103,
 &end
#
#    7 ASP  HA            8 VAL  HN          3.50    (#     20:10  Unique         2.15, 2.83 A)
 &rst
  ixpk= 20, nxpk= 10, iat= 100, 110, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 VAL  HA            8 VAL  HN          3.50    (#     21:10  Unique         2.27, 2.85 A)
 &rst
  ixpk= 21, nxpk= 10, iat= 112, 110, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 ASP  HB+           8 VAL  HN          4.50    (#     22:10  Unique         2.02, 4.13 A)
 &rst
  ixpk= 22, nxpk= 10, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 102, 103,
 &end
#
#    8 VAL  HB            8 VAL  HN          3.50    (#     23:10  Unique         2.32, 2.48 A)
 &rst
  ixpk= 23, nxpk= 10, iat= 114, 110, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 VAL  MGX           8 VAL  HN          3.50    (#     24:10  Unique         2.04, 3.87 A)
 &rst
  ixpk= 24, nxpk= 10, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#    9 ALA  HA            9 ALA  HN          3.50    (#     26:10  Unique         2.68, 2.79 A)
 &rst
  ixpk= 26, nxpk= 10, iat= 128, 126, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:27       9 ALA  HN          4.50    (#     27:10  Single Ambig)
 &rst
  ixpk= 27, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 102, 103, 140, 141,
 &end
#
#    8 VAL  HB            9 ALA  HN          3.50    (#     28:10  Unique         2.63, 2.86 A)
 &rst
  ixpk= 28, nxpk= 10, iat= 114, 126, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 ALA  MB            9 ALA  HN          2.80    (#     29:10  Unique         2.16, 2.83 A)
 &rst
  ixpk= 29, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 130, 131, 132,
 &end
#
#    8 VAL  MGY           9 ALA  HN          3.50    (#     30:10  Unique         3.32, 4.70 A)
 &rst
  ixpk= 30, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#    0 AMB  10-2:31       9 ALA  HN          4.50    (#     31:10  Single Ambig)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1824,1825,1826,1828,1829,1830,1215,1216,1217,1219,
      1220,1221,
 &end
#
#   12 ARG  HN           11 THR  HN          3.50    (#     33:10  Unique         2.72, 2.81 A)
 &rst
  ixpk= 33, nxpk= 10, iat= 164, 150, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 ALA  HN           11 THR  HN          4.50    (#     34:10  Unique         4.05, 4.17 A)
 &rst
  ixpk= 34, nxpk= 10, iat= 188, 150, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 THR  HB           11 THR  HN          2.80    (#     36:10  Unique         2.49, 2.59 A)
 &rst
  ixpk= 36, nxpk= 10, iat= 154, 150, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   11 THR  HA           11 THR  HN          3.50    (#     37:10  Unique         2.81, 2.85 A)
 &rst
  ixpk= 37, nxpk= 10, iat= 152, 150, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:39      11 THR  HN          4.50    (#     39:10  Single Ambig)
 &rst
  ixpk= 39, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 156, 157, 158,1819,1820,
 &end
#
#    8 VAL  MGY          11 THR  HN          5.50    (#     40:10  Unique         4.65, 6.12 A)
 &rst
  ixpk= 40, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#   14 ARG  HN           13 ALA  HN          3.50    (#     42:10  Unique         2.65, 2.72 A)
 &rst
  ixpk= 42, nxpk= 10, iat= 198, 188, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:44      13 ALA  HN          2.80    (#     44:10  Single Ambig)
 &rst
  ixpk= 44, nxpk= 10, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 190, 166,
 &end
#
#    9 ALA  HA           13 ALA  HN          4.50    (#     45:10  Unique         3.58, 3.82 A)
 &rst
  ixpk= 45, nxpk= 10, iat= 128, 188, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 ARG  HB-          13 ALA  HN          3.50    (#     46:10  Unique         2.66, 3.46 A)
 &rst
  ixpk= 46, nxpk= 10, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 168, 169,
 &end
#
#   12 ARG  HB+          13 ALA  HN          3.50    (#     47:10  Unique         2.66, 3.46 A)
 &rst
  ixpk= 47, nxpk= 10, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 168, 169,
 &end
#
#   13 ALA  MB           13 ALA  HN          2.80    (#     48:10  Unique         2.45, 2.89 A)
 &rst
  ixpk= 48, nxpk= 10, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 192, 193, 194,
 &end
#
#   80 LEU  HG           13 ALA  HN          4.50    (#     49:10  Unique         3.82, 4.65 A)
 &rst
  ixpk= 49, nxpk= 10, iat=1213, 188, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 LEU  MDX          13 ALA  HN          3.50    (#     50:10  Unique         2.75, 4.35 A)
 &rst
  ixpk= 50, nxpk= 10, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#  121 LEU  HG           13 ALA  HN          5.50    (#     51:10  Unique         4.15, 4.45 A)
 &rst
  ixpk= 51, nxpk= 10, iat=1822, 188, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 GLU  HN           14 ARG  HN          3.50    (#     52:10  Unique         2.62, 2.67 A)
 &rst
  ixpk= 52, nxpk= 10, iat= 222, 198, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 ALA  HN           14 ARG  HN          3.50    (#     53:10  Unique         2.65, 2.72 A)
 &rst
  ixpk= 53, nxpk= 10, iat= 188, 198, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:54      14 ARG  HN          3.50    (#     54:10  Single Ambig)
 &rst
  ixpk= 54, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 190, 166,
 &end
#
#   14 ARG  HA           14 ARG  HN          3.50    (#     55:10  Unique         2.89, 2.91 A)
 &rst
  ixpk= 55, nxpk= 10, iat= 200, 198, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:56      14 ARG  HN          4.50    (#     56:10  Single Ambig)
 &rst
  ixpk= 56, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 208, 209, 208, 209,
 &end
#
#    0 AMB  10-2:57      14 ARG  HN          2.80    (#     57:10  Single Ambig)
 &rst
  ixpk= 57, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 202, 203, 202, 203,
 &end
#
#   14 ARG  HG+          14 ARG  HN          3.50    (#     58:10  Unique         2.11, 3.02 A)
 &rst
  ixpk= 58, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 205, 206,
 &end
#
#   12 ARG  HG+          14 ARG  HN          6.50    (#     59:10  Unique         6.10, 6.73 A)
 &rst
  ixpk= 59, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 171, 172,
 &end
#
#   14 ARG  HG-          14 ARG  HN          3.50    (#     60:10  Unique         2.11, 3.02 A)
 &rst
  ixpk= 60, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 205, 206,
 &end
#
#   13 ALA  MB           14 ARG  HN          3.50    (#     61:10  Unique         2.49, 3.41 A)
 &rst
  ixpk= 61, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 192, 193, 194,
 &end
#
#    0 AMB  10-2:63      14 ARG  HN          5.50    (#     63:10  Single Ambig)
 &rst
  ixpk= 63, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1215,1216,1217,1219,1220,1221,2051,2052,2053,2055,
      2056,2057,1876,1877,1878,1880,1881,1882,
 &end
#
#  122 LEU  MDX          14 ARG  HN          4.50    (#     64:10  Unique         3.23, 5.20 A)
 &rst
  ixpk= 64, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1843,1844,1845,1847,1848,1849,
 &end
#
#  121 LEU  HG           14 ARG  HN          6.50    (#     65:10  Unique         5.57, 5.82 A)
 &rst
  ixpk= 65, nxpk= 10, iat=1822, 198, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   14 ARG  HN           15 GLU  HN          3.50    (#     66:10  Unique         2.62, 2.67 A)
 &rst
  ixpk= 66, nxpk= 10, iat= 198, 222, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   15 GLU  HA           15 GLU  HN          3.50    (#     67:10  Unique         2.85, 2.89 A)
 &rst
  ixpk= 67, nxpk= 10, iat= 224, 222, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 ARG  HA           15 GLU  HN          4.50    (#     68:10  Unique         3.52, 3.53 A)
 &rst
  ixpk= 68, nxpk= 10, iat= 200, 222, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 GLU  HG+          15 GLU  HN          4.50    (#     69:10  Unique         2.29, 3.49 A)
 &rst
  ixpk= 69, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 229, 230,
 &end
#
#   15 GLU  HB+          15 GLU  HN          3.50    (#     71:10  Unique         2.15, 2.82 A)
 &rst
  ixpk= 71, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 226, 227,
 &end
#
#    0 AMB  10-2:72      15 GLU  HN          3.50    (#     72:10  Single Ambig)
 &rst
  ixpk= 72, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 202, 203, 202, 203,
 &end
#
#   14 ARG  HG+          15 GLU  HN          4.50    (#     73:10  Unique         3.68, 4.71 A)
 &rst
  ixpk= 73, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 205, 206,
 &end
#
#   14 ARG  HG-          15 GLU  HN          5.50    (#     74:10  Unique         3.68, 4.71 A)
 &rst
  ixpk= 74, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 205, 206,
 &end
#
#   13 ALA  MB           15 GLU  HN          4.50    (#     75:10  Unique         5.01, 5.57 A)
 &rst
  ixpk= 75, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 192, 193, 194,
 &end
#
#   11 THR  MG2          15 GLU  HN          4.50    (#     76:10  Unique         4.31, 5.40 A)
 &rst
  ixpk= 76, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 156, 157, 158,
 &end
#
#    0 AMB  10-2:78      15 GLU  HN          6.50    (#     78:10  Single Ambig)
 &rst
  ixpk= 78, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1843,1844,1845,1847,1848,1849,1215,1216,1217,1219,
      1220,1221,
 &end
#
#   18 ALA  HN           17 ALA  HN          3.50    (#     80:10  Unique         2.76, 2.81 A)
 &rst
  ixpk= 80, nxpk= 10, iat= 261, 251, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   16 THR  HB           17 ALA  HN          4.50    (#     81:10  Unique         2.67, 2.81 A)
 &rst
  ixpk= 81, nxpk= 10, iat= 241, 251, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   16 THR  HA           17 ALA  HN          3.50    (#     82:10  Unique         3.55, 3.57 A)
 &rst
  ixpk= 82, nxpk= 10, iat= 239, 251, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ALA  HA           17 ALA  HN          3.50    (#     83:10  Unique         2.85, 2.86 A)
 &rst
  ixpk= 83, nxpk= 10, iat= 253, 251, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 ARG  HA           17 ALA  HN          4.50    (#     84:10  Unique         3.44, 3.54 A)
 &rst
  ixpk= 84, nxpk= 10, iat= 200, 251, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 ALA  MB           17 ALA  HN          2.80    (#     85:10  Unique         2.42, 2.86 A)
 &rst
  ixpk= 85, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 255, 256, 257,
 &end
#
#    0 AMB  10-2:86      17 ALA  HN          5.50    (#     86:10  Single Ambig)
 &rst
  ixpk= 86, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1876,1877,1878,1880,1881,1882,1215,1216,1217,1219,
      1220,1221,
 &end
#
#    0 AMB  10-2:87      17 ALA  HN          4.50    (#     87:10  Single Ambig)
 &rst
  ixpk= 87, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1843,1844,1845,1847,1848,1849,1215,1216,1217,1219,
      1220,1221,
 &end
#
#   17 ALA  HN           18 ALA  HN          3.50    (#     88:10  Unique         2.76, 2.81 A)
 &rst
  ixpk= 88, nxpk= 10, iat= 251, 261, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ALA  HA           18 ALA  HN          4.50    (#     90:10  Unique         3.60, 3.62 A)
 &rst
  ixpk= 90, nxpk= 10, iat= 253, 261, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 ALA  MB           18 ALA  HN          2.80    (#     91:10  Unique         2.46, 2.86 A)
 &rst
  ixpk= 91, nxpk= 10, iat=  -1, 261, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 265, 266, 267,
 &end
#
#   20 PHE  HN           19 ARG  HN          3.50    (#     93:10  Unique         2.69, 2.82 A)
 &rst
  ixpk= 93, nxpk= 10, iat= 295, 271, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:94      19 ARG  HN          3.50    (#     94:10  Single Ambig)
 &rst
  ixpk= 94, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 273, 263,
 &end
#
#    0 AMB  10-2:95      19 ARG  HN          4.50    (#     95:10  Single Ambig)
 &rst
  ixpk= 95, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 239, 224,
 &end
#
#   19 ARG  HG-          19 ARG  HN          4.50    (#     97:10  Unique         2.38, 3.72 A)
 &rst
  ixpk= 97, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 278, 279,
 &end
#
#   19 ARG  HG+          19 ARG  HN          4.50    (#     98:10  Unique         2.38, 3.72 A)
 &rst
  ixpk= 98, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 278, 279,
 &end
#
#   18 ALA  MB           19 ARG  HN          2.80    (#     99:10  Unique         2.57, 3.42 A)
 &rst
  ixpk= 99, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 265, 266, 267,
 &end
#
#   22 ALA  HN           21 THR  HN          3.50    (#    100:10  Unique         2.86, 2.89 A)
 &rst
  ixpk= 100, nxpk= 10, iat= 329, 315, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   21 THR  HB           21 THR  HN          3.50    (#    103:10  Unique         2.54, 2.68 A)
 &rst
  ixpk= 103, nxpk= 10, iat= 319, 315, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:104     21 THR  HN          4.50    (#    104:10  Single Ambig)
 &rst
  ixpk= 104, nxpk= 10, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 263, 273,
 &end
#
#    0 AMB  10-2:105     21 THR  HN          3.50    (#    105:10  Single Ambig)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 317, 297,
 &end
#
#   20 PHE  HB-          21 THR  HN          3.50    (#    106:10  Unique         2.58, 3.36 A)
 &rst
  ixpk= 106, nxpk= 10, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 299, 300,
 &end
#
#   20 PHE  HB+          21 THR  HN          4.50    (#    107:10  Unique         2.58, 3.36 A)
 &rst
  ixpk= 107, nxpk= 10, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 299, 300,
 &end
#
#   21 THR  MG2          21 THR  HN          4.50    (#    108:10  Unique         3.01, 4.54 A)
 &rst
  ixpk= 108, nxpk= 10, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 321, 322, 323,
 &end
#
#    0 AMB  10-2:109     21 THR  HN          5.50    (#    109:10  Single Ambig)
 &rst
  ixpk= 109, nxpk= 10, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1876,1877,1878,1880,1881,1882, 358, 359, 360, 362,
       363, 364,
 &end
#
#   24 LEU  HN           23 ALA  HN          3.50    (#    110:10  Unique         2.66, 2.70 A)
 &rst
  ixpk= 110, nxpk= 10, iat= 349, 339, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   21 THR  HN           23 ALA  HN          5.50    (#    111:10  Unique         4.15, 4.22 A)
 &rst
  ixpk= 111, nxpk= 10, iat= 315, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 ALA  HA           23 ALA  HN          3.50    (#    112:10  Unique         3.57, 3.58 A)
 &rst
  ixpk= 112, nxpk= 10, iat= 331, 339, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   23 ALA  HA           23 ALA  HN          4.50    (#    113:10  Unique         2.85, 2.87 A)
 &rst
  ixpk= 113, nxpk= 10, iat= 341, 339, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:114     23 ALA  HN          4.50    (#    114:10  Single Ambig)
 &rst
  ixpk= 114, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 297, 317,
 &end
#
#    0 AMB  10-2:115     23 ALA  HN          2.80    (#    115:10  Single Ambig)
 &rst
  ixpk= 115, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 343, 344, 345, 333, 334, 335,
 &end
#
#    0 AMB  10-2:116     23 ALA  HN          5.50    (#    116:10  Single Ambig)
 &rst
  ixpk= 116, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 392, 393, 394, 396, 397, 398, 358, 359, 360, 362,
       363, 364,
 &end
#
#   26 LEU  HN           25 GLU  HN          3.50    (#    117:10  Unique         2.69, 2.75 A)
 &rst
  ixpk= 117, nxpk= 10, iat= 383, 368, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 ALA  HA           25 GLU  HN          4.50    (#    118:10  Unique         3.08, 3.21 A)
 &rst
  ixpk= 118, nxpk= 10, iat= 331, 368, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:119     25 GLU  HN          4.50    (#    119:10  Single Ambig)
 &rst
  ixpk= 119, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 351, 317,
 &end
#
#   25 GLU  HA           25 GLU  HN          3.50    (#    120:10  Unique         2.85, 2.87 A)
 &rst
  ixpk= 120, nxpk= 10, iat= 370, 368, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   25 GLU  HB-          25 GLU  HN          2.80    (#    121:10  Unique         2.22, 2.56 A)
 &rst
  ixpk= 121, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 372, 373,
 &end
#
#    0 AMB  10-2:122     25 GLU  HN          4.50    (#    122:10  Single Ambig)
 &rst
  ixpk= 122, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 353, 354, 375, 376,
 &end
#
#    0 AMB  10-2:123     25 GLU  HN          4.50    (#    123:10  Single Ambig)
 &rst
  ixpk= 123, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 333, 334, 335, 343, 344, 345,
 &end
#
#   24 LEU  HB+          25 GLU  HN          4.50    (#    124:10  Unique         2.71, 3.40 A)
 &rst
  ixpk= 124, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 353, 354,
 &end
#
#   24 LEU  MDX          25 GLU  HN          4.50    (#    125:10  Unique         4.69, 5.66 A)
 &rst
  ixpk= 125, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 358, 359, 360, 362, 363, 364,
 &end
#
#    0 AMB  10-2:126     25 GLU  HN          5.50    (#    126:10  Single Ambig)
 &rst
  ixpk= 126, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 425, 426, 427, 595, 596, 597,
 &end
#
#    0 AMB  10-2:127     25 GLU  HN          6.50    (#    127:10  Single Ambig)
 &rst
  ixpk= 127, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1= 358, 359, 360, 362, 363, 364,1517,1518,
 &end
#
#   25 GLU  HN           26 LEU  HN          3.50    (#    128:10  Unique         2.69, 2.75 A)
 &rst
  ixpk= 128, nxpk= 10, iat= 368, 383, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 ALA  HN           26 LEU  HN          3.50    (#    129:10  Unique         2.84, 2.88 A)
 &rst
  ixpk= 129, nxpk= 10, iat= 402, 383, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   23 ALA  HA           26 LEU  HN          4.50    (#    130:10  Unique         3.23, 3.38 A)
 &rst
  ixpk= 130, nxpk= 10, iat= 341, 383, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 GLU  HA           26 LEU  HN          4.50    (#    131:10  Unique         3.57, 3.58 A)
 &rst
  ixpk= 131, nxpk= 10, iat= 370, 383, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 GLU  HB+          26 LEU  HN          3.50    (#    132:10  Unique         2.35, 3.03 A)
 &rst
  ixpk= 132, nxpk= 10, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 372, 373,
 &end
#
#   26 LEU  HB-          26 LEU  HN          2.80    (#    133:10  Unique         2.03, 2.41 A)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 387, 388,
 &end
#
#   26 LEU  HB+          26 LEU  HN          2.80    (#    134:10  Unique         2.03, 2.41 A)
 &rst
  ixpk= 134, nxpk= 10, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 387, 388,
 &end
#
#    0 AMB  10-2:135     26 LEU  HN          4.50    (#    135:10  Single Ambig)
 &rst
  ixpk= 135, nxpk= 10, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 406, 407, 408,1517,1518,
 &end
#
#    0 AMB  10-2:136     26 LEU  HN          6.50    (#    136:10  Single Ambig)
 &rst
  ixpk= 136, nxpk= 10, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 565, 566, 567, 569, 570, 571, 772, 773, 774, 776,
       777, 778,
 &end
#
#   26 LEU  MDX          26 LEU  HN          4.50    (#    137:10  Unique         4.35, 5.12 A)
 &rst
  ixpk= 137, nxpk= 10, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 392, 393, 394, 396, 397, 398,
 &end
#
#   31 ALA  HN           30 ARG  HN          3.50    (#    138:10  Unique         2.72, 2.75 A)
 &rst
  ixpk= 138, nxpk= 10, iat= 467, 443, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 ASP  HN            0 AMB  10-1:139    3.50    (#    139:10  Single Ambig)
 &rst
  ixpk= 139, nxpk= 10, iat= 431,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 412, 443,
 &end
#
#   30 ARG  HA           30 ARG  HN          3.50    (#    140:10  Unique         2.86, 2.90 A)
 &rst
  ixpk= 140, nxpk= 10, iat= 445, 443, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 ASP  HA           30 ARG  HN          4.50    (#    141:10  Unique         3.57, 3.59 A)
 &rst
  ixpk= 141, nxpk= 10, iat= 433, 443, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ILE  HA           28 ILE  HN          3.50    (#    142:10  Unique         2.86, 2.89 A)
 &rst
  ixpk= 142, nxpk= 10, iat= 414, 412, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   25 GLU  HA           28 ILE  HN          4.50    (#    143:10  Unique         3.19, 3.28 A)
 &rst
  ixpk= 143, nxpk= 10, iat= 370, 412, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 ASP  HB+          30 ARG  HN          3.50    (#    144:10  Unique         2.51, 3.23 A)
 &rst
  ixpk= 144, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 435, 436,
 &end
#
#   28 ILE  HB           28 ILE  HN          2.80    (#    146:10  Unique         2.36, 2.45 A)
 &rst
  ixpk= 146, nxpk= 10, iat= 416, 412, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   27 ALA  MB           28 ILE  HN          3.50    (#    147:10  Unique         2.60, 3.54 A)
 &rst
  ixpk= 147, nxpk= 10, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 406, 407, 408,
 &end
#
#   38 VAL  MGX          30 ARG  HN          4.50    (#    148:10  Unique         3.68, 5.53 A)
 &rst
  ixpk= 148, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#   31 ALA  MB            0 AMB  10-1:149    4.50    (#    149:10  Single Ambig)
 &rst
  ixpk= 149, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 471, 472, 473,
 igr2= 412, 443,
 &end
#
#   38 VAL  MGY          30 ARG  HN          4.50    (#    150:10  Unique         3.68, 5.53 A)
 &rst
  ixpk= 150, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#   28 ILE  QG2          28 ILE  HN          4.50    (#    151:10  Unique         4.33, 4.57 A)
 &rst
  ixpk= 151, nxpk= 10, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 418, 419, 420,
 &end
#
#   28 ILE  QD1          28 ILE  HN          4.50    (#    152:10  Unique         2.70, 4.21 A)
 &rst
  ixpk= 152, nxpk= 10, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 425, 426, 427,
 &end
#
#   30 ARG  HN           31 ALA  HN          3.50    (#    153:10  Unique         2.72, 2.75 A)
 &rst
  ixpk= 153, nxpk= 10, iat= 443, 467, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 ALA  HA           31 ALA  HN          3.50    (#    154:10  Unique         2.84, 2.89 A)
 &rst
  ixpk= 154, nxpk= 10, iat= 469, 467, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:156     31 ALA  HN          4.50    (#    156:10  Single Ambig)
 &rst
  ixpk= 156, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 433, 481,
 &end
#
#    0 AMB  10-2:157     31 ALA  HN          4.50    (#    157:10  Single Ambig)
 &rst
  ixpk= 157, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 445, 514, 515,
 &end
#
#   28 ILE  HA           31 ALA  HN          4.50    (#    158:10  Unique         3.14, 3.35 A)
 &rst
  ixpk= 158, nxpk= 10, iat= 414, 467, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   30 ARG  HB+          31 ALA  HN          3.50    (#    159:10  Unique         2.76, 3.49 A)
 &rst
  ixpk= 159, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 447, 448,
 &end
#
#   31 ALA  MB           31 ALA  HN          3.50    (#    160:10  Unique         2.34, 2.90 A)
 &rst
  ixpk= 160, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 471, 472, 473,
 &end
#
#   38 VAL  MGY          31 ALA  HN          3.50    (#    161:10  Unique         2.74, 4.46 A)
 &rst
  ixpk= 161, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  10-2:162     31 ALA  HN          5.50    (#    162:10  Single Ambig)
 &rst
  ixpk= 162, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1513,1514,1515, 772, 773, 774, 776, 777, 778,
 &end
#
#   33 LEU  HN           32 THR  HN          2.80    (#    163:10  Unique         2.46, 2.56 A)
 &rst
  ixpk= 163, nxpk= 10, iat= 491, 477, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   31 ALA  HN           32 THR  HN          3.50    (#    164:10  Unique         2.70, 2.76 A)
 &rst
  ixpk= 164, nxpk= 10, iat= 467, 477, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 ALA  HA           32 THR  HN          4.50    (#    166:10  Unique         3.55, 3.60 A)
 &rst
  ixpk= 166, nxpk= 10, iat= 469, 477, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:167     32 THR  HN          3.50    (#    167:10  Single Ambig)
 &rst
  ixpk= 167, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 481, 433,
 &end
#
#   32 THR  HA           32 THR  HN          3.50    (#    168:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 168, nxpk= 10, iat= 479, 477, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  101 ALA  HA           32 THR  HN          4.50    (#    169:10  Unique         2.97, 3.36 A)
 &rst
  ixpk= 169, nxpk= 10, iat=1547, 477, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ILE  HA           32 THR  HN          5.50    (#    170:10  Unique         4.00, 4.26 A)
 &rst
  ixpk= 170, nxpk= 10, iat= 414, 477, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 THR  MG2          32 THR  HN          2.80    (#    171:10  Unique         2.27, 3.19 A)
 &rst
  ixpk= 171, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 483, 484, 485,
 &end
#
#    0 AMB  10-2:172     32 THR  HN          5.50    (#    172:10  Single Ambig)
 &rst
  ixpk= 172, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1513,1514,1515, 772, 773, 774, 776, 777, 778,
 &end
#
#   38 VAL  MGY          32 THR  HN          5.50    (#    173:10  Unique         5.17, 6.82 A)
 &rst
  ixpk= 173, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  10-2:174     33 LEU  HN          4.50    (#    174:10  Single Ambig)
 &rst
  ixpk= 174, nxpk= 10, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 481, 433, 512,
 &end
#
#   33 LEU  HA           33 LEU  HN          2.80    (#    175:10  Unique         2.85, 2.88 A)
 &rst
  ixpk= 175, nxpk= 10, iat= 493, 491, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   33 LEU  HB-          33 LEU  HN          2.80    (#    177:10  Unique         2.31, 2.96 A)
 &rst
  ixpk= 177, nxpk= 10, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 495, 496,
 &end
#
#   33 LEU  HB+          33 LEU  HN          3.50    (#    178:10  Unique         2.31, 2.96 A)
 &rst
  ixpk= 178, nxpk= 10, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 495, 496,
 &end
#
#   32 THR  MG2          33 LEU  HN          3.50    (#    179:10  Unique         2.62, 3.41 A)
 &rst
  ixpk= 179, nxpk= 10, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 483, 484, 485,
 &end
#
#   33 LEU  MDX          33 LEU  HN          3.50    (#    180:10  Unique         3.58, 4.51 A)
 &rst
  ixpk= 180, nxpk= 10, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 500, 501, 502, 504, 505, 506,
 &end
#
#   31 ALA  HA           34 SER  HN          4.50    (#    182:10  Unique         3.37, 3.62 A)
 &rst
  ixpk= 182, nxpk= 10, iat= 469, 510, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 SER  HA           34 SER  HN          3.50    (#    183:10  Unique         2.85, 2.90 A)
 &rst
  ixpk= 183, nxpk= 10, iat= 512, 510, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 LEU  HA           34 SER  HN          3.50    (#    184:10  Unique         3.50, 3.54 A)
 &rst
  ixpk= 184, nxpk= 10, iat= 493, 510, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 SER  HB-          34 SER  HN          3.50    (#    185:10  Unique         2.32, 2.97 A)
 &rst
  ixpk= 185, nxpk= 10, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 514, 515,
 &end
#
#   34 SER  HB+          34 SER  HN          3.50    (#    186:10  Unique         2.32, 2.97 A)
 &rst
  ixpk= 186, nxpk= 10, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 514, 515,
 &end
#
#   33 LEU  HG           34 SER  HN          4.50    (#    188:10  Unique         2.42, 4.22 A)
 &rst
  ixpk= 188, nxpk= 10, iat= 498, 510, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   33 LEU  HB-          34 SER  HN          4.50    (#    189:10  Unique         2.58, 3.31 A)
 &rst
  ixpk= 189, nxpk= 10, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 495, 496,
 &end
#
#   33 LEU  HB+          34 SER  HN          4.50    (#    190:10  Unique         2.58, 3.31 A)
 &rst
  ixpk= 190, nxpk= 10, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 495, 496,
 &end
#
#    0 AMB  10-2:192     34 SER  HN          5.50    (#    192:10  Single Ambig)
 &rst
  ixpk= 192, nxpk= 10, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 565, 566, 567, 569, 570, 571, 772, 773, 774, 776,
       777, 778,
 &end
#
#   33 LEU  MDX          34 SER  HN          4.50    (#    193:10  Unique         3.16, 5.59 A)
 &rst
  ixpk= 193, nxpk= 10, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 500, 501, 502, 504, 505, 506,
 &end
#
#    0 AMB  10-2:194     35 GLY  HN          2.80    (#    194:10  Single Ambig)
 &rst
  ixpk= 194, nxpk= 10, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 528, 510,
 &end
#
#   31 ALA  HA           35 GLY  HN          4.50    (#    196:10  Unique         4.04, 4.42 A)
 &rst
  ixpk= 196, nxpk= 10, iat= 469, 521, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 SER  HA           35 GLY  HN          3.50    (#    197:10  Unique         3.35, 3.45 A)
 &rst
  ixpk= 197, nxpk= 10, iat= 512, 521, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 SER  HB+          35 GLY  HN          4.50    (#    199:10  Unique         2.93, 3.82 A)
 &rst
  ixpk= 199, nxpk= 10, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 514, 515,
 &end
#
#   36 GLN  HB+          35 GLY  HN          5.50    (#    201:10  Unique         5.24, 5.70 A)
 &rst
  ixpk= 201, nxpk= 10, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 532, 533,
 &end
#
#   33 LEU  MDX          35 GLY  HN          5.50    (#    203:10  Unique         5.06, 7.47 A)
 &rst
  ixpk= 203, nxpk= 10, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 500, 501, 502, 504, 505, 506,
 &end
#
#   34 SER  HB+          33 LEU  HN          4.50    (#    206:10  Unique         4.65, 5.39 A)
 &rst
  ixpk= 206, nxpk= 10, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 514, 515,
 &end
#
#   36 GLN  HB-          36 GLN  HN          3.50    (#    208:10  Unique         2.66, 3.14 A)
 &rst
  ixpk= 208, nxpk= 10, iat=  -1, 528, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 532, 533,
 &end
#
#   39 GLY  HN           38 VAL  HN          5.50    (#    209:10  Unique         4.48, 4.59 A)
 &rst
  ixpk= 209, nxpk= 10, iat= 575, 559, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 ILE  HN           38 VAL  HN          4.50    (#    210:10  Unique         2.88, 3.08 A)
 &rst
  ixpk= 210, nxpk= 10, iat=1507, 559, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 PRO  HA           38 VAL  HN          2.80    (#    211:10  Unique         2.18, 2.26 A)
 &rst
  ixpk= 211, nxpk= 10, iat= 555, 559, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  100 LEU  HA           38 VAL  HN          4.50    (#    213:10  Unique         3.96, 4.13 A)
 &rst
  ixpk= 213, nxpk= 10, iat=1528, 559, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 PRO  HB-          38 VAL  HN          3.50    (#    214:10  Unique         2.84, 3.31 A)
 &rst
  ixpk= 214, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 552, 553,
 &end
#
#   37 PRO  HB+          38 VAL  HN          3.50    (#    215:10  Unique         2.84, 3.31 A)
 &rst
  ixpk= 215, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 552, 553,
 &end
#
#    0 AMB  10-2:216     38 VAL  HN          5.50    (#    216:10  Single Ambig)
 &rst
  ixpk= 216, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 786, 787,1530,1531,
 &end
#
#    0 AMB  10-2:217     38 VAL  HN          3.50    (#    217:10  Single Ambig)
 &rst
  ixpk= 217, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 563,1511,
 &end
#
#    0 AMB  10-2:218     38 VAL  HN          4.50    (#    218:10  Single Ambig)
 &rst
  ixpk= 218, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 406, 407, 408,1517,1518, 450, 451,
 &end
#
#   31 ALA  MB           38 VAL  HN          3.50    (#    219:10  Unique         2.43, 3.43 A)
 &rst
  ixpk= 219, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 471, 472, 473,
 &end
#
#   38 VAL  MGX          38 VAL  HN          3.50    (#    220:10  Unique         2.39, 4.20 A)
 &rst
  ixpk= 220, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  10-2:221     38 VAL  HN          5.50    (#    221:10  Single Ambig)
 &rst
  ixpk= 221, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 772, 773, 774, 776, 777, 778, 418, 419, 420,
 &end
#
#   39 GLY  HN           40 ILE  HN          4.50    (#    222:10  Unique         4.45, 4.48 A)
 &rst
  ixpk= 222, nxpk= 10, iat= 575, 582, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 ILE  HN           40 ILE  HN          5.50    (#    223:10  Unique         4.86, 5.23 A)
 &rst
  ixpk= 223, nxpk= 10, iat=1507, 582, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 VAL  HN           40 ILE  HN          4.50    (#    224:10  Unique         2.93, 3.13 A)
 &rst
  ixpk= 224, nxpk= 10, iat=1475, 582, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 ILE  HA           40 ILE  HN          4.50    (#    226:10  Unique         2.97, 2.98 A)
 &rst
  ixpk= 226, nxpk= 10, iat= 584, 582, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   98 VAL  HA           40 ILE  HN          4.50    (#    227:10  Unique         3.52, 3.70 A)
 &rst
  ixpk= 227, nxpk= 10, iat=1493, 582, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 VAL  HB           40 ILE  HN          4.50    (#    229:10  Unique         2.81, 2.96 A)
 &rst
  ixpk= 229, nxpk= 10, iat=1479, 582, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   95 PRO  HB+          40 ILE  HN          3.50    (#    230:10  Unique         2.22, 2.79 A)
 &rst
  ixpk= 230, nxpk= 10, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1451,1452,
 &end
#
#   40 ILE  HG1-         40 ILE  HN          4.50    (#    231:10  Unique         2.78, 3.47 A)
 &rst
  ixpk= 231, nxpk= 10, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 592, 593,
 &end
#
#   40 ILE  HG1+         40 ILE  HN          3.50    (#    232:10  Unique         2.78, 3.47 A)
 &rst
  ixpk= 232, nxpk= 10, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 592, 593,
 &end
#
#   99 ILE  QD1          40 ILE  HN          4.50    (#    233:10  Unique         3.43, 4.01 A)
 &rst
  ixpk= 233, nxpk= 10, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1520,1521,1522,
 &end
#
#    0 AMB  10-2:234     40 ILE  HN          4.50    (#    234:10  Single Ambig)
 &rst
  ixpk= 234, nxpk= 10, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1448,1449,1462,1463,
 &end
#
#   40 ILE  QG2          40 ILE  HN          4.50    (#    235:10  Unique         4.49, 4.80 A)
 &rst
  ixpk= 235, nxpk= 10, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 588, 589, 590,
 &end
#
#   95 PRO  HG-          40 ILE  HN          4.50    (#    236:10  Unique         4.12, 4.41 A)
 &rst
  ixpk= 236, nxpk= 10, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1448,1449,
 &end
#
#   45 SER  HN           44 ASP  HN          4.50    (#    237:10  Unique         2.46, 2.81 A)
 &rst
  ixpk= 237, nxpk= 10, iat= 661, 649, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   43 SER  HA           44 ASP  HN          3.50    (#    238:10  Unique         2.41, 2.67 A)
 &rst
  ixpk= 238, nxpk= 10, iat= 640, 649, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 SER  HB+          44 ASP  HN          4.50    (#    240:10  Unique         1.98, 3.19 A)
 &rst
  ixpk= 240, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 642, 643,
 &end
#
#    0 AMB  10-2:241     44 ASP  HN          3.50    (#    241:10  Single Ambig)
 &rst
  ixpk= 241, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 653, 654, 653, 654,
 &end
#
#   89 PRO  HB-          44 ASP  HN          6.50    (#    242:10  Unique         2.87, 4.46 A)
 &rst
  ixpk= 242, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1371,1372,
 &end
#
#   46 ALA  HN           45 SER  HN          4.50    (#    243:10  Unique         1.86, 2.20 A)
 &rst
  ixpk= 243, nxpk= 10, iat= 672, 661, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   44 ASP  HN           45 SER  HN          4.50    (#    244:10  Unique         2.46, 2.81 A)
 &rst
  ixpk= 244, nxpk= 10, iat= 649, 661, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 SER  HA           45 SER  HN          3.50    (#    245:10  Unique         2.23, 2.94 A)
 &rst
  ixpk= 245, nxpk= 10, iat= 663, 661, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 SER  HB-          45 SER  HN          4.50    (#    246:10  Unique         2.80, 3.83 A)
 &rst
  ixpk= 246, nxpk= 10, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 642, 643,
 &end
#
#   43 SER  HB+          45 SER  HN          4.50    (#    247:10  Unique         2.80, 3.83 A)
 &rst
  ixpk= 247, nxpk= 10, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 642, 643,
 &end
#
#   45 SER  HB-          45 SER  HN          4.50    (#    248:10  Unique         2.46, 3.33 A)
 &rst
  ixpk= 248, nxpk= 10, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 665, 666,
 &end
#
#   45 SER  HB+          45 SER  HN          4.50    (#    249:10  Unique         2.46, 3.33 A)
 &rst
  ixpk= 249, nxpk= 10, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 665, 666,
 &end
#
#    0 AMB  10-2:250     45 SER  HN          4.50    (#    250:10  Single Ambig)
 &rst
  ixpk= 250, nxpk= 10, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 653, 654, 653, 654,
 &end
#
#   46 ALA  MB           45 SER  HN          5.50    (#    251:10  Unique         4.15, 5.14 A)
 &rst
  ixpk= 251, nxpk= 10, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 676, 677, 678,
 &end
#
#   45 SER  HN           46 ALA  HN          4.50    (#    252:10  Unique         1.86, 2.20 A)
 &rst
  ixpk= 252, nxpk= 10, iat= 661, 672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:253     46 ALA  HN          4.50    (#    253:10  Single Ambig)
 &rst
  ixpk= 253, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 638, 649,
 &end
#
#   45 SER  HA           46 ALA  HN          4.50    (#    254:10  Unique         2.97, 3.49 A)
 &rst
  ixpk= 254, nxpk= 10, iat= 663, 672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   43 SER  HB-          46 ALA  HN          4.50    (#    255:10  Unique         2.15, 3.77 A)
 &rst
  ixpk= 255, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 642, 643,
 &end
#
#   46 ALA  HA           46 ALA  HN          3.50    (#    256:10  Unique         2.90, 2.96 A)
 &rst
  ixpk= 256, nxpk= 10, iat= 674, 672, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 SER  HB+          46 ALA  HN          5.50    (#    257:10  Unique         2.15, 3.77 A)
 &rst
  ixpk= 257, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 642, 643,
 &end
#
#   45 SER  HB-          46 ALA  HN          5.50    (#    258:10  Unique         2.61, 3.96 A)
 &rst
  ixpk= 258, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 665, 666,
 &end
#
#   45 SER  HB+          46 ALA  HN          5.50    (#    259:10  Unique         2.61, 3.96 A)
 &rst
  ixpk= 259, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 665, 666,
 &end
#
#    0 AMB  10-2:260     46 ALA  HN          5.50    (#    260:10  Single Ambig)
 &rst
  ixpk= 260, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 653, 654, 653, 654,
 &end
#
#   46 ALA  MB           46 ALA  HN          3.50    (#    261:10  Unique         2.53, 3.31 A)
 &rst
  ixpk= 261, nxpk= 10, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 676, 677, 678,
 &end
#
#   51 VAL  HN           50 MET  HN          5.50    (#    262:10  Unique         4.39, 4.43 A)
 &rst
  ixpk= 262, nxpk= 10, iat= 766, 749, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 MET  HA           50 MET  HN          4.50    (#    263:10  Unique         2.97, 2.98 A)
 &rst
  ixpk= 263, nxpk= 10, iat= 751, 749, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:264     50 MET  HN          5.50    (#    264:10  Single Ambig)
 &rst
  ixpk= 264, nxpk= 10, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 980, 981, 740, 741,
 &end
#
#   40 ILE  HG1-         50 MET  HN          4.50    (#    265:10  Unique         3.56, 4.31 A)
 &rst
  ixpk= 265, nxpk= 10, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 592, 593,
 &end
#
#   49 ILE  QG2          50 MET  HN          3.50    (#    266:10  Unique         2.42, 3.17 A)
 &rst
  ixpk= 266, nxpk= 10, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 736, 737, 738,
 &end
#
#    0 AMB  10-2:267     50 MET  HN          4.50    (#    267:10  Single Ambig)
 &rst
  ixpk= 267, nxpk= 10, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 985, 986, 987, 989, 990, 991, 743, 744, 745,
 &end
#
#   63 PRO  HA           51 VAL  HN          4.50    (#    270:10  Unique         3.70, 3.93 A)
 &rst
  ixpk= 270, nxpk= 10, iat= 972, 766, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 MET  HB+          51 VAL  HN          4.50    (#    271:10  Unique         2.75, 3.42 A)
 &rst
  ixpk= 271, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 753, 754,
 &end
#
#    0 AMB  10-2:272     51 VAL  HN          4.50    (#    272:10  Single Ambig)
 &rst
  ixpk= 272, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 980, 981, 760, 761, 762,
 &end
#
#   64 LEU  HB+          51 VAL  HN          4.50    (#    273:10  Unique         3.13, 4.58 A)
 &rst
  ixpk= 273, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#   51 VAL  MGY          51 VAL  HN          4.50    (#    274:10  Unique         2.18, 3.64 A)
 &rst
  ixpk= 274, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 772, 773, 774, 776, 777, 778,
 &end
#
#   51 VAL  MGX          51 VAL  HN          3.50    (#    275:10  Unique         2.18, 3.64 A)
 &rst
  ixpk= 275, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 772, 773, 774, 776, 777, 778,
 &end
#
#   54 LYS  HA           55 THR  HN          4.50    (#    276:10  Unique         3.43, 3.50 A)
 &rst
  ixpk= 276, nxpk= 10, iat= 805, 825, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:277     55 THR  HN          5.50    (#    277:10  Single Ambig)
 &rst
  ixpk= 277, nxpk= 10, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 789, 790, 868, 869, 870,
 &end
#
#    0 AMB  10-2:278     55 THR  HN          5.50    (#    278:10  Single Ambig)
 &rst
  ixpk= 278, nxpk= 10, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 831, 832, 833, 835,
 &end
#
#   99 ILE  HN           98 VAL  HN          5.50    (#    279:10  Unique         4.32, 4.40 A)
 &rst
  ixpk= 279, nxpk= 10, iat=1507,1491, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 THR  HN           98 VAL  HN          4.50    (#    280:10  Unique         2.89, 3.06 A)
 &rst
  ixpk= 280, nxpk= 10, iat=1610,1491, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   98 VAL  HA           98 VAL  HN          4.50    (#    281:10  Unique         2.98, 2.99 A)
 &rst
  ixpk= 281, nxpk= 10, iat=1493,1491, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 VAL  HA           98 VAL  HN          2.80    (#    282:10  Unique         2.20, 2.22 A)
 &rst
  ixpk= 282, nxpk= 10, iat=1477,1491, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   98 VAL  HB           98 VAL  HN          3.50    (#    283:10  Unique         2.72, 2.78 A)
 &rst
  ixpk= 283, nxpk= 10, iat=1495,1491, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   97 VAL  MGX          98 VAL  HN          3.50    (#    284:10  Unique         2.72, 4.14 A)
 &rst
  ixpk= 284, nxpk= 10, iat=  -1,1491, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   99 ILE  QD1          98 VAL  HN          4.50    (#    285:10  Unique         3.78, 4.96 A)
 &rst
  ixpk= 285, nxpk= 10, iat=  -1,1491, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1520,1521,1522,
 &end
#
#   97 VAL  MGY          98 VAL  HN          3.50    (#    286:10  Unique         2.72, 4.14 A)
 &rst
  ixpk= 286, nxpk= 10, iat=  -1,1491, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   65 GLN  HA           66 GLU  HN          3.50    (#    287:10  Unique         2.30, 3.33 A)
 &rst
  ixpk= 287, nxpk= 10, iat= 997,1012, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 GLU  HA           66 GLU  HN          3.50    (#    288:10  Unique         2.24, 2.83 A)
 &rst
  ixpk= 288, nxpk= 10, iat=1014,1012, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:289     66 GLU  HN          4.50    (#    289:10  Single Ambig)
 &rst
  ixpk= 289, nxpk= 10, iat=  -1,1012, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1019,1020,1019,1020,
 &end
#
#    0 AMB  10-2:290     66 GLU  HN          3.50    (#    290:10  Single Ambig)
 &rst
  ixpk= 290, nxpk= 10, iat=  -1,1012, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 999,1000,1016,1017,
 &end
#
#    0 AMB  10-2:291     66 GLU  HN          3.50    (#    291:10  Single Ambig)
 &rst
  ixpk= 291, nxpk= 10, iat=  -1,1012, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 999,1000,1016,1017,
 &end
#
#   66 GLU  HA           67 ASP  HN          3.50    (#    292:10  Unique         2.13, 3.29 A)
 &rst
  ixpk= 292, nxpk= 10, iat=1014,1027, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  132 LEU  HA          133 ASP  HN          2.80    (#    293:10  Unique         2.13, 2.29 A)
 &rst
  ixpk= 293, nxpk= 10, iat=1982,1999, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   67 ASP  HA           67 ASP  HN          3.50    (#    294:10  Unique         2.23, 2.85 A)
 &rst
  ixpk= 294, nxpk= 10, iat=1029,1027, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   67 ASP  HB+          67 ASP  HN          3.50    (#    295:10  Unique         2.37, 2.91 A)
 &rst
  ixpk= 295, nxpk= 10, iat=  -1,1027, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1031,1032,
 &end
#
#    0 AMB  10-2:296     67 ASP  HN          4.50    (#    296:10  Single Ambig)
 &rst
  ixpk= 296, nxpk= 10, iat=  -1,1027, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1019,1020,1019,1020,
 &end
#
#   66 GLU  HB-          67 ASP  HN          4.50    (#    297:10  Unique         1.97, 3.39 A)
 &rst
  ixpk= 297, nxpk= 10, iat=  -1,1027, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1016,1017,
 &end
#
#   66 GLU  HB+          67 ASP  HN          4.50    (#    298:10  Unique         1.97, 3.39 A)
 &rst
  ixpk= 298, nxpk= 10, iat=  -1,1027, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1016,1017,
 &end
#
#  133 ASP  HB+         133 ASP  HN          2.80    (#    299:10  Unique         2.33, 2.56 A)
 &rst
  ixpk= 299, nxpk= 10, iat=  -1,1999, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2003,2004,
 &end
#
#    0 AMB  10-2:300    133 ASP  HN          4.50    (#    300:10  Single Ambig)
 &rst
  ixpk= 300, nxpk= 10, iat=  -1,1999, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1890,2015,2016,
 &end
#
#  132 LEU  HB-         133 ASP  HN          3.50    (#    301:10  Unique         2.28, 3.21 A)
 &rst
  ixpk= 301, nxpk= 10, iat=  -1,1999, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1984,1985,
 &end
#
#  132 LEU  HB+         133 ASP  HN          2.80    (#    302:10  Unique         2.28, 3.21 A)
 &rst
  ixpk= 302, nxpk= 10, iat=  -1,1999, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1984,1985,
 &end
#
#  132 LEU  MDX         133 ASP  HN          4.50    (#    303:10  Unique         3.36, 5.05 A)
 &rst
  ixpk= 303, nxpk= 10, iat=  -1,1999, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#  125 VAL  MGY         133 ASP  HN          4.50    (#    304:10  Unique         4.77, 5.68 A)
 &rst
  ixpk= 304, nxpk= 10, iat=  -1,1999, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#    0 AMB  10-2:305     68 ALA  HN          3.50    (#    305:10  Single Ambig)
 &rst
  ixpk= 305, nxpk= 10, iat=  -1,1039, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 997,1029,
 &end
#
#   68 ALA  HA           68 ALA  HN          3.50    (#    306:10  Unique         2.88, 2.94 A)
 &rst
  ixpk= 306, nxpk= 10, iat=1041,1039, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   67 ASP  HB-          68 ALA  HN          4.50    (#    307:10  Unique         2.56, 3.68 A)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1,1039, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1031,1032,
 &end
#
#   67 ASP  HB+          68 ALA  HN          4.50    (#    308:10  Unique         2.56, 3.68 A)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1,1039, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1031,1032,
 &end
#
#   68 ALA  MB           68 ALA  HN          3.50    (#    309:10  Unique         2.39, 2.98 A)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1,1039, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1043,1044,1045,
 &end
#
#   70 ASP  HA           71 GLU  HN          3.50    (#    310:10  Unique         2.14, 3.01 A)
 &rst
  ixpk= 310, nxpk= 10, iat=1061,1071, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   70 ASP  HB-          71 GLU  HN          4.50    (#    311:10  Unique         2.18, 3.84 A)
 &rst
  ixpk= 311, nxpk= 10, iat=  -1,1071, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1063,1064,
 &end
#
#   70 ASP  HB+          71 GLU  HN          4.50    (#    312:10  Unique         2.18, 3.84 A)
 &rst
  ixpk= 312, nxpk= 10, iat=  -1,1071, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1063,1064,
 &end
#
#   65 GLN  HG-          71 GLU  HN          4.50    (#    313:10  Unique         3.10, 4.68 A)
 &rst
  ixpk= 313, nxpk= 10, iat=  -1,1071, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1002,1003,
 &end
#
#    0 AMB  10-2:315     71 GLU  HN          3.50    (#    315:10  Single Ambig)
 &rst
  ixpk= 315, nxpk= 10, iat=  -1,1071, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1075,1076, 999,1000,
 &end
#
#   87 PHE  HD           88 LYS  HN          4.50    (#    317:10  Unique         3.38, 5.03 A)
 &rst
  ixpk= 317, nxpk= 10, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1330,1338,
 &end
#
#   88 LYS  HA           88 LYS  HN          3.50    (#    318:10  Unique         2.36, 2.80 A)
 &rst
  ixpk= 318, nxpk= 10, iat=1344,1342, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   87 PHE  HA           88 LYS  HN          3.50    (#    319:10  Unique         2.04, 2.18 A)
 &rst
  ixpk= 319, nxpk= 10, iat=1324,1342, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   87 PHE  HB-          88 LYS  HN          3.50    (#    320:10  Unique         2.60, 3.52 A)
 &rst
  ixpk= 320, nxpk= 10, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1326,1327,
 &end
#
#   87 PHE  HB+          88 LYS  HN          3.50    (#    321:10  Unique         2.60, 3.52 A)
 &rst
  ixpk= 321, nxpk= 10, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1326,1327,
 &end
#
#   88 LYS  HB-          88 LYS  HN          3.50    (#    322:10  Unique         2.36, 3.11 A)
 &rst
  ixpk= 322, nxpk= 10, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1346,1347,
 &end
#
#    0 AMB  10-2:323     88 LYS  HN          3.50    (#    323:10  Single Ambig)
 &rst
  ixpk= 323, nxpk= 10, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1352,1353,1346,1347,
 &end
#
#   88 LYS  HG-          88 LYS  HN          4.50    (#    324:10  Unique         1.93, 3.09 A)
 &rst
  ixpk= 324, nxpk= 10, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1349,1350,
 &end
#
#   72 SER  HN           73 GLN  HN          4.50    (#    325:10  Unique         1.91, 2.84 A)
 &rst
  ixpk= 325, nxpk= 10, iat=1086,1097, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   72 SER  HA           73 GLN  HN          3.50    (#    326:10  Unique         2.68, 3.30 A)
 &rst
  ixpk= 326, nxpk= 10, iat=1088,1097, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   73 GLN  HA           73 GLN  HN          4.50    (#    327:10  Unique         2.80, 2.88 A)
 &rst
  ixpk= 327, nxpk= 10, iat=1099,1097, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   72 SER  HB+          73 GLN  HN          5.50    (#    328:10  Unique         2.93, 4.22 A)
 &rst
  ixpk= 328, nxpk= 10, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1090,1091,
 &end
#
#    0 AMB  10-2:329     73 GLN  HN          4.50    (#    329:10  Single Ambig)
 &rst
  ixpk= 329, nxpk= 10, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1104,1105,1104,1105,
 &end
#
#   73 GLN  HB+          73 GLN  HN          4.50    (#    330:10  Unique         2.43, 3.33 A)
 &rst
  ixpk= 330, nxpk= 10, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1101,1102,
 &end
#
#   73 GLN  HB-          73 GLN  HN          4.50    (#    331:10  Unique         2.43, 3.33 A)
 &rst
  ixpk= 331, nxpk= 10, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1101,1102,
 &end
#
#   46 ALA  HA           74 ASN  HN          5.50    (#    332:10  Unique         2.86, 4.36 A)
 &rst
  ixpk= 332, nxpk= 10, iat= 674,1114, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:333     74 ASN  HN          6.50    (#    333:10  Single Ambig)
 &rst
  ixpk= 333, nxpk= 10, iat=  -1,1114, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1088,1073,
 &end
#
#   73 GLN  HA           74 ASN  HN          2.80    (#    334:10  Unique         2.09, 2.21 A)
 &rst
  ixpk= 334, nxpk= 10, iat=1099,1114, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   73 GLN  HG-          74 ASN  HN          4.50    (#    335:10  Unique         3.44, 4.51 A)
 &rst
  ixpk= 335, nxpk= 10, iat=  -1,1114, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1104,1105,
 &end
#
#   73 GLN  HB+          74 ASN  HN          5.50    (#    336:10  Unique         2.36, 3.44 A)
 &rst
  ixpk= 336, nxpk= 10, iat=  -1,1114, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1101,1102,
 &end
#
#   73 GLN  HB-          74 ASN  HN          4.50    (#    338:10  Unique         2.36, 3.44 A)
 &rst
  ixpk= 338, nxpk= 10, iat=  -1,1114, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1101,1102,
 &end
#
#    0 AMB  10-2:339     74 ASN  HN          3.50    (#    339:10  Single Ambig)
 &rst
  ixpk= 339, nxpk= 10, iat=  -1,1114, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1118,1119,1118,1119,
 &end
#
#   46 ALA  MB           74 ASN  HN          3.50    (#    340:10  Unique         2.63, 4.50 A)
 &rst
  ixpk= 340, nxpk= 10, iat=  -1,1114, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 676, 677, 678,
 &end
#
#   79 GLU  HN           78 GLU  HN          3.50    (#    341:10  Unique         1.78, 2.40 A)
 &rst
  ixpk= 341, nxpk= 10, iat=1191,1176, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 ASP  HA           78 GLU  HN          3.50    (#    342:10  Unique         2.20, 2.31 A)
 &rst
  ixpk= 342, nxpk= 10, iat=1166,1176, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   78 GLU  HA           78 GLU  HN          3.50    (#    343:10  Unique         2.81, 2.93 A)
 &rst
  ixpk= 343, nxpk= 10, iat=1178,1176, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   78 GLU  HG-          78 GLU  HN          3.50    (#    345:10  Unique         2.00, 2.84 A)
 &rst
  ixpk= 345, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1183,1184,
 &end
#
#   78 GLU  HG+          78 GLU  HN          3.50    (#    346:10  Unique         2.00, 2.84 A)
 &rst
  ixpk= 346, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1183,1184,
 &end
#
#    0 AMB  10-2:347     78 GLU  HN          3.50    (#    347:10  Single Ambig)
 &rst
  ixpk= 347, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1180,1181,1180,1181,
 &end
#
#   12 ARG  HG+          78 GLU  HN          5.50    (#    348:10  Unique         2.59, 5.64 A)
 &rst
  ixpk= 348, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 171, 172,
 &end
#
#    0 AMB  10-2:350     78 GLU  HN          6.50    (#    350:10  Single Ambig)
 &rst
  ixpk= 350, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 8.99, r4= 9.49,
 igr1=1213, 116, 117, 118, 120, 121, 122,
 &end
#
#   78 GLU  HN           79 GLU  HN          3.50    (#    351:10  Unique         1.78, 2.40 A)
 &rst
  ixpk= 351, nxpk= 10, iat=1176,1191, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 LEU  HN           79 GLU  HN          3.50    (#    352:10  Unique         1.94, 2.50 A)
 &rst
  ixpk= 352, nxpk= 10, iat=1206,1191, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 ASP  HA           79 GLU  HN          4.50    (#    353:10  Unique         3.76, 4.10 A)
 &rst
  ixpk= 353, nxpk= 10, iat=1166,1191, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:354     79 GLU  HN          3.50    (#    354:10  Single Ambig)
 &rst
  ixpk= 354, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1193,1178,
 &end
#
#   77 ASP  HB+          79 GLU  HN          4.50    (#    355:10  Unique         2.48, 3.76 A)
 &rst
  ixpk= 355, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1168,1169,
 &end
#
#    0 AMB  10-2:356     79 GLU  HN          3.50    (#    356:10  Single Ambig)
 &rst
  ixpk= 356, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1195,1196,1198,1199,
 &end
#
#    0 AMB  10-2:357     79 GLU  HN          4.50    (#    357:10  Single Ambig)
 &rst
  ixpk= 357, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1180,1181,1180,1181,
 &end
#
#    0 AMB  10-2:358     79 GLU  HN          4.50    (#    358:10  Single Ambig)
 &rst
  ixpk= 358, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1210,1211, 168, 169,
 &end
#
#  115 ALA  MB           79 GLU  HN          5.50    (#    360:10  Unique         4.86, 5.60 A)
 &rst
  ixpk= 360, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1752,1753,1754,
 &end
#
#    0 AMB  10-2:361     79 GLU  HN          4.50    (#    361:10  Single Ambig)
 &rst
  ixpk= 361, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1=1213, 116, 117, 118, 120, 121, 122,
 &end
#
#   80 LEU  MDX          79 GLU  HN          5.50    (#    362:10  Unique         2.60, 5.64 A)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#  115 ALA  HN           80 LEU  HN          5.50    (#    363:10  Unique         4.10, 4.35 A)
 &rst
  ixpk= 363, nxpk= 10, iat=1748,1206, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 GLU  HN           80 LEU  HN          3.50    (#    364:10  Unique         1.94, 2.50 A)
 &rst
  ixpk= 364, nxpk= 10, iat=1191,1206, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 LEU  HA           80 LEU  HN          3.50    (#    365:10  Unique         2.98, 2.99 A)
 &rst
  ixpk= 365, nxpk= 10, iat=1208,1206, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 ASP  HB+          80 LEU  HN          3.50    (#    367:10  Unique         2.64, 4.03 A)
 &rst
  ixpk= 367, nxpk= 10, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1168,1169,
 &end
#
#    0 AMB  10-2:368     80 LEU  HN          4.50    (#    368:10  Single Ambig)
 &rst
  ixpk= 368, nxpk= 10, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1195,1196,1198,1199,
 &end
#
#   80 LEU  HB-          80 LEU  HN          3.50    (#    369:10  Unique         2.29, 3.15 A)
 &rst
  ixpk= 369, nxpk= 10, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1210,1211,
 &end
#
#   79 GLU  HB+          80 LEU  HN          4.50    (#    370:10  Unique         3.66, 4.36 A)
 &rst
  ixpk= 370, nxpk= 10, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1195,1196,
 &end
#
#   80 LEU  HB+          80 LEU  HN          3.50    (#    372:10  Unique         2.29, 3.15 A)
 &rst
  ixpk= 372, nxpk= 10, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1210,1211,
 &end
#
#   80 LEU  HG           80 LEU  HN          5.50    (#    373:10  Unique         2.75, 3.48 A)
 &rst
  ixpk= 373, nxpk= 10, iat=1213,1206, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   80 LEU  MDX          80 LEU  HN          4.50    (#    374:10  Unique         3.07, 4.83 A)
 &rst
  ixpk= 374, nxpk= 10, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#  113 ALA  HN           81 SER  HN          3.50    (#    375:10  Unique         2.63, 2.89 A)
 &rst
  ixpk= 375, nxpk= 10, iat=1724,1225, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 LEU  HA           81 SER  HN          2.80    (#    376:10  Unique         2.06, 2.15 A)
 &rst
  ixpk= 376, nxpk= 10, iat=1208,1225, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:377     81 SER  HN          4.50    (#    377:10  Single Ambig)
 &rst
  ixpk= 377, nxpk= 10, iat=  -1,1225, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1709,1726,
 &end
#
#   81 SER  HA           81 SER  HN          3.50    (#    378:10  Unique         2.97, 2.99 A)
 &rst
  ixpk= 378, nxpk= 10, iat=1227,1225, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  114 ASN  HA           81 SER  HN          4.50    (#    379:10  Unique         4.10, 4.25 A)
 &rst
  ixpk= 379, nxpk= 10, iat=1736,1225, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  115 ALA  HA           81 SER  HN          4.50    (#    380:10  Unique         3.90, 4.31 A)
 &rst
  ixpk= 380, nxpk= 10, iat=1750,1225, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:381     81 SER  HN          3.50    (#    381:10  Single Ambig)
 &rst
  ixpk= 381, nxpk= 10, iat=  -1,1225, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1229,1230,1229,1230,
 &end
#
#   80 LEU  HB-          81 SER  HN          3.50    (#    382:10  Unique         2.37, 3.35 A)
 &rst
  ixpk= 382, nxpk= 10, iat=  -1,1225, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1210,1211,
 &end
#
#   80 LEU  HB+          81 SER  HN          3.50    (#    384:10  Unique         2.37, 3.35 A)
 &rst
  ixpk= 384, nxpk= 10, iat=  -1,1225, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1210,1211,
 &end
#
#  113 ALA  MB           81 SER  HN          4.50    (#    385:10  Unique         3.34, 4.51 A)
 &rst
  ixpk= 385, nxpk= 10, iat=  -1,1225, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1728,1729,1730,
 &end
#
#   80 LEU  MDX          81 SER  HN          3.50    (#    386:10  Unique         2.74, 4.79 A)
 &rst
  ixpk= 386, nxpk= 10, iat=  -1,1225, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#   82 ILE  QD1          81 SER  HN          4.50    (#    388:10  Unique         3.49, 4.37 A)
 &rst
  ixpk= 388, nxpk= 10, iat=  -1,1225, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1249,1250,1251,
 &end
#
#   83 HIS  HB+          84 LEU  HN          4.50    (#    393:10  Unique         2.68, 3.74 A)
 &rst
  ixpk= 393, nxpk= 10, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1259,1260,
 &end
#
#   84 LEU  HB-          84 LEU  HN          3.50    (#    394:10  Unique         2.23, 2.92 A)
 &rst
  ixpk= 394, nxpk= 10, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1276,1277,
 &end
#
#   84 LEU  HG           84 LEU  HN          4.50    (#    395:10  Unique         3.14, 4.32 A)
 &rst
  ixpk= 395, nxpk= 10, iat=1279,1272, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 LEU  HB+          84 LEU  HN          3.50    (#    396:10  Unique         2.23, 2.92 A)
 &rst
  ixpk= 396, nxpk= 10, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1276,1277,
 &end
#
#   84 LEU  MDY          84 LEU  HN          4.50    (#    397:10  Unique         2.64, 5.13 A)
 &rst
  ixpk= 397, nxpk= 10, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  MDX          84 LEU  HN          4.50    (#    398:10  Unique         2.64, 5.13 A)
 &rst
  ixpk= 398, nxpk= 10, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1281,1282,1283,1285,1286,1287,
 &end
#
#   82 ILE  QG2          84 LEU  HN          4.50    (#    399:10  Unique         3.33, 5.02 A)
 &rst
  ixpk= 399, nxpk= 10, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1242,1243,1244,
 &end
#
#   47 TRP  HA           48 ARG  HN          3.50    (#    400:10  Unique         2.22, 2.34 A)
 &rst
  ixpk= 400, nxpk= 10, iat= 684, 706, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 TRP  HB+          48 ARG  HN          3.50    (#    402:10  Unique         2.52, 3.39 A)
 &rst
  ixpk= 402, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 686, 687,
 &end
#
#    0 AMB  10-2:403     48 ARG  HN          5.50    (#    403:10  Single Ambig)
 &rst
  ixpk= 403, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1101,1102, 969, 970,
 &end
#
#    0 AMB  10-2:405     48 ARG  HN          6.50    (#    405:10  Single Ambig)
 &rst
  ixpk= 405, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1451,1452, 983, 406, 407, 408,
 &end
#
#   40 ILE  QG2          48 ARG  HN          4.50    (#    406:10  Unique         2.88, 3.78 A)
 &rst
  ixpk= 406, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 588, 589, 590,
 &end
#
#   90 ASP  HB+          90 ASP  HN          5.50    (#    407:10  Unique         2.57, 3.13 A)
 &rst
  ixpk= 407, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1382,1383,
 &end
#
#    0 AMB  10-2:408     90 ASP  HN          4.50    (#    408:10  Single Ambig)
 &rst
  ixpk= 408, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1371,1372,1352,1353,
 &end
#
#   89 PRO  HB-          90 ASP  HN          4.50    (#    409:10  Unique         3.47, 4.29 A)
 &rst
  ixpk= 409, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1371,1372,
 &end
#
#   92 SER  HN           91 ASP  HN          4.50    (#    410:10  Unique         3.56, 4.02 A)
 &rst
  ixpk= 410, nxpk= 10, iat=1402,1390, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   91 ASP  HA           91 ASP  HN          3.50    (#    411:10  Unique         2.87, 2.91 A)
 &rst
  ixpk= 411, nxpk= 10, iat=1392,1390, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   90 ASP  HB-          91 ASP  HN          4.50    (#    413:10  Unique         2.46, 3.89 A)
 &rst
  ixpk= 413, nxpk= 10, iat=  -1,1390, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1382,1383,
 &end
#
#   90 ASP  HB+          91 ASP  HN          4.50    (#    414:10  Unique         2.46, 3.89 A)
 &rst
  ixpk= 414, nxpk= 10, iat=  -1,1390, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1382,1383,
 &end
#
#   91 ASP  HB+          91 ASP  HN          3.50    (#    415:10  Unique         2.31, 2.61 A)
 &rst
  ixpk= 415, nxpk= 10, iat=  -1,1390, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1394,1395,
 &end
#
#   91 ASP  HN           92 SER  HN          4.50    (#    416:10  Unique         3.56, 4.02 A)
 &rst
  ixpk= 416, nxpk= 10, iat=1390,1402, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   91 ASP  HA           92 SER  HN          3.50    (#    417:10  Unique         2.12, 2.23 A)
 &rst
  ixpk= 417, nxpk= 10, iat=1392,1402, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   92 SER  HA           92 SER  HN          3.50    (#    418:10  Unique         2.86, 2.94 A)
 &rst
  ixpk= 418, nxpk= 10, iat=1404,1402, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:419      0 AMB  10-1:419    2.80    (#    419:10  Double Ambig)
 &rst
  ixpk= 419, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1811,1406,1407,
 igr2=1815,1402,
 &end
#
#   92 SER  HB-          92 SER  HN          3.50    (#    420:10  Unique         2.42, 2.76 A)
 &rst
  ixpk= 420, nxpk= 10, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1406,1407,
 &end
#
#   90 ASP  HB-          92 SER  HN          4.50    (#    421:10  Unique         3.69, 5.20 A)
 &rst
  ixpk= 421, nxpk= 10, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1382,1383,
 &end
#
#   90 ASP  HB+          92 SER  HN          4.50    (#    422:10  Unique         3.69, 5.20 A)
 &rst
  ixpk= 422, nxpk= 10, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1382,1383,
 &end
#
#   97 VAL  HN           96 GLN  HN          3.50    (#    423:10  Unique         2.15, 2.32 A)
 &rst
  ixpk= 423, nxpk= 10, iat=1475,1458, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 HIS  HD2          96 GLN  HN          4.50    (#    424:10  Unique         4.22, 4.50 A)
 &rst
  ixpk= 424, nxpk= 10, iat= 614,1458, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   41 HIS  HA           96 GLN  HN          4.50    (#    425:10  Unique         1.88, 2.23 A)
 &rst
  ixpk= 425, nxpk= 10, iat= 603,1458, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   95 PRO  HA           96 GLN  HN          3.50    (#    426:10  Unique         2.15, 2.28 A)
 &rst
  ixpk= 426, nxpk= 10, iat=1454,1458, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   96 GLN  HA           96 GLN  HN          3.50    (#    427:10  Unique         2.94, 2.98 A)
 &rst
  ixpk= 427, nxpk= 10, iat=1460,1458, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:428     96 GLN  HN          4.50    (#    428:10  Single Ambig)
 &rst
  ixpk= 428, nxpk= 10, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1465,1466,1465,1466,
 &end
#
#   95 PRO  HD-          96 GLN  HN          5.50    (#    429:10  Unique         5.47, 5.61 A)
 &rst
  ixpk= 429, nxpk= 10, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1445,1446,
 &end
#
#   95 PRO  HB+          96 GLN  HN          4.50    (#    430:10  Unique         2.85, 3.45 A)
 &rst
  ixpk= 430, nxpk= 10, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1451,1452,
 &end
#
#   95 PRO  HB-          96 GLN  HN          4.50    (#    431:10  Unique         2.85, 3.45 A)
 &rst
  ixpk= 431, nxpk= 10, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1451,1452,
 &end
#
#   96 GLN  HB-          96 GLN  HN          4.50    (#    432:10  Unique         2.22, 3.01 A)
 &rst
  ixpk= 432, nxpk= 10, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1462,1463,
 &end
#
#   96 GLN  HB+          96 GLN  HN          4.50    (#    433:10  Unique         2.22, 3.01 A)
 &rst
  ixpk= 433, nxpk= 10, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1462,1463,
 &end
#
#   96 GLN  HN           97 VAL  HN          3.50    (#    434:10  Unique         2.15, 2.32 A)
 &rst
  ixpk= 434, nxpk= 10, iat=1458,1475, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   40 ILE  HN           97 VAL  HN          3.50    (#    435:10  Unique         2.93, 3.13 A)
 &rst
  ixpk= 435, nxpk= 10, iat= 582,1475, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   97 VAL  HA           97 VAL  HN          3.50    (#    436:10  Unique         2.96, 2.99 A)
 &rst
  ixpk= 436, nxpk= 10, iat=1477,1475, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   95 PRO  HA           97 VAL  HN          4.50    (#    437:10  Unique         3.79, 4.09 A)
 &rst
  ixpk= 437, nxpk= 10, iat=1454,1475, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   96 GLN  HA           97 VAL  HN          4.50    (#    438:10  Unique         3.45, 3.56 A)
 &rst
  ixpk= 438, nxpk= 10, iat=1460,1475, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 VAL  HB           97 VAL  HN          3.50    (#    439:10  Unique         2.25, 2.41 A)
 &rst
  ixpk= 439, nxpk= 10, iat=1479,1475, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   95 PRO  HB+          97 VAL  HN          3.50    (#    440:10  Unique         2.45, 3.83 A)
 &rst
  ixpk= 440, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1451,1452,
 &end
#
#   97 VAL  MGX          97 VAL  HN          3.50    (#    441:10  Unique         2.46, 4.04 A)
 &rst
  ixpk= 441, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   96 GLN  HB-          97 VAL  HN          3.50    (#    442:10  Unique         2.47, 3.16 A)
 &rst
  ixpk= 442, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1462,1463,
 &end
#
#    0 AMB  10-2:443     97 VAL  HN          3.50    (#    443:10  Single Ambig)
 &rst
  ixpk= 443, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1481,1482,1483,1485,1486,1487,1462,1463,
 &end
#
#   40 ILE  QG2          97 VAL  HN          5.50    (#    444:10  Unique         4.75, 5.63 A)
 &rst
  ixpk= 444, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 588, 589, 590,
 &end
#
#  102 ASP  HN          101 ALA  HN          3.50    (#    445:10  Unique         2.68, 2.79 A)
 &rst
  ixpk= 445, nxpk= 10, iat=1555,1545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  100 LEU  HA          101 ALA  HN          2.80    (#    446:10  Unique         2.26, 2.34 A)
 &rst
  ixpk= 446, nxpk= 10, iat=1528,1545, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  101 ALA  HA          101 ALA  HN          3.50    (#    447:10  Unique         2.81, 2.86 A)
 &rst
  ixpk= 447, nxpk= 10, iat=1547,1545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  100 LEU  HB-         101 ALA  HN          3.50    (#    448:10  Unique         2.28, 3.01 A)
 &rst
  ixpk= 448, nxpk= 10, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1530,1531,
 &end
#
#  100 LEU  HB+         101 ALA  HN          3.50    (#    449:10  Unique         2.28, 3.01 A)
 &rst
  ixpk= 449, nxpk= 10, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1530,1531,
 &end
#
#  101 ALA  MB          101 ALA  HN          2.80    (#    450:10  Unique         2.40, 2.84 A)
 &rst
  ixpk= 450, nxpk= 10, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1549,1550,1551,
 &end
#
#  100 LEU  MDX         101 ALA  HN          3.50    (#    451:10  Unique         3.67, 5.04 A)
 &rst
  ixpk= 451, nxpk= 10, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1535,1536,1537,1539,1540,1541,
 &end
#
#  103 GLY  HN          102 ASP  HN          2.80    (#    452:10  Unique         2.58, 2.67 A)
 &rst
  ixpk= 452, nxpk= 10, iat=1567,1555, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  102 ASP  HA          102 ASP  HN          3.50    (#    453:10  Unique         2.92, 2.95 A)
 &rst
  ixpk= 453, nxpk= 10, iat=1557,1555, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  101 ALA  HA          102 ASP  HN          3.50    (#    455:10  Unique         3.44, 3.49 A)
 &rst
  ixpk= 455, nxpk= 10, iat=1547,1555, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  102 ASP  HB-         102 ASP  HN          4.50    (#    457:10  Unique         2.25, 2.84 A)
 &rst
  ixpk= 457, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1559,1560,
 &end
#
#  102 ASP  HB+         102 ASP  HN          3.50    (#    458:10  Unique         2.25, 2.84 A)
 &rst
  ixpk= 458, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1559,1560,
 &end
#
#  100 LEU  HB-         102 ASP  HN          3.50    (#    459:10  Unique         2.67, 3.06 A)
 &rst
  ixpk= 459, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1530,1531,
 &end
#
#  100 LEU  HB+         102 ASP  HN          3.50    (#    460:10  Unique         2.67, 3.06 A)
 &rst
  ixpk= 460, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1530,1531,
 &end
#
#  101 ALA  MB          102 ASP  HN          4.50    (#    461:10  Unique         2.95, 3.77 A)
 &rst
  ixpk= 461, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1549,1550,1551,
 &end
#
#   99 ILE  QG2         102 ASP  HN          5.50    (#    463:10  Unique         5.56, 6.50 A)
 &rst
  ixpk= 463, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1513,1514,1515,
 &end
#
#  104 GLN  HN          103 GLY  HN          3.50    (#    464:10  Unique         2.42, 2.63 A)
 &rst
  ixpk= 464, nxpk= 10, iat=1574,1567, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  102 ASP  HN          103 GLY  HN          3.50    (#    465:10  Unique         2.58, 2.67 A)
 &rst
  ixpk= 465, nxpk= 10, iat=1555,1567, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  102 ASP  HA          103 GLY  HN          3.50    (#    466:10  Unique         3.05, 3.21 A)
 &rst
  ixpk= 466, nxpk= 10, iat=1557,1567, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  101 ALA  HA          103 GLY  HN          4.50    (#    468:10  Unique         3.55, 3.84 A)
 &rst
  ixpk= 468, nxpk= 10, iat=1547,1567, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  102 ASP  HB-         103 GLY  HN          5.50    (#    470:10  Unique         3.48, 4.28 A)
 &rst
  ixpk= 470, nxpk= 10, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1559,1560,
 &end
#
#    0 AMB  10-2:471    103 GLY  HN          4.50    (#    471:10  Single Ambig)
 &rst
  ixpk= 471, nxpk= 10, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1559,1560,1581,1582,
 &end
#
#  100 LEU  HB-         103 GLY  HN          4.50    (#    472:10  Unique         3.43, 4.17 A)
 &rst
  ixpk= 472, nxpk= 10, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1530,1531,
 &end
#
#  100 LEU  HB+         103 GLY  HN          5.50    (#    473:10  Unique         3.43, 4.17 A)
 &rst
  ixpk= 473, nxpk= 10, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1530,1531,
 &end
#
#    0 AMB  10-2:474    103 GLY  HN          4.50    (#    474:10  Single Ambig)
 &rst
  ixpk= 474, nxpk= 10, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1549,1550,1551, 483, 484, 485,
 &end
#
#    0 AMB  10-2:475    103 GLY  HN          4.50    (#    475:10  Single Ambig)
 &rst
  ixpk= 475, nxpk= 10, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1604,1605,1606,1533,
 &end
#
#   99 ILE  QG2         103 GLY  HN          5.50    (#    476:10  Unique         4.07, 4.85 A)
 &rst
  ixpk= 476, nxpk= 10, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1513,1514,1515,
 &end
#
#  105 ILE  HN          104 GLN  HN          4.50    (#    477:10  Unique         4.52, 4.55 A)
 &rst
  ixpk= 477, nxpk= 10, iat=1591,1574, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  103 GLY  HN          104 GLN  HN          3.50    (#    478:10  Unique         2.42, 2.63 A)
 &rst
  ixpk= 478, nxpk= 10, iat=1567,1574, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:481      0 AMB  10-1:481    3.50    (#    481:10  Double Ambig)
 &rst
  ixpk= 481, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1576, 855,
 igr2=1574, 874,
 &end
#
#  104 GLN  HG+         104 GLN  HN          3.50    (#    483:10  Unique         2.01, 3.12 A)
 &rst
  ixpk= 483, nxpk= 10, iat=  -1,1574, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1581,1582,
 &end
#
#  104 GLN  HB-         104 GLN  HN          3.50    (#    484:10  Unique         2.38, 3.08 A)
 &rst
  ixpk= 484, nxpk= 10, iat=  -1,1574, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1578,1579,
 &end
#
#    0 AMB  10-2:485     59 TRP  HN          4.50    (#    485:10  Single Ambig)
 &rst
  ixpk= 485, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 902, 903, 902, 903, 532, 533,
 &end
#
#  100 LEU  HB+         104 GLN  HN          3.50    (#    486:10  Unique         2.35, 3.31 A)
 &rst
  ixpk= 486, nxpk= 10, iat=  -1,1574, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1530,1531,
 &end
#
#    0 AMB  10-2:487    104 GLN  HN          3.50    (#    487:10  Single Ambig)
 &rst
  ixpk= 487, nxpk= 10, iat=  -1,1574, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1533,1604,1605,1606,
 &end
#
#    0 AMB  10-2:488     59 TRP  HN          5.50    (#    488:10  Single Ambig)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 831, 832, 833, 835,
 &end
#
#   58 ALA  MB           59 TRP  HN          3.50    (#    489:10  Unique         2.09, 3.48 A)
 &rst
  ixpk= 489, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 868, 869, 870,
 &end
#
#    0 AMB  10-2:490      0 AMB  10-1:490    4.50    (#    490:10  Double Ambig)
 &rst
  ixpk= 490, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 878, 879,1559,1560,
 igr2= 874,1574,
 &end
#
#   98 VAL  HN          106 THR  HN          4.50    (#    492:10  Unique         2.89, 3.06 A)
 &rst
  ixpk= 492, nxpk= 10, iat=1491,1610, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  106 THR  HA          106 THR  HN          3.50    (#    493:10  Unique         2.77, 2.83 A)
 &rst
  ixpk= 493, nxpk= 10, iat=1612,1610, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  106 THR  HB          106 THR  HN          3.50    (#    494:10  Unique         2.31, 3.37 A)
 &rst
  ixpk= 494, nxpk= 10, iat=1614,1610, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  106 THR  MG2         106 THR  HN          3.50    (#    496:10  Unique         2.36, 3.41 A)
 &rst
  ixpk= 496, nxpk= 10, iat=  -1,1610, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1616,1617,1618,
 &end
#
#  105 ILE  HB          106 THR  HN          4.50    (#    497:10  Unique         3.55, 3.81 A)
 &rst
  ixpk= 497, nxpk= 10, iat=1595,1610, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:498    106 THR  HN          4.50    (#    498:10  Single Ambig)
 &rst
  ixpk= 498, nxpk= 10, iat=  -1,1610, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1481,1482,1483,1485,1486,1487,1604,1605,1606,1533,
      
 &end
#
#   97 VAL  MGY         106 THR  HN          5.50    (#    500:10  Unique         3.57, 5.66 A)
 &rst
  ixpk= 500, nxpk= 10, iat=  -1,1610, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#  108 PHE  HD          108 PHE  HN          4.50    (#    501:10  Unique         2.55, 3.92 A)
 &rst
  ixpk= 501, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1646,1654,
 &end
#
#  108 PHE  HA          108 PHE  HN          4.50    (#    502:10  Unique         2.86, 2.90 A)
 &rst
  ixpk= 502, nxpk= 10, iat=1640,1638, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:503    108 PHE  HN          4.50    (#    503:10  Single Ambig)
 &rst
  ixpk= 503, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1904,1660,
 &end
#
#  107 PRO  HA          108 PHE  HN          2.80    (#    504:10  Unique         2.14, 2.19 A)
 &rst
  ixpk= 504, nxpk= 10, iat=1634,1638, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  108 PHE  HB-         108 PHE  HN          4.50    (#    505:10  Unique         3.20, 3.72 A)
 &rst
  ixpk= 505, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1642,1643,
 &end
#
#  126 CYS  HB-         108 PHE  HN          4.50    (#    506:10  Unique         1.62, 2.58 A)
 &rst
  ixpk= 506, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1906,1907,
 &end
#
#  107 PRO  HG+         108 PHE  HN          5.50    (#    507:10  Unique         4.71, 5.43 A)
 &rst
  ixpk= 507, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1628,1629,
 &end
#
#  107 PRO  HB+         108 PHE  HN          4.50    (#    508:10  Unique         3.30, 3.85 A)
 &rst
  ixpk= 508, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1631,1632,
 &end
#
#  107 PRO  HB-         108 PHE  HN          4.50    (#    509:10  Unique         3.30, 3.85 A)
 &rst
  ixpk= 509, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1631,1632,
 &end
#
#    0 AMB  10-2:511    108 PHE  HN          5.50    (#    511:10  Single Ambig)
 &rst
  ixpk= 511, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1628,1629,2128,2129,
 &end
#
#  105 ILE  QG2         108 PHE  HN          6.50    (#    512:10  Unique         4.96, 6.52 A)
 &rst
  ixpk= 512, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1597,1598,1599,
 &end
#
#  125 VAL  MGX         108 PHE  HN          5.50    (#    513:10  Unique         4.48, 6.47 A)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#   85 GLN  HN          109 SER  HN          4.50    (#    514:10  Unique         2.80, 2.98 A)
 &rst
  ixpk= 514, nxpk= 10, iat=1291,1658, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  108 PHE  HD          109 SER  HN          3.50    (#    515:10  Unique         2.71, 4.29 A)
 &rst
  ixpk= 515, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1646,1654,
 &end
#
#  108 PHE  HA          109 SER  HN          3.50    (#    517:10  Unique         2.29, 2.39 A)
 &rst
  ixpk= 517, nxpk= 10, iat=1640,1658, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  109 SER  HA          109 SER  HN          3.50    (#    518:10  Unique         2.95, 2.97 A)
 &rst
  ixpk= 518, nxpk= 10, iat=1660,1658, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:519    109 SER  HN          3.50    (#    519:10  Single Ambig)
 &rst
  ixpk= 519, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1662,1663,1662,1663,
 &end
#
#  108 PHE  HB-         109 SER  HN          3.50    (#    520:10  Unique         2.35, 3.12 A)
 &rst
  ixpk= 520, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1642,1643,
 &end
#
#  108 PHE  HB+         109 SER  HN          3.50    (#    521:10  Unique         2.35, 3.12 A)
 &rst
  ixpk= 521, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1642,1643,
 &end
#
#    0 AMB  10-2:522    109 SER  HN          6.50    (#    522:10  Single Ambig)
 &rst
  ixpk= 522, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1298,1299,1298,1299,
 &end
#
#   85 GLN  HB-         109 SER  HN          6.50    (#    523:10  Unique         3.02, 4.28 A)
 &rst
  ixpk= 523, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1295,1296,
 &end
#
#   85 GLN  HB+         109 SER  HN          6.50    (#    524:10  Unique         3.02, 4.28 A)
 &rst
  ixpk= 524, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1295,1296,
 &end
#
#  125 VAL  MGY         109 SER  HN          6.50    (#    525:10  Unique         4.79, 6.51 A)
 &rst
  ixpk= 525, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#    0 AMB  10-2:526    109 SER  HN          6.50    (#    526:10  Single Ambig)
 &rst
  ixpk= 526, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1481,1482,1483,1485,1486,1487,1462,1463,
 &end
#
#  110 LEU  MDY         109 SER  HN          6.50    (#    527:10  Unique         7.09, 8.05 A)
 &rst
  ixpk= 527, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1678,1679,1680,1682,1683,1684,
 &end
#
#   84 LEU  MDX         109 SER  HN          5.50    (#    528:10  Unique         3.09, 5.36 A)
 &rst
  ixpk= 528, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1281,1282,1283,1285,1286,1287,
 &end
#
#  111 LEU  HA          111 LEU  HN          3.50    (#    529:10  Unique         2.94, 2.97 A)
 &rst
  ixpk= 529, nxpk= 10, iat=1690,1688, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 LEU  HA          111 LEU  HN          4.50    (#    531:10  Unique         3.12, 3.45 A)
 &rst
  ixpk= 531, nxpk= 10, iat=1274,1688, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   83 HIS  HB-         111 LEU  HN          4.50    (#    532:10  Unique         3.21, 4.16 A)
 &rst
  ixpk= 532, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1259,1260,
 &end
#
#   83 HIS  HB+         111 LEU  HN          4.50    (#    533:10  Unique         3.21, 4.16 A)
 &rst
  ixpk= 533, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1259,1260,
 &end
#
#  111 LEU  HB-         111 LEU  HN          3.50    (#    534:10  Unique         2.28, 2.69 A)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1692,1693,
 &end
#
#  111 LEU  HB+         111 LEU  HN          3.50    (#    535:10  Unique         2.28, 2.69 A)
 &rst
  ixpk= 535, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1692,1693,
 &end
#
#    0 AMB  10-2:536    111 LEU  HN          4.50    (#    536:10  Single Ambig)
 &rst
  ixpk= 536, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1673,1674,1695,
 &end
#
#  110 LEU  HG          111 LEU  HN          4.50    (#    537:10  Unique         3.57, 4.18 A)
 &rst
  ixpk= 537, nxpk= 10, iat=1676,1688, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  123 THR  MG2         111 LEU  HN          5.50    (#    538:10  Unique         3.87, 5.43 A)
 &rst
  ixpk= 538, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1859,1860,1861,
 &end
#
#  111 LEU  MDX         111 LEU  HN          4.50    (#    539:10  Unique         4.42, 5.30 A)
 &rst
  ixpk= 539, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1697,1698,1699,1701,1702,1703,
 &end
#
#  111 LEU  MDY         111 LEU  HN          4.50    (#    540:10  Unique         4.42, 5.30 A)
 &rst
  ixpk= 540, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1697,1698,1699,1701,1702,1703,
 &end
#
#    0 AMB  10-2:541    111 LEU  HN          4.50    (#    541:10  Single Ambig)
 &rst
  ixpk= 541, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 &end
#
#    0 AMB  10-2:542    111 LEU  HN          4.50    (#    542:10  Single Ambig)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1281,1282,1283,1285,1286,1287,1246,1247,
 &end
#
#   82 ILE  QG2         111 LEU  HN          4.50    (#    543:10  Unique         3.68, 5.25 A)
 &rst
  ixpk= 543, nxpk= 10, iat=  -1,1688, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1242,1243,1244,
 &end
#
#  122 LEU  HN          112 MET  HN          4.50    (#    544:10  Unique         2.94, 3.28 A)
 &rst
  ixpk= 544, nxpk= 10, iat=1834,1707, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  123 THR  HA          112 MET  HN          3.50    (#    545:10  Unique         2.92, 3.27 A)
 &rst
  ixpk= 545, nxpk= 10, iat=1855,1707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:546    112 MET  HN          2.80    (#    546:10  Single Ambig)
 &rst
  ixpk= 546, nxpk= 10, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1690,1709,
 &end
#
#  112 MET  HG+         112 MET  HN          3.50    (#    547:10  Unique         2.74, 3.40 A)
 &rst
  ixpk= 547, nxpk= 10, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1714,1715,
 &end
#
#  120 PRO  HB-         112 MET  HN          4.50    (#    548:10  Unique         4.29, 5.27 A)
 &rst
  ixpk= 548, nxpk= 10, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1808,1809,
 &end
#
#    0 AMB  10-2:549    112 MET  HN          3.50    (#    549:10  Single Ambig)
 &rst
  ixpk= 549, nxpk= 10, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1692,1693,1808,1809,2075,2076,2075,2076,
 &end
#
#    0 AMB  10-2:550    112 MET  HN          4.50    (#    550:10  Single Ambig)
 &rst
  ixpk= 550, nxpk= 10, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1838,1839,1841,
 &end
#
#  111 LEU  HG          112 MET  HN          3.50    (#    551:10  Unique         2.12, 2.57 A)
 &rst
  ixpk= 551, nxpk= 10, iat=1695,1707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  123 THR  MG2         112 MET  HN          4.50    (#    552:10  Unique         4.36, 5.60 A)
 &rst
  ixpk= 552, nxpk= 10, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1859,1860,1861,
 &end
#
#  111 LEU  MDX         112 MET  HN          3.50    (#    553:10  Unique         1.84, 4.28 A)
 &rst
  ixpk= 553, nxpk= 10, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1697,1698,1699,1701,1702,1703,
 &end
#
#    0 AMB  10-2:555    112 MET  HN          4.50    (#    555:10  Single Ambig)
 &rst
  ixpk= 555, nxpk= 10, iat=  -1,1707, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 &end
#
#   81 SER  HN          113 ALA  HN          3.50    (#    557:10  Unique         2.63, 2.89 A)
 &rst
  ixpk= 557, nxpk= 10, iat=1225,1724, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 LEU  HA          113 ALA  HN          5.50    (#    559:10  Unique         4.28, 4.50 A)
 &rst
  ixpk= 559, nxpk= 10, iat=1208,1724, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  112 MET  HA          113 ALA  HN          2.80    (#    560:10  Unique         2.13, 2.17 A)
 &rst
  ixpk= 560, nxpk= 10, iat=1709,1724, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   82 ILE  HA          113 ALA  HN          4.50    (#    561:10  Unique         3.29, 3.65 A)
 &rst
  ixpk= 561, nxpk= 10, iat=1238,1724, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:562    113 ALA  HN          4.50    (#    562:10  Single Ambig)
 &rst
  ixpk= 562, nxpk= 10, iat=  -1,1724, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1229,1230,1229,1230,
 &end
#
#  120 PRO  HB-         113 ALA  HN          6.50    (#    563:10  Unique         5.71, 6.65 A)
 &rst
  ixpk= 563, nxpk= 10, iat=  -1,1724, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1808,1809,
 &end
#
#    0 AMB  10-2:564    113 ALA  HN          4.50    (#    564:10  Single Ambig)
 &rst
  ixpk= 564, nxpk= 10, iat=  -1,1724, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1711,1712,1711,1712,
 &end
#
#  113 ALA  MB          113 ALA  HN          3.50    (#    565:10  Unique         2.46, 3.10 A)
 &rst
  ixpk= 565, nxpk= 10, iat=  -1,1724, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1728,1729,1730,
 &end
#
#    0 AMB  10-2:566    113 ALA  HN          4.50    (#    566:10  Single Ambig)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1,1724, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1697,1698,1699,1701,1702,1703,1215,1216,1217,1219,
      1220,1221,1824,1825,1826,1828,1829,1830,
 &end
#
#   82 ILE  QD1         113 ALA  HN          4.50    (#    567:10  Unique         3.29, 4.65 A)
 &rst
  ixpk= 567, nxpk= 10, iat=  -1,1724, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1249,1250,1251,
 &end
#
#  119 GLU  HN          114 ASN  HN          4.50    (#    568:10  Unique         3.11, 3.45 A)
 &rst
  ixpk= 568, nxpk= 10, iat=1786,1734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  113 ALA  HA          114 ASN  HN          2.80    (#    569:10  Unique         2.23, 2.26 A)
 &rst
  ixpk= 569, nxpk= 10, iat=1726,1734, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  114 ASN  HA          114 ASN  HN          3.50    (#    570:10  Unique         2.86, 2.91 A)
 &rst
  ixpk= 570, nxpk= 10, iat=1736,1734, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  120 PRO  HA          114 ASN  HN          4.50    (#    571:10  Unique         3.56, 3.89 A)
 &rst
  ixpk= 571, nxpk= 10, iat=1811,1734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  114 ASN  HB-         114 ASN  HN          3.50    (#    572:10  Unique         2.14, 2.46 A)
 &rst
  ixpk= 572, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1738,1739,
 &end
#
#  114 ASN  HB+         114 ASN  HN          3.50    (#    573:10  Unique         2.14, 2.46 A)
 &rst
  ixpk= 573, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1738,1739,
 &end
#
#    0 AMB  10-2:574    114 ASN  HN          5.50    (#    574:10  Single Ambig)
 &rst
  ixpk= 574, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1793,1794,1793,1794,
 &end
#
#  119 GLU  HB-         114 ASN  HN          5.50    (#    575:10  Unique         3.68, 4.65 A)
 &rst
  ixpk= 575, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1790,1791,
 &end
#
#  121 LEU  HB-         114 ASN  HN          5.50    (#    577:10  Unique         2.52, 4.80 A)
 &rst
  ixpk= 577, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1819,1820,
 &end
#
#  113 ALA  MB          114 ASN  HN          3.50    (#    578:10  Unique         2.74, 3.66 A)
 &rst
  ixpk= 578, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1728,1729,1730,
 &end
#
#  121 LEU  MDY         114 ASN  HN          3.50    (#    579:10  Unique         2.39, 4.21 A)
 &rst
  ixpk= 579, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1824,1825,1826,1828,1829,1830,
 &end
#
#  121 LEU  HG          114 ASN  HN          4.50    (#    580:10  Unique         3.93, 4.45 A)
 &rst
  ixpk= 580, nxpk= 10, iat=1822,1734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 LEU  HA          115 ALA  HN          4.50    (#    581:10  Unique         2.37, 2.86 A)
 &rst
  ixpk= 581, nxpk= 10, iat=1208,1748, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  114 ASN  HA          115 ALA  HN          2.80    (#    582:10  Unique         2.16, 2.21 A)
 &rst
  ixpk= 582, nxpk= 10, iat=1736,1748, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   79 GLU  HA          115 ALA  HN          4.50    (#    583:10  Unique         3.25, 3.71 A)
 &rst
  ixpk= 583, nxpk= 10, iat=1193,1748, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  115 ALA  HA          115 ALA  HN          3.50    (#    584:10  Unique         2.81, 2.85 A)
 &rst
  ixpk= 584, nxpk= 10, iat=1750,1748, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:585    115 ALA  HN          5.50    (#    585:10  Single Ambig)
 &rst
  ixpk= 585, nxpk= 10, iat=  -1,1748, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1229,1230,1229,1230,
 &end
#
#  114 ASN  HB-         115 ALA  HN          4.50    (#    586:10  Unique         4.19, 4.37 A)
 &rst
  ixpk= 586, nxpk= 10, iat=  -1,1748, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1738,1739,
 &end
#
#  114 ASN  HB+         115 ALA  HN          4.50    (#    587:10  Unique         4.19, 4.37 A)
 &rst
  ixpk= 587, nxpk= 10, iat=  -1,1748, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1738,1739,
 &end
#
#  115 ALA  MB          115 ALA  HN          2.80    (#    588:10  Unique         2.40, 2.86 A)
 &rst
  ixpk= 588, nxpk= 10, iat=  -1,1748, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1752,1753,1754,
 &end
#
#    0 AMB  10-2:589    115 ALA  HN          4.50    (#    589:10  Single Ambig)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1,1748, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1215,1216,1217,1219,1220,1221,1824,1825,1826,1828,
      1829,1830,
 &end
#
#  121 LEU  HG          115 ALA  HN          6.50    (#    590:10  Unique         6.11, 6.51 A)
 &rst
  ixpk= 590, nxpk= 10, iat=1822,1748, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  115 ALA  HN          116 GLY  HN          3.50    (#    591:10  Unique         2.73, 2.84 A)
 &rst
  ixpk= 591, nxpk= 10, iat=1748,1758, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  117 THR  HN          116 GLY  HN          3.50    (#    592:10  Unique         2.36, 2.53 A)
 &rst
  ixpk= 592, nxpk= 10, iat=1765,1758, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:593    116 GLY  HN          4.50    (#    593:10  Single Ambig)
 &rst
  ixpk= 593, nxpk= 10, iat=  -1,1758, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1736,1769,
 &end
#
#    0 AMB  10-2:594    116 GLY  HN          5.50    (#    594:10  Single Ambig)
 &rst
  ixpk= 594, nxpk= 10, iat=  -1,1758, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  33,1767,
 &end
#
#  116 GLY  HA+         116 GLY  HN          3.50    (#    595:10  Unique         2.28, 7.32 A)
 &rst
  ixpk= 595, nxpk= 10, iat=  -1,1758, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1760,1761,
 &end
#
#  115 ALA  MB          116 GLY  HN          3.50    (#    596:10  Unique         3.06, 3.88 A)
 &rst
  ixpk= 596, nxpk= 10, iat=  -1,1758, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1752,1753,1754,
 &end
#
#    0 AMB  10-2:597    117 THR  HN          2.80    (#    597:10  Single Ambig)
 &rst
  ixpk= 597, nxpk= 10, iat=  -1,1765, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1779,1758,
 &end
#
#  114 ASN  HD2-        117 THR  HN          5.50    (#    598:10  Unique         3.04, 3.98 A)
 &rst
  ixpk= 598, nxpk= 10, iat=  -1,1765, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1743,1744,
 &end
#
#  119 GLU  HN          117 THR  HN          4.50    (#    599:10  Unique         3.68, 3.87 A)
 &rst
  ixpk= 599, nxpk= 10, iat=1786,1765, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  117 THR  HA          117 THR  HN          3.50    (#    600:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 600, nxpk= 10, iat=1767,1765, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  117 THR  HB          117 THR  HN          3.50    (#    601:10  Unique         2.73, 3.43 A)
 &rst
  ixpk= 601, nxpk= 10, iat=1769,1765, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  118 GLY  HA+         117 THR  HN          4.50    (#    604:10  Unique         4.89, 7.78 A)
 &rst
  ixpk= 604, nxpk= 10, iat=  -1,1765, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1781,1782,
 &end
#
#  114 ASN  HB-         117 THR  HN          4.50    (#    605:10  Unique         3.10, 4.02 A)
 &rst
  ixpk= 605, nxpk= 10, iat=  -1,1765, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1738,1739,
 &end
#
#  114 ASN  HB+         117 THR  HN          4.50    (#    606:10  Unique         3.10, 4.02 A)
 &rst
  ixpk= 606, nxpk= 10, iat=  -1,1765, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1738,1739,
 &end
#
#  117 THR  MG2         117 THR  HN          4.50    (#    607:10  Unique         2.33, 3.58 A)
 &rst
  ixpk= 607, nxpk= 10, iat=  -1,1765, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1771,1772,1773,
 &end
#
#    0 AMB  10-2:608    122 LEU  HN          5.50    (#    608:10  Single Ambig)
 &rst
  ixpk= 608, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1709,1690,
 &end
#
#  122 LEU  HA          122 LEU  HN          3.50    (#    609:10  Unique         2.94, 2.98 A)
 &rst
  ixpk= 609, nxpk= 10, iat=1836,1834, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  121 LEU  HA          122 LEU  HN          3.50    (#    610:10  Unique         3.52, 3.55 A)
 &rst
  ixpk= 610, nxpk= 10, iat=1817,1834, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:611    122 LEU  HN          4.50    (#    611:10  Single Ambig)
 &rst
  ixpk= 611, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1811,2063,
 &end
#
#  120 PRO  HB-         122 LEU  HN          4.50    (#    612:10  Unique         3.64, 4.65 A)
 &rst
  ixpk= 612, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1808,1809,
 &end
#
#  122 LEU  HB-         122 LEU  HN          3.50    (#    613:10  Unique         2.58, 2.99 A)
 &rst
  ixpk= 613, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1838,1839,
 &end
#
#    0 AMB  10-2:614    122 LEU  HN          3.50    (#    614:10  Single Ambig)
 &rst
  ixpk= 614, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1838,1839,1841,
 &end
#
#  121 LEU  HB-         122 LEU  HN          4.50    (#    615:10  Unique         2.24, 3.16 A)
 &rst
  ixpk= 615, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1819,1820,
 &end
#
#  121 LEU  HB+         122 LEU  HN          4.50    (#    616:10  Unique         2.24, 3.16 A)
 &rst
  ixpk= 616, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1819,1820,
 &end
#
#  113 ALA  MB          122 LEU  HN          5.50    (#    617:10  Unique         5.49, 6.51 A)
 &rst
  ixpk= 617, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1728,1729,1730,
 &end
#
#    0 AMB  10-2:618    122 LEU  HN          3.50    (#    618:10  Single Ambig)
 &rst
  ixpk= 618, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1824,1825,1826,1828,1829,1830,1697,1698,1699,1701,
      1702,1703,1843,1844,1845,1847,1848,1849,
 &end
#
#  121 LEU  HG          122 LEU  HN          5.50    (#    619:10  Unique         4.46, 4.75 A)
 &rst
  ixpk= 619, nxpk= 10, iat=1822,1834, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 THR  HA          123 THR  HN          3.50    (#    622:10  Unique         2.97, 2.99 A)
 &rst
  ixpk= 622, nxpk= 10, iat=1855,1853, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  122 LEU  HA          123 THR  HN          2.80    (#    623:10  Unique         2.16, 2.22 A)
 &rst
  ixpk= 623, nxpk= 10, iat=1836,1853, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  136 LEU  HA          123 THR  HN          4.50    (#    624:10  Unique         3.46, 3.79 A)
 &rst
  ixpk= 624, nxpk= 10, iat=2044,1853, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  123 THR  HB          123 THR  HN          3.50    (#    625:10  Unique         2.79, 2.87 A)
 &rst
  ixpk= 625, nxpk= 10, iat=1857,1853, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  122 LEU  HB-         123 THR  HN          4.50    (#    626:10  Unique         2.78, 3.92 A)
 &rst
  ixpk= 626, nxpk= 10, iat=  -1,1853, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1838,1839,
 &end
#
#    0 AMB  10-2:627    123 THR  HN          4.50    (#    627:10  Single Ambig)
 &rst
  ixpk= 627, nxpk= 10, iat=  -1,1853, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1841,1838,1839,
 &end
#
#    0 AMB  10-2:628    123 THR  HN          6.50    (#    628:10  Single Ambig)
 &rst
  ixpk= 628, nxpk= 10, iat=  -1,1853, r1= 1.30, r2= 1.80, r3= 8.50, r4= 9.00,
 igr1=2065,2066,2067,1819,1820,
 &end
#
#  122 LEU  MDX         123 THR  HN          4.50    (#    630:10  Unique         2.15, 4.59 A)
 &rst
  ixpk= 630, nxpk= 10, iat=  -1,1853, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1843,1844,1845,1847,1848,1849,
 &end
#
#  124 LEU  HN          125 VAL  HN          4.50    (#    631:10  Unique         4.23, 4.44 A)
 &rst
  ixpk= 631, nxpk= 10, iat=1867,1886, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  134 GLN  HA          125 VAL  HN          4.50    (#    632:10  Unique         3.68, 4.08 A)
 &rst
  ixpk= 632, nxpk= 10, iat=2013,1886, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  124 LEU  HA          125 VAL  HN          2.80    (#    633:10  Unique         2.12, 2.24 A)
 &rst
  ixpk= 633, nxpk= 10, iat=1869,1886, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  125 VAL  HA          125 VAL  HN          4.50    (#    634:10  Unique         2.97, 2.99 A)
 &rst
  ixpk= 634, nxpk= 10, iat=1888,1886, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  125 VAL  HB          125 VAL  HN          3.50    (#    636:10  Unique         2.70, 2.92 A)
 &rst
  ixpk= 636, nxpk= 10, iat=1890,1886, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:637    125 VAL  HN          5.50    (#    637:10  Single Ambig)
 &rst
  ixpk= 637, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1987,1874,
 &end
#
#  124 LEU  HB+         125 VAL  HN          3.50    (#    638:10  Unique         2.71, 3.57 A)
 &rst
  ixpk= 638, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1871,1872,
 &end
#
#  124 LEU  MDX         125 VAL  HN          4.50    (#    639:10  Unique         4.17, 5.63 A)
 &rst
  ixpk= 639, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1876,1877,1878,1880,1881,1882,
 &end
#
#  125 VAL  MGY         125 VAL  HN          3.50    (#    640:10  Unique         2.69, 4.35 A)
 &rst
  ixpk= 640, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#  108 PHE  HN          126 CYS  HN          5.50    (#    641:10  Unique         2.68, 2.91 A)
 &rst
  ixpk= 641, nxpk= 10, iat=1638,1902, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:642    126 CYS  HN          3.50    (#    642:10  Single Ambig)
 &rst
  ixpk= 642, nxpk= 10, iat=  -1,1902, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1904,1660,
 &end
#
#  125 VAL  HA          126 CYS  HN          2.80    (#    643:10  Unique         2.12, 2.17 A)
 &rst
  ixpk= 643, nxpk= 10, iat=1888,1902, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:644    126 CYS  HN          5.50    (#    644:10  Single Ambig)
 &rst
  ixpk= 644, nxpk= 10, iat=  -1,1902, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1662,1663,1662,1663,
 &end
#
#  126 CYS  HB+         126 CYS  HN          3.50    (#    646:10  Unique         2.51, 2.77 A)
 &rst
  ixpk= 646, nxpk= 10, iat=  -1,1902, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1906,1907,
 &end
#
#  125 VAL  HB          126 CYS  HN          4.50    (#    647:10  Unique         3.96, 4.07 A)
 &rst
  ixpk= 647, nxpk= 10, iat=1890,1902, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  128 GLY  HN          129 SER  HN          3.50    (#    678:10  Unique         2.13, 2.36 A)
 &rst
  ixpk= 678, nxpk= 10, iat=1924,1931, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  127 SER  HN          129 SER  HN          5.50    (#    679:10  Unique         3.17, 3.31 A)
 &rst
  ixpk= 679, nxpk= 10, iat=1913,1931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HN          129 SER  HN          4.50    (#    680:10  Unique         4.39, 4.44 A)
 &rst
  ixpk= 680, nxpk= 10, iat=1942,1931, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  126 CYS  HA          129 SER  HN          6.50    (#    681:10  Unique         4.19, 4.45 A)
 &rst
  ixpk= 681, nxpk= 10, iat=1904,1931, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  129 SER  HA          129 SER  HN          3.50    (#    682:10  Unique         2.94, 2.97 A)
 &rst
  ixpk= 682, nxpk= 10, iat=1933,1931, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:685    129 SER  HN          3.50    (#    685:10  Single Ambig)
 &rst
  ixpk= 685, nxpk= 10, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1935,1936,1935,1936,
 &end
#
#  126 CYS  HB-         129 SER  HN          5.50    (#    686:10  Unique         3.36, 5.55 A)
 &rst
  ixpk= 686, nxpk= 10, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1906,1907,
 &end
#
#    0 AMB  10-2:687    129 SER  HN          5.50    (#    687:10  Single Ambig)
 &rst
  ixpk= 687, nxpk= 10, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1601,1602,1601,1602,1631,1632,
 &end
#
#  105 ILE  HB          129 SER  HN          4.50    (#    688:10  Unique         3.92, 4.14 A)
 &rst
  ixpk= 688, nxpk= 10, iat=1595,1931, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  105 ILE  QD1         129 SER  HN          5.50    (#    689:10  Unique         4.72, 6.43 A)
 &rst
  ixpk= 689, nxpk= 10, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1604,1605,1606,
 &end
#
#  129 SER  HN          130 TRP  HN          5.50    (#    691:10  Unique         4.39, 4.44 A)
 &rst
  ixpk= 691, nxpk= 10, iat=1931,1942, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HE3         130 TRP  HN          5.50    (#    692:10  Unique         4.75, 4.94 A)
 &rst
  ixpk= 692, nxpk= 10, iat=1961,1942, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  129 SER  HA          130 TRP  HN          2.80    (#    693:10  Unique         2.17, 2.23 A)
 &rst
  ixpk= 693, nxpk= 10, iat=1933,1942, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  130 TRP  HA          130 TRP  HN          3.50    (#    694:10  Unique         2.76, 2.80 A)
 &rst
  ixpk= 694, nxpk= 10, iat=1944,1942, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:695    130 TRP  HN          3.50    (#    695:10  Single Ambig)
 &rst
  ixpk= 695, nxpk= 10, iat=  -1,1942, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1935,1936,1935,1936,
 &end
#
#    0 AMB  10-2:696    130 TRP  HN          3.50    (#    696:10  Single Ambig)
 &rst
  ixpk= 696, nxpk= 10, iat=  -1,1942, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1946,1947,1946,1947,
 &end
#
#    0 AMB  10-2:697    130 TRP  HN          5.50    (#    697:10  Single Ambig)
 &rst
  ixpk= 697, nxpk= 10, iat=  -1,1942, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1601,1602,1601,1602,
 &end
#
#  105 ILE  QD1         130 TRP  HN          3.50    (#    698:10  Unique         2.23, 3.76 A)
 &rst
  ixpk= 698, nxpk= 10, iat=  -1,1942, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1604,1605,1606,
 &end
#
#   99 ILE  QG2         130 TRP  HN          5.50    (#    699:10  Unique         5.93, 6.94 A)
 &rst
  ixpk= 699, nxpk= 10, iat=  -1,1942, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1513,1514,1515,
 &end
#
#   28 ILE  QD1         130 TRP  HN          4.50    (#    700:10  Unique         4.26, 5.06 A)
 &rst
  ixpk= 700, nxpk= 10, iat=  -1,1942, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 425, 426, 427,
 &end
#
#  134 GLN  HA          134 GLN  HN          3.50    (#    701:10  Unique         2.89, 2.96 A)
 &rst
  ixpk= 701, nxpk= 10, iat=2013,2011, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:703    134 GLN  HN          3.50    (#    703:10  Single Ambig)
 &rst
  ixpk= 703, nxpk= 10, iat=  -1,2011, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2015,2016,2018,2019,
 &end
#
#  134 GLN  HB+         134 GLN  HN          3.50    (#    704:10  Unique         2.39, 3.19 A)
 &rst
  ixpk= 704, nxpk= 10, iat=  -1,2011, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2015,2016,
 &end
#
#    0 AMB  10-2:705    134 GLN  HN          6.50    (#    705:10  Single Ambig)
 &rst
  ixpk= 705, nxpk= 10, iat=  -1,2011, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1874,1987,
 &end
#
#  135 THR  MG2         134 GLN  HN          6.50    (#    706:10  Unique         4.75, 6.46 A)
 &rst
  ixpk= 706, nxpk= 10, iat=  -1,2011, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=2034,2035,2036,
 &end
#
#  124 LEU  MDX         134 GLN  HN          5.50    (#    707:10  Unique         4.80, 6.89 A)
 &rst
  ixpk= 707, nxpk= 10, iat=  -1,2011, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1876,1877,1878,1880,1881,1882,
 &end
#
#  122 LEU  MDX         134 GLN  HN          5.50    (#    708:10  Unique         5.95, 7.86 A)
 &rst
  ixpk= 708, nxpk= 10, iat=  -1,2011, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1843,1844,1845,1847,1848,1849,
 &end
#
#  124 LEU  HA          135 THR  HN          4.50    (#    709:10  Unique         3.35, 3.74 A)
 &rst
  ixpk= 709, nxpk= 10, iat=1869,2028, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  134 GLN  HA          135 THR  HN          2.80    (#    710:10  Unique         2.13, 2.18 A)
 &rst
  ixpk= 710, nxpk= 10, iat=2013,2028, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  122 LEU  HA          135 THR  HN          4.50    (#    711:10  Unique         4.26, 4.45 A)
 &rst
  ixpk= 711, nxpk= 10, iat=1836,2028, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  135 THR  HA          135 THR  HN          3.50    (#    712:10  Unique         2.94, 2.98 A)
 &rst
  ixpk= 712, nxpk= 10, iat=2030,2028, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  123 THR  HB          135 THR  HN          4.50    (#    713:10  Unique         3.68, 4.00 A)
 &rst
  ixpk= 713, nxpk= 10, iat=1857,2028, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  135 THR  HB          135 THR  HN          3.50    (#    714:10  Unique         2.61, 3.16 A)
 &rst
  ixpk= 714, nxpk= 10, iat=2032,2028, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  134 GLN  HG+         135 THR  HN          4.50    (#    715:10  Unique         2.90, 4.09 A)
 &rst
  ixpk= 715, nxpk= 10, iat=  -1,2028, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2018,2019,
 &end
#
#  122 LEU  HB-         135 THR  HN          5.50    (#    716:10  Unique         4.20, 5.73 A)
 &rst
  ixpk= 716, nxpk= 10, iat=  -1,2028, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1838,1839,
 &end
#
#  134 GLN  HB+         135 THR  HN          4.50    (#    717:10  Unique         2.85, 3.94 A)
 &rst
  ixpk= 717, nxpk= 10, iat=  -1,2028, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2015,2016,
 &end
#
#    0 AMB  10-2:718    135 THR  HN          4.50    (#    718:10  Single Ambig)
 &rst
  ixpk= 718, nxpk= 10, iat=  -1,2028, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1841,1874,1838,1839,
 &end
#
#  135 THR  MG2         135 THR  HN          3.50    (#    719:10  Unique         2.40, 3.41 A)
 &rst
  ixpk= 719, nxpk= 10, iat=  -1,2028, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2034,2035,2036,
 &end
#
#  124 LEU  MDX         135 THR  HN          3.50    (#    720:10  Unique         3.04, 5.76 A)
 &rst
  ixpk= 720, nxpk= 10, iat=  -1,2028, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1876,1877,1878,1880,1881,1882,
 &end
#
#  122 LEU  MDX         135 THR  HN          4.50    (#    721:10  Unique         2.58, 5.00 A)
 &rst
  ixpk= 721, nxpk= 10, iat=  -1,2028, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1843,1844,1845,1847,1848,1849,
 &end
#
#  123 THR  HN          137 ALA  HN          4.50    (#    724:10  Unique         3.35, 4.09 A)
 &rst
  ixpk= 724, nxpk= 10, iat=1853,2061, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:725    137 ALA  HN          4.50    (#    725:10  Single Ambig)
 &rst
  ixpk= 725, nxpk= 10, iat=  -1,2061, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2042,1815,
 &end
#
#  122 LEU  HA          137 ALA  HN          4.50    (#    726:10  Unique         2.29, 2.73 A)
 &rst
  ixpk= 726, nxpk= 10, iat=1836,2061, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  136 LEU  HA          137 ALA  HN          2.80    (#    727:10  Unique         2.07, 2.14 A)
 &rst
  ixpk= 727, nxpk= 10, iat=2044,2061, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  137 ALA  HA          137 ALA  HN          3.50    (#    728:10  Unique         2.22, 2.31 A)
 &rst
  ixpk= 728, nxpk= 10, iat=2063,2061, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  136 LEU  HB+         137 ALA  HN          4.50    (#    729:10  Unique         2.59, 3.68 A)
 &rst
  ixpk= 729, nxpk= 10, iat=  -1,2061, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2046,2047,
 &end
#
#  137 ALA  MB          137 ALA  HN          3.50    (#    730:10  Unique         2.40, 3.32 A)
 &rst
  ixpk= 730, nxpk= 10, iat=  -1,2061, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2065,2066,2067,
 &end
#
#  135 THR  MG2         137 ALA  HN          5.50    (#    731:10  Unique         4.31, 5.54 A)
 &rst
  ixpk= 731, nxpk= 10, iat=  -1,2061, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2034,2035,2036,
 &end
#
#  136 LEU  MDX         137 ALA  HN          4.50    (#    732:10  Unique         3.36, 5.39 A)
 &rst
  ixpk= 732, nxpk= 10, iat=  -1,2061, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2051,2052,2053,2055,2056,2057,
 &end
#
#    0 AMB  10-2:733    137 ALA  HN          5.50    (#    733:10  Single Ambig)
 &rst
  ixpk= 733, nxpk= 10, iat=  -1,2061, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1843,1844,1845,1847,1848,1849,1824,1825,1826,1828,
      1829,1830,
 &end
#
#  139 ASP  HA          139 ASP  HN          4.50    (#    734:10  Unique         2.26, 2.77 A)
 &rst
  ixpk= 734, nxpk= 10, iat=2097,2095, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  138 ARG  HA          139 ASP  HN          4.50    (#    735:10  Unique         2.59, 3.04 A)
 &rst
  ixpk= 735, nxpk= 10, iat=2073,2095, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  139 ASP  HB-         139 ASP  HN          4.50    (#    736:10  Unique         2.27, 2.52 A)
 &rst
  ixpk= 736, nxpk= 10, iat=  -1,2095, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2099,2100,
 &end
#
#  139 ASP  HB+         139 ASP  HN          4.50    (#    737:10  Unique         2.27, 2.52 A)
 &rst
  ixpk= 737, nxpk= 10, iat=  -1,2095, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2099,2100,
 &end
#
#    0 AMB  10-2:738    139 ASP  HN          5.50    (#    738:10  Single Ambig)
 &rst
  ixpk= 738, nxpk= 10, iat=  -1,2095, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2075,2076,2075,2076,
 &end
#
#    0 AMB  10-2:739    139 ASP  HN          6.50    (#    739:10  Single Ambig)
 &rst
  ixpk= 739, nxpk= 10, iat=  -1,2095, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=2078,2079,2078,2079,
 &end
#
#    0 AMB  10-2:740    140 THR  HN          4.50    (#    740:10  Single Ambig)
 &rst
  ixpk= 740, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2121,2095,
 &end
#
#  139 ASP  HA          140 THR  HN          3.50    (#    742:10  Unique         2.23, 3.47 A)
 &rst
  ixpk= 742, nxpk= 10, iat=2097,2107, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  139 ASP  HB+         140 THR  HN          5.50    (#    744:10  Unique         2.11, 3.46 A)
 &rst
  ixpk= 744, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2099,2100,
 &end
#
#  140 THR  MG2         140 THR  HN          4.50    (#    745:10  Unique         2.12, 3.48 A)
 &rst
  ixpk= 745, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2113,2114,2115,
 &end
#
#    0 AMB  10-2:746    141 ARG  HN          3.50    (#    746:10  Single Ambig)
 &rst
  ixpk= 746, nxpk= 10, iat=  -1,2121, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2073,2111,2109,
 &end
#
#  140 THR  MG2         141 ARG  HN          5.50    (#    748:10  Unique         2.73, 4.20 A)
 &rst
  ixpk= 748, nxpk= 10, iat=  -1,2121, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2113,2114,2115,
 &end
#
#   38 VAL  HN           99 ILE  HN          4.50    (#    749:10  Unique         2.88, 3.08 A)
 &rst
  ixpk= 749, nxpk= 10, iat= 559,1507, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:751     99 ILE  HN          4.50    (#    751:10  Single Ambig)
 &rst
  ixpk= 751, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 555,1593,
 &end
#
#   99 ILE  HA           99 ILE  HN          3.50    (#    752:10  Unique         2.97, 2.99 A)
 &rst
  ixpk= 752, nxpk= 10, iat=1509,1507, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   98 VAL  HA           99 ILE  HN          2.80    (#    753:10  Unique         2.04, 2.12 A)
 &rst
  ixpk= 753, nxpk= 10, iat=1493,1507, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   99 ILE  HB           99 ILE  HN          3.50    (#    754:10  Unique         2.47, 2.56 A)
 &rst
  ixpk= 754, nxpk= 10, iat=1511,1507, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:755     99 ILE  HN          3.50    (#    755:10  Single Ambig)
 &rst
  ixpk= 755, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1517,1518, 406, 407, 408,
 &end
#
#   98 VAL  MGY          99 ILE  HN          3.50    (#    756:10  Unique         2.47, 3.93 A)
 &rst
  ixpk= 756, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1497,1498,1499,1501,1502,1503,
 &end
#
#   99 ILE  QG2          99 ILE  HN          4.50    (#    757:10  Unique         4.34, 4.62 A)
 &rst
  ixpk= 757, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1513,1514,1515,
 &end
#
#   61 TRP  HZ2          61 TRP  HE1         3.50    (#    758:10  Unique         2.88, 2.90 A)
 &rst
  ixpk= 758, nxpk= 10, iat= 935, 932, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 TRP  HD1          61 TRP  HE1         3.50    (#    759:10  Unique         2.56, 2.57 A)
 &rst
  ixpk= 759, nxpk= 10, iat= 930, 932, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   94 GLN  HA           61 TRP  HE1         5.50    (#    761:10  Unique         4.29, 4.88 A)
 &rst
  ixpk= 761, nxpk= 10, iat=1429, 932, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   95 PRO  HD+          61 TRP  HE1         6.50    (#    762:10  Unique         2.61, 3.80 A)
 &rst
  ixpk= 762, nxpk= 10, iat=  -1, 932, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1445,1446,
 &end
#
#   95 PRO  HD-          61 TRP  HE1         4.50    (#    763:10  Unique         2.61, 3.80 A)
 &rst
  ixpk= 763, nxpk= 10, iat=  -1, 932, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1445,1446,
 &end
#
#   94 GLN  HG+          61 TRP  HE1         5.50    (#    764:10  Unique         5.60, 6.22 A)
 &rst
  ixpk= 764, nxpk= 10, iat=  -1, 932, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1434,1435,
 &end
#
#   51 VAL  HN           64 LEU  HN          5.50    (#    768:10  Unique         3.90, 4.20 A)
 &rst
  ixpk= 768, nxpk= 10, iat= 766, 976, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 MET  HA           64 LEU  HN          5.50    (#    769:10  Unique         2.16, 2.66 A)
 &rst
  ixpk= 769, nxpk= 10, iat= 751, 976, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   63 PRO  HA           64 LEU  HN          3.50    (#    770:10  Unique         2.18, 2.26 A)
 &rst
  ixpk= 770, nxpk= 10, iat= 972, 976, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:771      0 AMB  10-1:771    3.50    (#    771:10  Double Ambig)
 &rst
  ixpk= 771, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1002,1003, 969, 970,
 igr2= 995, 976,
 &end
#
#   64 LEU  HB-           0 AMB  10-1:772    3.50    (#    772:10  Single Ambig)
 &rst
  ixpk= 772, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 980, 981,
 igr2= 995, 976,
 &end
#
#    0 AMB  10-2:774      0 AMB  10-1:774    3.50    (#    774:10  Double Ambig)
 &rst
  ixpk= 774, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 980, 981, 980, 981,
 igr2= 995, 976,
 &end
#
#   51 VAL  MGY           0 AMB  10-1:775    6.50    (#    775:10  Single Ambig)
 &rst
  ixpk= 775, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 772, 773, 774, 776, 777, 778,
 igr2= 976, 995,
 &end
#
#    0 AMB  10-2:776     65 GLN  HN          3.50    (#    776:10  Single Ambig)
 &rst
  ixpk= 776, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 985, 986, 987, 989, 990, 991, 952, 953, 954, 956,
       957, 958,
 &end
#
#   48 ARG  HA           49 ILE  HN          3.50    (#    778:10  Unique         2.16, 2.35 A)
 &rst
  ixpk= 778, nxpk= 10, iat= 708, 730, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 ILE  HB           49 ILE  HN          4.50    (#    779:10  Unique         2.58, 2.70 A)
 &rst
  ixpk= 779, nxpk= 10, iat= 734, 730, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:780     49 ILE  HN          3.50    (#    780:10  Single Ambig)
 &rst
  ixpk= 780, nxpk= 10, iat=  -1, 730, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 740, 741, 710, 711,
 &end
#
#    0 AMB  10-2:781     49 ILE  HN          5.50    (#    781:10  Single Ambig)
 &rst
  ixpk= 781, nxpk= 10, iat=  -1, 730, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 592, 593, 736, 737, 738,
 &end
#
#    0 AMB  10-2:782     49 ILE  HN          5.50    (#    782:10  Single Ambig)
 &rst
  ixpk= 782, nxpk= 10, iat=  -1, 730, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 743, 744, 745, 985, 986, 987, 989, 990, 991,
 &end
#
#    9 ALA  HN            8 VAL  HN          4.50    (#    783:10  Unique         2.12, 2.77 A)
 &rst
  ixpk= 783, nxpk= 10, iat= 126, 110, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  118 GLY  HN          119 GLU  HN          3.50    (#    784:10  Unique         2.42, 2.49 A)
 &rst
  ixpk= 784, nxpk= 10, iat=1779,1786, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  114 ASN  HN          119 GLU  HN          4.50    (#    785:10  Unique         3.11, 3.45 A)
 &rst
  ixpk= 785, nxpk= 10, iat=1734,1786, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  117 THR  HA          119 GLU  HN          5.50    (#    786:10  Unique         4.28, 4.43 A)
 &rst
  ixpk= 786, nxpk= 10, iat=1767,1786, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:787    119 GLU  HN          3.50    (#    787:10  Single Ambig)
 &rst
  ixpk= 787, nxpk= 10, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1769,1788,
 &end
#
#  118 GLY  HA-         119 GLU  HN          3.50    (#    788:10  Unique         3.41, 7.45 A)
 &rst
  ixpk= 788, nxpk= 10, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1781,1782,
 &end
#
#    0 AMB  10-2:789    119 GLU  HN          4.50    (#    789:10  Single Ambig)
 &rst
  ixpk= 789, nxpk= 10, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1802,1803,1802,1803,
 &end
#
#  118 GLY  HA+         119 GLU  HN          3.50    (#    790:10  Unique         3.41, 7.45 A)
 &rst
  ixpk= 790, nxpk= 10, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1781,1782,
 &end
#
#  114 ASN  HB-         119 GLU  HN          3.50    (#    791:10  Unique         2.74, 3.83 A)
 &rst
  ixpk= 791, nxpk= 10, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1738,1739,
 &end
#
#  114 ASN  HB+         119 GLU  HN          3.50    (#    792:10  Unique         2.74, 3.83 A)
 &rst
  ixpk= 792, nxpk= 10, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1738,1739,
 &end
#
#    0 AMB  10-2:793    119 GLU  HN          3.50    (#    793:10  Single Ambig)
 &rst
  ixpk= 793, nxpk= 10, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1793,1794,1793,1794,
 &end
#
#  119 GLU  HB-         119 GLU  HN          2.80    (#    794:10  Unique         2.31, 2.84 A)
 &rst
  ixpk= 794, nxpk= 10, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1790,1791,
 &end
#
#  117 THR  MG2         119 GLU  HN          4.50    (#    795:10  Unique         3.91, 4.86 A)
 &rst
  ixpk= 795, nxpk= 10, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1771,1772,1773,
 &end
#
#    0 AMB  10-2:797     29 ASP  HN          3.50    (#    797:10  Single Ambig)
 &rst
  ixpk= 797, nxpk= 10, iat=  -1, 431, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 412, 443,
 &end
#
#   26 LEU  HA           29 ASP  HN          5.50    (#    798:10  Unique         3.46, 3.60 A)
 &rst
  ixpk= 798, nxpk= 10, iat= 385, 431, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 ASP  HB+          29 ASP  HN          3.50    (#    799:10  Unique         2.29, 2.48 A)
 &rst
  ixpk= 799, nxpk= 10, iat=  -1, 431, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 435, 436,
 &end
#
#   29 ASP  HA           29 ASP  HN          4.50    (#    800:10  Unique         2.83, 2.84 A)
 &rst
  ixpk= 800, nxpk= 10, iat= 433, 431, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ILE  HB           29 ASP  HN          4.50    (#    801:10  Unique         2.49, 2.64 A)
 &rst
  ixpk= 801, nxpk= 10, iat= 416, 431, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   60 ARG  HA           60 ARG  HN          4.50    (#    804:10  Unique         2.56, 2.89 A)
 &rst
  ixpk= 804, nxpk= 10, iat= 900, 898, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:805     60 ARG  HN          4.50    (#    805:10  Single Ambig)
 &rst
  ixpk= 805, nxpk= 10, iat=  -1, 898, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 878, 879, 908, 909,
 &end
#
#    0 AMB  10-2:806     60 ARG  HN          4.50    (#    806:10  Single Ambig)
 &rst
  ixpk= 806, nxpk= 10, iat=  -1, 898, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 902, 903, 902, 903,
 &end
#
#    0 AMB  10-2:807     60 ARG  HN          4.50    (#    807:10  Single Ambig)
 &rst
  ixpk= 807, nxpk= 10, iat=  -1, 898, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 789, 790, 905, 906, 905, 906,
 &end
#
#  110 LEU  HG          125 VAL  HN          6.50    (#    808:10  Unique         6.55, 6.59 A)
 &rst
  ixpk= 808, nxpk= 10, iat=1676,1886, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   42 PHE  HB+          43 SER  HN          5.50    (#    809:10  Unique         3.10, 3.92 A)
 &rst
  ixpk= 809, nxpk= 10, iat=  -1, 638, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 622, 623,
 &end
#
#   11 THR  HN           12 ARG  HN          3.50    (#    817:10  Unique         2.72, 2.81 A)
 &rst
  ixpk= 817, nxpk= 10, iat= 150, 164, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   11 THR  HB           12 ARG  HN          3.50    (#    818:10  Unique         2.39, 2.46 A)
 &rst
  ixpk= 818, nxpk= 10, iat= 154, 164, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   12 ARG  HA           12 ARG  HN          3.50    (#    819:10  Unique         2.82, 2.89 A)
 &rst
  ixpk= 819, nxpk= 10, iat= 166, 164, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 VAL  HA           12 ARG  HN          4.50    (#    820:10  Unique         3.64, 4.02 A)
 &rst
  ixpk= 820, nxpk= 10, iat= 112, 164, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 ARG  HD+          12 ARG  HN          4.50    (#    821:10  Unique         3.14, 4.41 A)
 &rst
  ixpk= 821, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 174, 175,
 &end
#
#   12 ARG  HD-          12 ARG  HN          5.50    (#    822:10  Unique         3.14, 4.41 A)
 &rst
  ixpk= 822, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 174, 175,
 &end
#
#   12 ARG  HB-          12 ARG  HN          2.80    (#    823:10  Unique         2.21, 3.01 A)
 &rst
  ixpk= 823, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 168, 169,
 &end
#
#   12 ARG  HB+          12 ARG  HN          2.80    (#    824:10  Unique         2.21, 3.01 A)
 &rst
  ixpk= 824, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 168, 169,
 &end
#
#   12 ARG  HG+          12 ARG  HN          4.50    (#    825:10  Unique         2.17, 3.00 A)
 &rst
  ixpk= 825, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 171, 172,
 &end
#
#    0 AMB  10-2:826     12 ARG  HN          4.50    (#    826:10  Single Ambig)
 &rst
  ixpk= 826, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 192, 193, 194, 130, 131, 132,
 &end
#
#   11 THR  MG2          12 ARG  HN          4.50    (#    827:10  Unique         3.57, 4.39 A)
 &rst
  ixpk= 827, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 156, 157, 158,
 &end
#
#    8 VAL  MGY          12 ARG  HN          4.50    (#    828:10  Unique         3.73, 5.56 A)
 &rst
  ixpk= 828, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#   80 LEU  MDX          12 ARG  HN          5.50    (#    829:10  Unique         3.81, 6.15 A)
 &rst
  ixpk= 829, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1215,1216,1217,1219,1220,1221,
 &end
#
#  124 LEU  HA          133 ASP  HN          4.50    (#    830:10  Unique         4.34, 4.50 A)
 &rst
  ixpk= 830, nxpk= 10, iat=1869,1999, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  121 LEU  HN          122 LEU  HN          3.50    (#    833:10  Unique         1.96, 2.12 A)
 &rst
  ixpk= 833, nxpk= 10, iat=1815,1834, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  112 MET  HN          122 LEU  HN          4.50    (#    834:10  Unique         2.94, 3.28 A)
 &rst
  ixpk= 834, nxpk= 10, iat=1707,1834, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   87 PHE  HD           87 PHE  HN          3.50    (#    835:10  Unique         2.29, 3.48 A)
 &rst
  ixpk= 835, nxpk= 10, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1330,1338,
 &end
#
#   88 LYS  HN           87 PHE  HN          4.50    (#    836:10  Unique         3.49, 4.53 A)
 &rst
  ixpk= 836, nxpk= 10, iat=1342,1322, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   87 PHE  HA           87 PHE  HN          3.50    (#    837:10  Unique         2.28, 2.84 A)
 &rst
  ixpk= 837, nxpk= 10, iat=1324,1322, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 PRO  HA           87 PHE  HN          4.50    (#    838:10  Unique         2.19, 3.43 A)
 &rst
  ixpk= 838, nxpk= 10, iat=1318,1322, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   85 GLN  HA           87 PHE  HN          4.50    (#    839:10  Unique         2.82, 3.26 A)
 &rst
  ixpk= 839, nxpk= 10, iat=1293,1322, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   86 PRO  HD+          87 PHE  HN          4.50    (#    840:10  Unique         2.56, 3.37 A)
 &rst
  ixpk= 840, nxpk= 10, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1309,1310,
 &end
#
#   86 PRO  HD-          87 PHE  HN          4.50    (#    841:10  Unique         2.56, 3.37 A)
 &rst
  ixpk= 841, nxpk= 10, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1309,1310,
 &end
#
#   87 PHE  HB-          87 PHE  HN          4.50    (#    842:10  Unique         2.38, 3.16 A)
 &rst
  ixpk= 842, nxpk= 10, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1326,1327,
 &end
#
#   87 PHE  HB+          87 PHE  HN          3.50    (#    843:10  Unique         2.38, 3.16 A)
 &rst
  ixpk= 843, nxpk= 10, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1326,1327,
 &end
#
#   86 PRO  HG-          87 PHE  HN          4.50    (#    846:10  Unique         2.63, 3.79 A)
 &rst
  ixpk= 846, nxpk= 10, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1312,1313,
 &end
#
#    0 AMB  10-2:847     87 PHE  HN          5.50    (#    847:10  Single Ambig)
 &rst
  ixpk= 847, nxpk= 10, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1276,1277,1462,1463,
 &end
#
#   97 VAL  MGY          87 PHE  HN          6.50    (#    848:10  Unique         5.72, 8.44 A)
 &rst
  ixpk= 848, nxpk= 10, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1481,1482,1483,1485,1486,1487,
 &end
#
#   85 GLN  HN           87 PHE  HN          5.50    (#    849:10  Unique         4.21, 4.70 A)
 &rst
  ixpk= 849, nxpk= 10, iat=1291,1322, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   92 SER  HN           94 GLN  HN          5.50    (#    850:10  Unique         3.45, 4.39 A)
 &rst
  ixpk= 850, nxpk= 10, iat=1402,1427, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLN  HA           94 GLN  HN          3.50    (#    851:10  Unique         2.89, 2.96 A)
 &rst
  ixpk= 851, nxpk= 10, iat=1429,1427, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   92 SER  HA           94 GLN  HN          4.50    (#    852:10  Unique         3.73, 3.98 A)
 &rst
  ixpk= 852, nxpk= 10, iat=1404,1427, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:853     94 GLN  HN          3.50    (#    853:10  Single Ambig)
 &rst
  ixpk= 853, nxpk= 10, iat=  -1,1427, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1406,1407,1415,
 &end
#
#   92 SER  HB-          94 GLN  HN          4.50    (#    854:10  Unique         2.69, 3.55 A)
 &rst
  ixpk= 854, nxpk= 10, iat=  -1,1427, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1406,1407,
 &end
#
#   93 ASN  HB-          94 GLN  HN          4.50    (#    855:10  Unique         3.40, 4.14 A)
 &rst
  ixpk= 855, nxpk= 10, iat=  -1,1427, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1417,1418,
 &end
#
#   94 GLN  HG-          94 GLN  HN          5.50    (#    856:10  Unique         2.55, 2.92 A)
 &rst
  ixpk= 856, nxpk= 10, iat=  -1,1427, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1434,1435,
 &end
#
#   94 GLN  HG+          94 GLN  HN          4.50    (#    857:10  Unique         2.55, 2.92 A)
 &rst
  ixpk= 857, nxpk= 10, iat=  -1,1427, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1434,1435,
 &end
#
#  122 LEU  HA          138 ARG  HN          6.50    (#    858:10  Unique         3.86, 4.74 A)
 &rst
  ixpk= 858, nxpk= 10, iat=1836,2071, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  136 LEU  HA          138 ARG  HN          5.50    (#    859:10  Unique         4.08, 4.82 A)
 &rst
  ixpk= 859, nxpk= 10, iat=2044,2071, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  138 ARG  HA          138 ARG  HN          4.50    (#    860:10  Unique         2.22, 2.45 A)
 &rst
  ixpk= 860, nxpk= 10, iat=2073,2071, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  137 ALA  HA          138 ARG  HN          3.50    (#    861:10  Unique         2.06, 2.69 A)
 &rst
  ixpk= 861, nxpk= 10, iat=2063,2071, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:862    138 ARG  HN          3.50    (#    862:10  Single Ambig)
 &rst
  ixpk= 862, nxpk= 10, iat=  -1,2071, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2075,2076,2075,2076,
 &end
#
#    0 AMB  10-2:863    138 ARG  HN          4.50    (#    863:10  Single Ambig)
 &rst
  ixpk= 863, nxpk= 10, iat=  -1,2071, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2078,2079,2078,2079,
 &end
#
#  137 ALA  MB          138 ARG  HN          4.50    (#    864:10  Unique         2.12, 4.06 A)
 &rst
  ixpk= 864, nxpk= 10, iat=  -1,2071, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2065,2066,2067,
 &end
#
#  133 ASP  HN          132 LEU  HN          4.50    (#    865:10  Unique         4.28, 4.47 A)
 &rst
  ixpk= 865, nxpk= 10, iat=1999,1980, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  130 TRP  HA          132 LEU  HN          4.50    (#    866:10  Unique         2.77, 3.55 A)
 &rst
  ixpk= 866, nxpk= 10, iat=1944,1980, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  132 LEU  HA          132 LEU  HN          3.50    (#    867:10  Unique         2.24, 2.59 A)
 &rst
  ixpk= 867, nxpk= 10, iat=1982,1980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  131 PRO  HA          132 LEU  HN          3.50    (#    868:10  Unique         2.45, 2.80 A)
 &rst
  ixpk= 868, nxpk= 10, iat=1976,1980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  132 LEU  HG          132 LEU  HN          4.50    (#    869:10  Unique         3.74, 3.88 A)
 &rst
  ixpk= 869, nxpk= 10, iat=1987,1980, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  132 LEU  HB-         132 LEU  HN          3.50    (#    870:10  Unique         2.27, 3.42 A)
 &rst
  ixpk= 870, nxpk= 10, iat=  -1,1980, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1984,1985,
 &end
#
#  132 LEU  HB+         132 LEU  HN          3.50    (#    871:10  Unique         2.27, 3.42 A)
 &rst
  ixpk= 871, nxpk= 10, iat=  -1,1980, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1984,1985,
 &end
#
#    0 AMB  10-2:872    132 LEU  HN          3.50    (#    872:10  Single Ambig)
 &rst
  ixpk= 872, nxpk= 10, iat=  -1,1980, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1989,1990,1991,1993,1994,1995, 358, 359, 360, 362,
       363, 364,
 &end
#
#  132 LEU  MDY         132 LEU  HN          4.50    (#    873:10  Unique         2.52, 4.56 A)
 &rst
  ixpk= 873, nxpk= 10, iat=  -1,1980, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#   50 MET  HA           62 VAL  HN          5.50    (#    875:10  Unique         4.23, 4.46 A)
 &rst
  ixpk= 875, nxpk= 10, iat= 751, 946, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 TRP  HA           62 VAL  HN          3.50    (#    876:10  Unique         2.05, 2.14 A)
 &rst
  ixpk= 876, nxpk= 10, iat= 924, 946, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 PRO  HA           62 VAL  HN          5.50    (#    877:10  Unique         4.03, 4.27 A)
 &rst
  ixpk= 877, nxpk= 10, iat= 792, 946, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 TRP  HB-          62 VAL  HN          5.50    (#    878:10  Unique         2.75, 3.49 A)
 &rst
  ixpk= 878, nxpk= 10, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 926, 927,
 &end
#
#   61 TRP  HB+          62 VAL  HN          4.50    (#    879:10  Unique         2.75, 3.49 A)
 &rst
  ixpk= 879, nxpk= 10, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 926, 927,
 &end
#
#   50 MET  ME           62 VAL  HN          5.50    (#    880:10  Unique         3.44, 4.84 A)
 &rst
  ixpk= 880, nxpk= 10, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 760, 761, 762,
 &end
#
#   50 MET  HB+          62 VAL  HN          5.50    (#    881:10  Unique         3.37, 4.43 A)
 &rst
  ixpk= 881, nxpk= 10, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 753, 754,
 &end
#
#   62 VAL  MGY          62 VAL  HN          3.50    (#    882:10  Unique         2.56, 4.17 A)
 &rst
  ixpk= 882, nxpk= 10, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 952, 953, 954, 956, 957, 958,
 &end
#
#    0 AMB  10-2:883    114 ASN  HD2-        5.50    (#    883:10  Single Ambig)
 &rst
  ixpk= 883, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1758,  52,
 igr2=1743,1744,
 &end
#
#  114 ASN  HN          114 ASN  HD2-        5.50    (#    884:10  Unique         4.61, 5.26 A)
 &rst
  ixpk= 884, nxpk= 10, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1743,1744,
 &end
#
#    0 AMB  10-2:885    114 ASN  HD2-        4.50    (#    885:10  Single Ambig)
 &rst
  ixpk= 885, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1736,1769,
 igr2=1743,1744,
 &end
#
#  114 ASN  HB-         114 ASN  HD2-        4.50    (#    886:10  Unique         2.21, 3.14 A)
 &rst
  ixpk= 886, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1738,1739,
 igr2=1743,1744,
 &end
#
#  114 ASN  HB+         114 ASN  HD2-        3.50    (#    887:10  Unique         2.21, 3.14 A)
 &rst
  ixpk= 887, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1738,1739,
 igr2=1743,1744,
 &end
#
#    0 AMB  10-2:888    114 ASN  HD2-        6.50    (#    888:10  Single Ambig)
 &rst
  ixpk= 888, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1793,1794,1793,1794,1195,1196,
 igr2=1743,1744,
 &end
#
#    9 ALA  MB          114 ASN  HD2-        3.50    (#    889:10  Unique         2.14, 3.83 A)
 &rst
  ixpk= 889, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 130, 131, 132,
 igr2=1743,1744,
 &end
#
#  117 THR  MG2         114 ASN  HD2-        4.50    (#    890:10  Unique         2.46, 4.37 A)
 &rst
  ixpk= 890, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1771,1772,1773,
 igr2=1743,1744,
 &end
#
#  121 LEU  MDY         114 ASN  HD2-        4.50    (#    891:10  Unique         2.70, 5.86 A)
 &rst
  ixpk= 891, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1824,1825,1826,1828,1829,1830,
 igr2=1743,1744,
 &end
#
#  121 LEU  HG          114 ASN  HD2-        5.50    (#    892:10  Unique         4.10, 5.71 A)
 &rst
  ixpk= 892, nxpk= 10, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1743,1744,
 &end
#
#   74 ASN  HN           47 TRP  HN          4.50    (#    893:10  Unique         2.31, 2.83 A)
 &rst
  ixpk= 893, nxpk= 10, iat=1114, 682, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   46 ALA  HN           47 TRP  HN          5.50    (#    894:10  Unique         2.33, 4.35 A)
 &rst
  ixpk= 894, nxpk= 10, iat= 672, 682, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 TRP  HA           47 TRP  HN          4.50    (#    895:10  Unique         2.62, 2.95 A)
 &rst
  ixpk= 895, nxpk= 10, iat= 684, 682, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   46 ALA  HA           47 TRP  HN          3.50    (#    896:10  Unique         2.18, 2.37 A)
 &rst
  ixpk= 896, nxpk= 10, iat= 674, 682, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 TRP  HB+          47 TRP  HN          4.50    (#    897:10  Unique         2.45, 3.45 A)
 &rst
  ixpk= 897, nxpk= 10, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 686, 687,
 &end
#
#   46 ALA  MB           47 TRP  HN          3.50    (#    898:10  Unique         2.19, 3.41 A)
 &rst
  ixpk= 898, nxpk= 10, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 676, 677, 678,
 &end
#
#    0 AMB  10-2:900      0 AMB  10-1:900    4.50    (#    900:10  Double Ambig)
 &rst
  ixpk= 900, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1758,1779,
 igr2=1743,1744,1743,1744,
 &end
#
#  114 ASN  HN          114 ASN  HD2+        5.50    (#    901:10  Unique         4.61, 5.26 A)
 &rst
  ixpk= 901, nxpk= 10, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1743,1744,
 &end
#
#    0 AMB  10-2:902      0 AMB  10-1:902    4.50    (#    902:10  Double Ambig)
 &rst
  ixpk= 902, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1736,1769,
 igr2=1743,1744,1743,1744,
 &end
#
#  114 ASN  HB-         114 ASN  HD2+        4.50    (#    903:10  Unique         2.21, 3.14 A)
 &rst
  ixpk= 903, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1738,1739,
 igr2=1743,1744,
 &end
#
#  114 ASN  HB+         114 ASN  HD2+        3.50    (#    904:10  Unique         2.21, 3.14 A)
 &rst
  ixpk= 904, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1738,1739,
 igr2=1743,1744,
 &end
#
#    9 ALA  MB          114 ASN  HD2+        3.50    (#    905:10  Unique         2.14, 3.83 A)
 &rst
  ixpk= 905, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 130, 131, 132,
 igr2=1743,1744,
 &end
#
#  117 THR  MG2         114 ASN  HD2+        4.50    (#    906:10  Unique         2.46, 4.37 A)
 &rst
  ixpk= 906, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1771,1772,1773,
 igr2=1743,1744,
 &end
#
#  121 LEU  MDY         114 ASN  HD2+        5.50    (#    907:10  Unique         2.70, 5.86 A)
 &rst
  ixpk= 907, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1824,1825,1826,1828,1829,1830,
 igr2=1743,1744,
 &end
#
#  121 LEU  HG          114 ASN  HD2+        5.50    (#    908:10  Unique         4.10, 5.71 A)
 &rst
  ixpk= 908, nxpk= 10, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1743,1744,
 &end
#
#    0 AMB  10-2:912      0 AMB  10-1:912    3.50    (#    912:10  Double Ambig)
 &rst
  ixpk= 912, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1581,1582,1559,1560,
 igr2=1586,1587,1586,1587,
 &end
#
#  104 GLN  HG-         104 GLN  HE2+        3.50    (#    913:10  Unique         2.12, 3.36 A)
 &rst
  ixpk= 913, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1581,1582,
 igr2=1586,1587,
 &end
#
#  104 GLN  HB-         104 GLN  HE2+        4.50    (#    914:10  Unique         2.47, 3.81 A)
 &rst
  ixpk= 914, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1578,1579,
 igr2=1586,1587,
 &end
#
#  100 LEU  HG          104 GLN  HE2+        5.50    (#    915:10  Unique         3.35, 4.95 A)
 &rst
  ixpk= 915, nxpk= 10, iat=1533,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1586,1587,
 &end
#
#    0 AMB  10-2:916    104 GLN  HE2-        3.50    (#    916:10  Single Ambig)
 &rst
  ixpk= 916, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1581,1582,1559,1560,
 igr2=1586,1587,
 &end
#
#  104 GLN  HG-         104 GLN  HE2-        4.50    (#    917:10  Unique         2.12, 3.36 A)
 &rst
  ixpk= 917, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1581,1582,
 igr2=1586,1587,
 &end
#
#  104 GLN  HB-         104 GLN  HE2-        4.50    (#    918:10  Unique         2.47, 3.81 A)
 &rst
  ixpk= 918, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1578,1579,
 igr2=1586,1587,
 &end
#
#  100 LEU  HG          104 GLN  HE2-        5.50    (#    919:10  Unique         3.35, 4.95 A)
 &rst
  ixpk= 919, nxpk= 10, iat=1533,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1586,1587,
 &end
#
#   10 ASN  HB-          10 ASN  HD2-        3.50    (#    920:10  Unique         2.17, 3.29 A)
 &rst
  ixpk= 920, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 140, 141,
 igr2= 145, 146,
 &end
#
#  121 LEU  MDY          10 ASN  HD2-        4.50    (#    921:10  Unique         1.93, 5.11 A)
 &rst
  ixpk= 921, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1824,1825,1826,1828,1829,1830,
 igr2= 145, 146,
 &end
#
#    0 AMB  10-2:923     73 GLN  HE2-        4.50    (#    923:10  Single Ambig)
 &rst
  ixpk= 923, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1104,1105,1104,1105,
 igr2=1109,1110,
 &end
#
#   46 ALA  MB           73 GLN  HE2-        5.50    (#    924:10  Unique         5.88, 7.44 A)
 &rst
  ixpk= 924, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 676, 677, 678,
 igr2=1109,1110,
 &end
#
#    0 AMB  10-2:925     65 GLN  HE2-        3.50    (#    925:10  Single Ambig)
 &rst
  ixpk= 925, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 969, 970,1002,1003,
 igr2=1007,1008,
 &end
#
#   73 GLN  HG-          65 GLN  HE2-        6.50    (#    926:10  Unique         2.41, 5.81 A)
 &rst
  ixpk= 926, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1104,1105,
 igr2=1007,1008,
 &end
#
#    0 AMB  10-2:927     65 GLN  HE2-        6.50    (#    927:10  Single Ambig)
 &rst
  ixpk= 927, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1043,1044,1045,1053,1054,1055,
 igr2=1007,1008,
 &end
#
#   65 GLN  HB+          65 GLN  HE2-        5.50    (#    928:10  Unique         2.38, 4.38 A)
 &rst
  ixpk= 928, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 999,1000,
 igr2=1007,1008,
 &end
#
#   94 GLN  HG-          94 GLN  HE2+        4.50    (#    929:10  Unique         2.23, 3.37 A)
 &rst
  ixpk= 929, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1434,1435,
 igr2=1439,1440,
 &end
#
#   94 GLN  HG+          94 GLN  HE2+        3.50    (#    930:10  Unique         2.23, 3.37 A)
 &rst
  ixpk= 930, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1434,1435,
 igr2=1439,1440,
 &end
#
#   52 PRO  HA           53 GLY  HN          3.50    (#    932:10  Unique         2.14, 2.30 A)
 &rst
  ixpk= 932, nxpk= 10, iat= 792, 796, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 VAL  MGY          53 GLY  HN          5.50    (#    935:10  Unique         3.12, 5.95 A)
 &rst
  ixpk= 935, nxpk= 10, iat=  -1, 796, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 952, 953, 954, 956, 957, 958,
 &end
#
#   89 PRO  HA           96 GLN  HE2+        4.50    (#    936:10  Unique         3.03, 4.18 A)
 &rst
  ixpk= 936, nxpk= 10, iat=1374,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1470,1471,
 &end
#
#    0 AMB  10-2:937      0 AMB  10-1:937    4.50    (#    937:10  Double Ambig)
 &rst
  ixpk= 937, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1465,1466,1465,1466,
 igr2=1470,1471,1470,1471,
 &end
#
#   94 GLN  HG-          96 GLN  HE2+        5.50    (#    938:10  Unique         3.64, 5.73 A)
 &rst
  ixpk= 938, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1434,1435,
 igr2=1470,1471,
 &end
#
#    0 AMB  10-2:939      0 AMB  10-1:939    5.50    (#    939:10  Double Ambig)
 &rst
  ixpk= 939, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1295,1296,1692,1693, 532, 533,
 igr2=1303,1304, 540, 541,
 &end
#
#   90 ASP  HN           96 GLN  HE2-        4.50    (#    941:10  Unique         2.07, 2.83 A)
 &rst
  ixpk= 941, nxpk= 10, iat=1378,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1470,1471,
 &end
#
#   42 PHE  HN           96 GLN  HE2-        5.50    (#    942:10  Unique         3.12, 3.96 A)
 &rst
  ixpk= 942, nxpk= 10, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1470,1471,
 &end
#
#   89 PRO  HA           96 GLN  HE2-        4.50    (#    943:10  Unique         3.03, 4.18 A)
 &rst
  ixpk= 943, nxpk= 10, iat=1374,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1470,1471,
 &end
#
#    0 AMB  10-2:944     96 GLN  HE2-        4.50    (#    944:10  Single Ambig)
 &rst
  ixpk= 944, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1465,1466,1465,1466,
 igr2=1470,1471,
 &end
#
#   94 GLN  HG-          96 GLN  HE2-        4.50    (#    945:10  Unique         3.64, 5.73 A)
 &rst
  ixpk= 945, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1434,1435,
 igr2=1470,1471,
 &end
#
#  130 TRP  HZ2         130 TRP  HE1         3.50    (#    952:10  Unique         2.88, 2.90 A)
 &rst
  ixpk= 952, nxpk= 10, iat=1955,1952, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  130 TRP  HD1         130 TRP  HE1         2.80    (#    953:10  Unique         2.56, 2.57 A)
 &rst
  ixpk= 953, nxpk= 10, iat=1950,1952, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:954    130 TRP  HE1         4.50    (#    954:10  Single Ambig)
 &rst
  ixpk= 954, nxpk= 10, iat=  -1,1952, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1946,1947,1946,1947,
 &end
#
#  131 PRO  HG+         130 TRP  HE1         4.50    (#    955:10  Unique         3.40, 5.10 A)
 &rst
  ixpk= 955, nxpk= 10, iat=  -1,1952, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1970,1971,
 &end
#
#  131 PRO  HB+         130 TRP  HE1         6.50    (#    956:10  Unique         3.55, 5.02 A)
 &rst
  ixpk= 956, nxpk= 10, iat=  -1,1952, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1973,1974,
 &end
#
#   25 GLU  HG-         130 TRP  HE1         6.50    (#    958:10  Unique         3.97, 5.58 A)
 &rst
  ixpk= 958, nxpk= 10, iat=  -1,1952, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 375, 376,
 &end
#
#  116 GLY  HN          115 ALA  HN          3.50    (#    959:10  Unique         2.73, 2.84 A)
 &rst
  ixpk= 959, nxpk= 10, iat=1758,1748, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:960    115 ALA  HN          4.50    (#    960:10  Single Ambig)
 &rst
  ixpk= 960, nxpk= 10, iat=  -1,1748, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1206,1743,1744,
 &end
#
#  117 THR  HN          115 ALA  HN          5.50    (#    962:10  Unique         4.37, 4.67 A)
 &rst
  ixpk= 962, nxpk= 10, iat=1765,1748, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  117 THR  HN          115 ALA  HN          5.50    (#    964:10  Unique         4.37, 4.67 A)
 &rst
  ixpk= 964, nxpk= 10, iat=1765,1748, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 ALA  MB          115 ALA  HN          4.50    (#    965:10  Unique         3.47, 4.11 A)
 &rst
  ixpk= 965, nxpk= 10, iat=  -1,1748, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 130, 131, 132,
 &end
#
#   80 LEU  HB-         115 ALA  HN          5.50    (#    966:10  Unique         4.73, 5.49 A)
 &rst
  ixpk= 966, nxpk= 10, iat=  -1,1748, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1210,1211,
 &end
#
#   98 VAL  HN           99 ILE  HN          4.50    (#    967:10  Unique         4.32, 4.40 A)
 &rst
  ixpk= 967, nxpk= 10, iat=1491,1507, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:968     99 ILE  HN          6.50    (#    968:10  Single Ambig)
 &rst
  ixpk= 968, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1477, 792,
 &end
#
#    0 AMB  10-2:971     99 ILE  HN          4.50    (#    971:10  Single Ambig)
 &rst
  ixpk= 971, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 552, 553,1601,1602,1601,1602,
 &end
#
#    0 AMB  10-2:972     99 ILE  HN          6.50    (#    972:10  Single Ambig)
 &rst
  ixpk= 972, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1530,1531, 786, 787,
 &end
#
#    0 AMB  10-2:973     99 ILE  HN          5.50    (#    973:10  Single Ambig)
 &rst
  ixpk= 973, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1448,1449, 595, 596, 597, 425, 426, 427,
 &end
#
#   61 TRP  HH2          61 TRP  HE1         5.50    (#    974:10  Unique         5.06, 5.09 A)
 &rst
  ixpk= 974, nxpk= 10, iat= 937, 932, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   85 GLN  HN           84 LEU  HN          5.50    (#    976:10  Unique         4.29, 4.46 A)
 &rst
  ixpk= 976, nxpk= 10, iat=1291,1272, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 THR  HA          111 LEU  HN          5.50    (#    978:10  Unique         4.70, 4.81 A)
 &rst
  ixpk= 978, nxpk= 10, iat=1855,1688, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ILE  HA          111 LEU  HN          5.50    (#    979:10  Unique         4.55, 4.76 A)
 &rst
  ixpk= 979, nxpk= 10, iat=1238,1688, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 LEU  HB+          83 HIS  HN          5.50    (#    980:10  Unique         3.05, 4.22 A)
 &rst
  ixpk= 980, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1692,1693,
 &end
#
#   32 THR  HN           31 ALA  HN          3.50    (#    981:10  Unique         2.70, 2.76 A)
 &rst
  ixpk= 981, nxpk= 10, iat= 477, 467, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 ARG  HD+          31 ALA  HN          6.50    (#    982:10  Unique         5.00, 5.80 A)
 &rst
  ixpk= 982, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 453, 454,
 &end
#
#    0 AMB  10-2:984     31 ALA  HN          4.50    (#    984:10  Single Ambig)
 &rst
  ixpk= 984, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 406, 407, 408,1517,1518,
 &end
#
#   81 SER  HN           82 ILE  HN          4.50    (#    985:10  Unique         4.20, 4.34 A)
 &rst
  ixpk= 985, nxpk= 10, iat=1225,1236, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  127 SER  HN          126 CYS  HN          5.50    (#    986:10  Unique         4.38, 4.45 A)
 &rst
  ixpk= 986, nxpk= 10, iat=1913,1902, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  108 PHE  HE          126 CYS  HN          6.50    (#    987:10  Unique         5.13, 5.84 A)
 &rst
  ixpk= 987, nxpk= 10, iat=  -1,1902, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1648,1652,
 &end
#
#  108 PHE  HD          126 CYS  HN          5.50    (#    988:10  Unique         4.26, 5.19 A)
 &rst
  ixpk= 988, nxpk= 10, iat=  -1,1902, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1646,1654,
 &end
#
#    0 AMB  10-2:990     98 VAL  HN          5.50    (#    990:10  Single Ambig)
 &rst
  ixpk= 990, nxpk= 10, iat=  -1,1491, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1646,1654,1475,
 &end
#
#  105 ILE  HA           98 VAL  HN          5.50    (#    991:10  Unique         4.69, 4.85 A)
 &rst
  ixpk= 991, nxpk= 10, iat=1593,1491, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 THR  HA           98 VAL  HN          6.50    (#    992:10  Unique         4.53, 4.76 A)
 &rst
  ixpk= 992, nxpk= 10, iat=1612,1491, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  105 ILE  QG2          98 VAL  HN          5.50    (#    994:10  Unique         3.76, 4.56 A)
 &rst
  ixpk= 994, nxpk= 10, iat=  -1,1491, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1597,1598,1599,
 &end
#
#   47 TRP  HN           46 ALA  HN          5.50    (#    995:10  Unique         2.33, 4.35 A)
 &rst
  ixpk= 995, nxpk= 10, iat= 682, 672, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 TRP  HA           46 ALA  HN          6.50    (#    997:10  Unique         4.10, 4.97 A)
 &rst
  ixpk= 997, nxpk= 10, iat= 684, 672, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   43 SER  HA           46 ALA  HN          6.50    (#    998:10  Unique         4.59, 4.72 A)
 &rst
  ixpk= 998, nxpk= 10, iat= 640, 672, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  126 CYS  HN          127 SER  HN          5.50    (#    999:10  Unique         4.38, 4.45 A)
 &rst
  ixpk= 999, nxpk= 10, iat=1902,1913, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  132 LEU  MDY         127 SER  HN          6.50    (#   1000:10  Unique         5.17, 6.41 A)
 &rst
  ixpk= 1000, nxpk= 10, iat=  -1,1913, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#   50 MET  HG+          50 MET  HN          4.50    (#   1001:10  Unique         3.05, 3.65 A)
 &rst
  ixpk= 1001, nxpk= 10, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 756, 757,
 &end
#
#  138 ARG  HN          137 ALA  HN          4.50    (#   1002:10  Unique         3.18, 3.69 A)
 &rst
  ixpk= 1002, nxpk= 10, iat=2071,2061, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  136 LEU  HB-         137 ALA  HN          4.50    (#   1004:10  Unique         2.59, 3.68 A)
 &rst
  ixpk= 1004, nxpk= 10, iat=  -1,2061, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2046,2047,
 &end
#
#  135 THR  HN          134 GLN  HN          4.50    (#   1005:10  Unique         3.94, 4.31 A)
 &rst
  ixpk= 1005, nxpk= 10, iat=2028,2011, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  133 ASP  HN          134 GLN  HN          4.50    (#   1006:10  Unique         4.50, 4.55 A)
 &rst
  ixpk= 1006, nxpk= 10, iat=1999,2011, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  124 LEU  HA          134 GLN  HN          5.50    (#   1007:10  Unique         4.49, 4.69 A)
 &rst
  ixpk= 1007, nxpk= 10, iat=1869,2011, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  132 LEU  HA          134 GLN  HN          6.50    (#   1008:10  Unique         5.86, 6.30 A)
 &rst
  ixpk= 1008, nxpk= 10, iat=1982,2011, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  105 ILE  HA          106 THR  HN          3.50    (#   1010:10  Unique         2.22, 2.31 A)
 &rst
  ixpk= 1010, nxpk= 10, iat=1593,1610, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   99 ILE  HA          106 THR  HN          4.50    (#   1011:10  Unique         3.60, 3.86 A)
 &rst
  ixpk= 1011, nxpk= 10, iat=1509,1610, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1012   106 THR  HN          4.50    (#   1012:10  Single Ambig)
 &rst
  ixpk= 1012, nxpk= 10, iat=  -1,1610, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1601,1602,1601,1602,
 &end
#
#   12 ARG  HN           13 ALA  HN          3.50    (#   1013:10  Unique         2.72, 2.81 A)
 &rst
  ixpk= 1013, nxpk= 10, iat= 164, 188, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   16 THR  HN           17 ALA  HN          3.50    (#   1014:10  Unique         2.57, 2.80 A)
 &rst
  ixpk= 1014, nxpk= 10, iat= 237, 251, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   15 GLU  HB-          17 ALA  HN          5.50    (#   1015:10  Unique         4.88, 5.28 A)
 &rst
  ixpk= 1015, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 226, 227,
 &end
#
#    0 AMB  10-2:1016    17 ALA  HN          5.50    (#   1016:10  Single Ambig)
 &rst
  ixpk= 1016, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 202, 203, 202, 203,2018,2019,
 &end
#
#  112 MET  ME           17 ALA  HN          4.50    (#   1017:10  Unique         2.55, 3.98 A)
 &rst
  ixpk= 1017, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1718,1719,1720,
 &end
#
#   80 LEU  HN           78 GLU  HN          5.50    (#   1018:10  Unique         3.31, 4.23 A)
 &rst
  ixpk= 1018, nxpk= 10, iat=1206,1176, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 ARG  HD-          78 GLU  HN          5.50    (#   1019:10  Unique         2.50, 4.81 A)
 &rst
  ixpk= 1019, nxpk= 10, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 174, 175,
 &end
#
#  105 ILE  HN          130 TRP  HN          5.50    (#   1020:10  Unique         4.12, 4.33 A)
 &rst
  ixpk= 1020, nxpk= 10, iat=1591,1942, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 ILE  QG2         130 TRP  HN          5.50    (#   1023:10  Unique         5.75, 6.39 A)
 &rst
  ixpk= 1023, nxpk= 10, iat=  -1,1942, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1597,1598,1599,
 &end
#
#  105 ILE  HB          130 TRP  HN          5.50    (#   1024:10  Unique         4.04, 4.64 A)
 &rst
  ixpk= 1024, nxpk= 10, iat=1595,1942, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  113 ALA  HN          112 MET  HN          5.50    (#   1028:10  Unique         4.07, 4.32 A)
 &rst
  ixpk= 1028, nxpk= 10, iat=1724,1707, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 LEU  HN          112 MET  HN          4.50    (#   1029:10  Unique         4.42, 4.51 A)
 &rst
  ixpk= 1029, nxpk= 10, iat=1688,1707, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   67 ASP  HN           68 ALA  HN          5.50    (#   1030:10  Unique         2.02, 2.52 A)
 &rst
  ixpk= 1030, nxpk= 10, iat=1027,1039, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1032    68 ALA  HN          4.50    (#   1032:10  Single Ambig)
 &rst
  ixpk= 1032, nxpk= 10, iat=  -1,1039, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1049,1059,
 &end
#
#    8 VAL  MGX           9 ALA  HN          4.50    (#   1034:10  Unique         3.32, 4.70 A)
 &rst
  ixpk= 1034, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#    0 AMB  10-2:1035     9 ALA  HN          4.50    (#   1035:10  Single Ambig)
 &rst
  ixpk= 1035, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1195,1196,  63,  64,
 &end
#
#   79 GLU  HG-           9 ALA  HN          5.50    (#   1036:10  Unique         2.64, 4.01 A)
 &rst
  ixpk= 1036, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1198,1199,
 &end
#
#    8 VAL  HN            9 ALA  HN          3.50    (#   1037:10  Unique         2.12, 2.77 A)
 &rst
  ixpk= 1037, nxpk= 10, iat= 110, 126, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  106 THR  MG2         105 ILE  HN          6.50    (#   1039:10  Unique         6.15, 7.20 A)
 &rst
  ixpk= 1039, nxpk= 10, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1616,1617,1618,
 &end
#
#    0 AMB  10-2:1041     8 VAL  HN          6.50    (#   1041:10  Single Ambig)
 &rst
  ixpk= 1041, nxpk= 10, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 154,1736,
 &end
#
#    7 ASP  HB-           8 VAL  HN          4.50    (#   1042:10  Unique         2.02, 4.13 A)
 &rst
  ixpk= 1042, nxpk= 10, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 102, 103,
 &end
#
#    9 ALA  MB            8 VAL  HN          5.50    (#   1043:10  Unique         4.02, 5.36 A)
 &rst
  ixpk= 1043, nxpk= 10, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 130, 131, 132,
 &end
#
#    0 AMB  10-2:1044   100 LEU  HN          6.50    (#   1044:10  Single Ambig)
 &rst
  ixpk= 1044, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1= 414, 546, 547,
 &end
#
#   37 PRO  HB-         100 LEU  HN          6.50    (#   1045:10  Unique         4.27, 5.45 A)
 &rst
  ixpk= 1045, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 552, 553,
 &end
#
#    0 AMB  10-2:1046   100 LEU  HN          5.50    (#   1046:10  Single Ambig)
 &rst
  ixpk= 1046, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1601,1602,1601,1602,
 &end
#
#   42 PHE  HD           96 GLN  HN          5.50    (#   1047:10  Unique         3.30, 5.76 A)
 &rst
  ixpk= 1047, nxpk= 10, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 634,
 &end
#
#   41 HIS  HB+          96 GLN  HN          5.50    (#   1048:10  Unique         3.60, 4.51 A)
 &rst
  ixpk= 1048, nxpk= 10, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 605, 606,
 &end
#
#  117 THR  HN          119 GLU  HN          4.50    (#   1049:10  Unique         3.68, 3.87 A)
 &rst
  ixpk= 1049, nxpk= 10, iat=1765,1786, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 ALA  HN           23 ALA  HN          6.50    (#   1050:10  Unique         5.96, 6.03 A)
 &rst
  ixpk= 1050, nxpk= 10, iat= 402, 339, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   25 GLU  HN           23 ALA  HN          5.50    (#   1051:10  Unique         4.03, 4.13 A)
 &rst
  ixpk= 1051, nxpk= 10, iat= 368, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 ALA  HN           23 ALA  HN          2.80    (#   1052:10  Unique         2.75, 2.78 A)
 &rst
  ixpk= 1052, nxpk= 10, iat= 329, 339, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1053    23 ALA  HN          5.50    (#   1053:10  Single Ambig)
 &rst
  ixpk= 1053, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1153, 303, 311,
 &end
#
#   76 TRP  HH2          23 ALA  HN          5.50    (#   1054:10  Unique         3.55, 4.58 A)
 &rst
  ixpk= 1054, nxpk= 10, iat=1155, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 TRP  HZ3          23 ALA  HN          6.50    (#   1055:10  Unique         4.77, 5.89 A)
 &rst
  ixpk= 1055, nxpk= 10, iat=1157, 339, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  10-2:1056    23 ALA  HN          5.50    (#   1056:10  Single Ambig)
 &rst
  ixpk= 1056, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 387, 388, 353, 354,
 &end
#
#   16 THR  HN           18 ALA  HN          5.50    (#   1057:10  Unique         4.15, 4.42 A)
 &rst
  ixpk= 1057, nxpk= 10, iat= 237, 261, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1058    69 ALA  HN          4.50    (#   1058:10  Single Ambig)
 &rst
  ixpk= 1058, nxpk= 10, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 997,1029,
 &end
#
#    0 AMB  10-2:1059    18 ALA  HN          4.50    (#   1059:10  Single Ambig)
 &rst
  ixpk= 1059, nxpk= 10, iat=  -1, 261, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 224, 239,
 &end
#
#   14 ARG  HA           18 ALA  HN          4.50    (#   1060:10  Unique         3.86, 4.16 A)
 &rst
  ixpk= 1060, nxpk= 10, iat= 200, 261, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1061    18 ALA  HN          4.50    (#   1061:10  Single Ambig)
 &rst
  ixpk= 1061, nxpk= 10, iat=  -1, 261, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 275, 276, 226, 227,
 &end
#
#   32 THR  HN           33 LEU  HN          2.80    (#   1064:10  Unique         2.46, 2.56 A)
 &rst
  ixpk= 1064, nxpk= 10, iat= 477, 491, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   31 ALA  HN           33 LEU  HN          4.50    (#   1065:10  Unique         3.99, 4.07 A)
 &rst
  ixpk= 1065, nxpk= 10, iat= 467, 491, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   35 GLY  HN           36 GLN  HN          2.80    (#   1067:10  Unique         2.55, 2.76 A)
 &rst
  ixpk= 1067, nxpk= 10, iat= 521, 528, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   30 ARG  HA           33 LEU  HN          3.50    (#   1068:10  Unique         3.15, 3.34 A)
 &rst
  ixpk= 1068, nxpk= 10, iat= 445, 491, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1069    36 GLN  HN          5.50    (#   1069:10  Single Ambig)
 &rst
  ixpk= 1069, nxpk= 10, iat=  -1, 528, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 783, 784, 546, 547,
 &end
#
#    0 AMB  10-2:1070    36 GLN  HN          6.50    (#   1070:10  Single Ambig)
 &rst
  ixpk= 1070, nxpk= 10, iat=  -1, 528, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 565, 566, 567, 569, 570, 571, 772, 773, 774, 776,
       777, 778,
 &end
#
#  110 LEU  HN          125 VAL  HN          5.50    (#   1071:10  Unique         4.72, 4.83 A)
 &rst
  ixpk= 1071, nxpk= 10, iat=1669,1886, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  133 ASP  HN          125 VAL  HN          4.50    (#   1072:10  Unique         2.61, 2.69 A)
 &rst
  ixpk= 1072, nxpk= 10, iat=1999,1886, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1073   125 VAL  HN          5.50    (#   1073:10  Single Ambig)
 &rst
  ixpk= 1073, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1660,1904,
 &end
#
#  132 LEU  HA          125 VAL  HN          5.50    (#   1074:10  Unique         3.92, 4.48 A)
 &rst
  ixpk= 1074, nxpk= 10, iat=1982,1886, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1075   125 VAL  HN          5.50    (#   1075:10  Single Ambig)
 &rst
  ixpk= 1075, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2015,2016,2018,2019,1906,1907,
 &end
#
#  132 LEU  HB-         125 VAL  HN          5.50    (#   1076:10  Unique         2.56, 3.80 A)
 &rst
  ixpk= 1076, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1984,1985,
 &end
#
#  132 LEU  MDX         125 VAL  HN          4.50    (#   1077:10  Unique         2.77, 5.11 A)
 &rst
  ixpk= 1077, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1989,1990,1991,1993,1994,1995,
 &end
#
#   59 TRP  HA           60 ARG  HN          3.50    (#   1078:10  Unique         2.12, 2.36 A)
 &rst
  ixpk= 1078, nxpk= 10, iat= 876, 898, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 TRP  HB-          60 ARG  HN          4.50    (#   1079:10  Unique         2.60, 4.18 A)
 &rst
  ixpk= 1079, nxpk= 10, iat=  -1, 898, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 878, 879,
 &end
#
#   47 TRP  HN           74 ASN  HN          4.50    (#   1081:10  Unique         2.31, 2.83 A)
 &rst
  ixpk= 1081, nxpk= 10, iat= 682,1114, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   48 ARG  HA           74 ASN  HN          5.50    (#   1083:10  Unique         3.55, 4.03 A)
 &rst
  ixpk= 1083, nxpk= 10, iat= 708,1114, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ALA  HN           15 GLU  HN          5.50    (#   1086:10  Unique         4.06, 4.15 A)
 &rst
  ixpk= 1086, nxpk= 10, iat= 251, 222, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ALA  HN           15 GLU  HN          4.50    (#   1087:10  Unique         4.03, 4.15 A)
 &rst
  ixpk= 1087, nxpk= 10, iat= 188, 222, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 ALA  HN           15 GLU  HN          5.50    (#   1088:10  Unique         4.71, 4.83 A)
 &rst
  ixpk= 1088, nxpk= 10, iat= 261, 222, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 THR  HB           15 GLU  HN          5.50    (#   1089:10  Unique         4.68, 4.86 A)
 &rst
  ixpk= 1089, nxpk= 10, iat= 241, 222, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1090    15 GLU  HN          4.50    (#   1090:10  Single Ambig)
 &rst
  ixpk= 1090, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 208, 209, 208, 209,
 &end
#
#  132 LEU  HG          133 ASP  HN          5.50    (#   1091:10  Unique         2.65, 3.29 A)
 &rst
  ixpk= 1091, nxpk= 10, iat=1987,1999, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1092   133 ASP  HN          4.50    (#   1092:10  Single Ambig)
 &rst
  ixpk= 1092, nxpk= 10, iat=  -1,1999, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1906,1907,2018,2019,2015,2016,
 &end
#
#   67 ASP  HB-          67 ASP  HN          3.50    (#   1093:10  Unique         2.37, 2.91 A)
 &rst
  ixpk= 1093, nxpk= 10, iat=  -1,1027, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1031,1032,
 &end
#
#  125 VAL  HA          133 ASP  HN          4.50    (#   1094:10  Unique         4.53, 4.60 A)
 &rst
  ixpk= 1094, nxpk= 10, iat=1888,1999, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  132 LEU  HN          133 ASP  HN          4.50    (#   1095:10  Unique         4.28, 4.47 A)
 &rst
  ixpk= 1095, nxpk= 10, iat=1980,1999, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  134 GLN  HN          133 ASP  HN          4.50    (#   1096:10  Unique         4.50, 4.55 A)
 &rst
  ixpk= 1096, nxpk= 10, iat=2011,1999, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  125 VAL  HN          133 ASP  HN          3.50    (#   1097:10  Unique         2.61, 2.69 A)
 &rst
  ixpk= 1097, nxpk= 10, iat=1886,1999, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  123 THR  HN          122 LEU  HN          4.50    (#   1099:10  Unique         4.30, 4.39 A)
 &rst
  ixpk= 1099, nxpk= 10, iat=1853,1834, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  123 THR  HA          122 LEU  HN          5.50    (#   1100:10  Unique         4.77, 4.89 A)
 &rst
  ixpk= 1100, nxpk= 10, iat=1855,1834, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1103    19 ARG  HN          4.50    (#   1103:10  Single Ambig)
 &rst
  ixpk= 1103, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 281, 282, 281, 282,
 &end
#
#    0 AMB  10-2:1106    25 GLU  HN          4.50    (#   1106:10  Single Ambig)
 &rst
  ixpk= 1106, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 375, 376, 422, 423,
 &end
#
#  130 TRP  HZ3          25 GLU  HN          5.50    (#   1107:10  Unique         2.66, 2.94 A)
 &rst
  ixpk= 1107, nxpk= 10, iat=1959, 368, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HH2          25 GLU  HN          5.50    (#   1108:10  Unique         3.34, 3.41 A)
 &rst
  ixpk= 1108, nxpk= 10, iat=1957, 368, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ALA  HN           19 ARG  HN          4.50    (#   1109:10  Unique         4.00, 4.16 A)
 &rst
  ixpk= 1109, nxpk= 10, iat= 251, 271, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  134 GLN  HE2+         19 ARG  HN          6.50    (#   1110:10  Unique         6.59, 7.42 A)
 &rst
  ixpk= 1110, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=2023,2024,
 &end
#
#   17 ALA  HA           19 ARG  HN          4.50    (#   1111:10  Unique         4.41, 4.51 A)
 &rst
  ixpk= 1111, nxpk= 10, iat= 253, 271, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   20 PHE  HB+          19 ARG  HN          5.50    (#   1113:10  Unique         4.65, 5.12 A)
 &rst
  ixpk= 1113, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 299, 300,
 &end
#
#   37 PRO  HA          101 ALA  HN          4.50    (#   1114:10  Unique         3.52, 3.97 A)
 &rst
  ixpk= 1114, nxpk= 10, iat= 555,1545, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   32 THR  HA          101 ALA  HN          6.50    (#   1115:10  Unique         4.83, 5.21 A)
 &rst
  ixpk= 1115, nxpk= 10, iat= 479,1545, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   37 PRO  HB-         101 ALA  HN          5.50    (#   1116:10  Unique         4.34, 5.58 A)
 &rst
  ixpk= 1116, nxpk= 10, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 552, 553,
 &end
#
#   37 PRO  HG+         101 ALA  HN          4.50    (#   1117:10  Unique         2.88, 4.75 A)
 &rst
  ixpk= 1117, nxpk= 10, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 549, 550,
 &end
#
#   99 ILE  QG2         101 ALA  HN          5.50    (#   1118:10  Unique         4.96, 6.15 A)
 &rst
  ixpk= 1118, nxpk= 10, iat=  -1,1545, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1513,1514,1515,
 &end
#
#    0 AMB  10-2:1120    12 ARG  HN          5.50    (#   1120:10  Single Ambig)
 &rst
  ixpk= 1120, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 114,1180,1181,
 &end
#
#    0 AMB  10-2:1121    12 ARG  HN          4.50    (#   1121:10  Single Ambig)
 &rst
  ixpk= 1121, nxpk= 10, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 226, 227,1198,1199,1183,1184,
 &end
#
#   13 ALA  HN           12 ARG  HN          3.50    (#   1123:10  Unique         2.72, 2.81 A)
 &rst
  ixpk= 1123, nxpk= 10, iat= 188, 164, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 HIS  HN           40 ILE  HN          5.50    (#   1124:10  Unique         4.18, 4.27 A)
 &rst
  ixpk= 1124, nxpk= 10, iat= 601, 582, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1125    40 ILE  HN          5.50    (#   1125:10  Single Ambig)
 &rst
  ixpk= 1125, nxpk= 10, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 628, 632, 889,
 &end
#
#   95 PRO  HB-          40 ILE  HN          3.50    (#   1126:10  Unique         2.22, 2.79 A)
 &rst
  ixpk= 1126, nxpk= 10, iat=  -1, 582, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1451,1452,
 &end
#
#  113 ALA  HN          114 ASN  HN          5.50    (#   1127:10  Unique         4.51, 4.55 A)
 &rst
  ixpk= 1127, nxpk= 10, iat=1724,1734, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 LEU  HN          114 ASN  HN          4.50    (#   1128:10  Unique         3.51, 4.05 A)
 &rst
  ixpk= 1128, nxpk= 10, iat=1815,1734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1129   114 ASN  HN          4.50    (#   1129:10  Single Ambig)
 &rst
  ixpk= 1129, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1779,1758,
 &end
#
#  114 ASN  HD2-        114 ASN  HN          4.50    (#   1130:10  Unique         4.61, 5.26 A)
 &rst
  ixpk= 1130, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1743,1744,
 &end
#
#  117 THR  HN          114 ASN  HN          6.50    (#   1131:10  Unique         4.90, 5.16 A)
 &rst
  ixpk= 1131, nxpk= 10, iat=1765,1734, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  118 GLY  HA+         114 ASN  HN          5.50    (#   1133:10  Unique         5.78,10.30 A)
 &rst
  ixpk= 1133, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1781,1782,
 &end
#
#   41 HIS  HD2          92 SER  HN          5.50    (#   1134:10  Unique         2.44, 2.79 A)
 &rst
  ixpk= 1134, nxpk= 10, iat= 614,1402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 LEU  HA          121 LEU  HN          3.50    (#   1136:10  Unique         2.96, 3.00 A)
 &rst
  ixpk= 1136, nxpk= 10, iat=1817,1815, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 ASP  HB+          92 SER  HN          4.50    (#   1137:10  Unique         3.94, 4.50 A)
 &rst
  ixpk= 1137, nxpk= 10, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1394,1395,
 &end
#
#  102 ASP  HN          104 GLN  HN          4.50    (#   1138:10  Unique         3.32, 3.50 A)
 &rst
  ixpk= 1138, nxpk= 10, iat=1555,1574, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   59 TRP  HD1          59 TRP  HN          5.50    (#   1139:10  Unique         4.48, 4.69 A)
 &rst
  ixpk= 1139, nxpk= 10, iat= 882, 874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 TRP  HB-          59 TRP  HN          4.50    (#   1141:10  Unique         2.18, 2.70 A)
 &rst
  ixpk= 1141, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 878, 879,
 &end
#
#   99 ILE  QG2         104 GLN  HN          4.50    (#   1143:10  Unique         5.00, 5.63 A)
 &rst
  ixpk= 1143, nxpk= 10, iat=  -1,1574, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1513,1514,1515,
 &end
#
#   27 ALA  HA           30 ARG  HN          3.50    (#   1144:10  Unique         3.23, 3.37 A)
 &rst
  ixpk= 1144, nxpk= 10, iat= 404, 443, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 LEU  HA           28 ILE  HN          5.50    (#   1145:10  Unique         3.95, 4.09 A)
 &rst
  ixpk= 1145, nxpk= 10, iat= 351, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 ARG  HD-          30 ARG  HN          5.50    (#   1146:10  Unique         2.63, 4.51 A)
 &rst
  ixpk= 1146, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 453, 454,
 &end
#
#   24 LEU  HN           26 LEU  HN          5.50    (#   1149:10  Unique         4.09, 4.16 A)
 &rst
  ixpk= 1149, nxpk= 10, iat= 349, 383, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HH2          26 LEU  HN          6.50    (#   1150:10  Unique         5.48, 5.59 A)
 &rst
  ixpk= 1150, nxpk= 10, iat=1957, 383, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   22 ALA  HA           26 LEU  HN          4.50    (#   1151:10  Unique         3.91, 4.00 A)
 &rst
  ixpk= 1151, nxpk= 10, iat= 331, 383, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 LEU  HA           26 LEU  HN          3.50    (#   1152:10  Unique         2.81, 2.82 A)
 &rst
  ixpk= 1152, nxpk= 10, iat= 385, 383, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1154    26 LEU  HN          5.50    (#   1154:10  Single Ambig)
 &rst
  ixpk= 1154, nxpk= 10, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 351, 317,
 &end
#
#    0 AMB  10-2:1155    26 LEU  HN          4.50    (#   1155:10  Single Ambig)
 &rst
  ixpk= 1155, nxpk= 10, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 333, 334, 335, 416, 343, 344, 345,
 &end
#
#   85 GLN  HB-          87 PHE  HN          4.50    (#   1156:10  Unique         4.26, 5.11 A)
 &rst
  ixpk= 1156, nxpk= 10, iat=  -1,1322, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1295,1296,
 &end
#
#   93 ASN  HN           94 GLN  HN          4.50    (#   1157:10  Unique         2.54, 2.64 A)
 &rst
  ixpk= 1157, nxpk= 10, iat=1413,1427, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   41 HIS  HD2          94 GLN  HN          5.50    (#   1158:10  Unique         2.76, 4.29 A)
 &rst
  ixpk= 1158, nxpk= 10, iat= 614,1427, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   93 ASN  HB+          94 GLN  HN          5.50    (#   1160:10  Unique         3.40, 4.14 A)
 &rst
  ixpk= 1160, nxpk= 10, iat=  -1,1427, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1417,1418,
 &end
#
#    0 AMB  10-2:1161    94 GLN  HN          3.50    (#   1161:10  Single Ambig)
 &rst
  ixpk= 1161, nxpk= 10, iat=  -1,1427, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1431,1432,1431,1432,
 &end
#
#   14 ARG  HN           16 THR  HN          5.50    (#   1162:10  Unique         4.11, 4.22 A)
 &rst
  ixpk= 1162, nxpk= 10, iat= 198, 237, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   46 ALA  HN           44 ASP  HN          5.50    (#   1163:10  Unique         3.70, 4.20 A)
 &rst
  ixpk= 1163, nxpk= 10, iat= 672, 649, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   80 LEU  HA           79 GLU  HN          6.50    (#   1164:10  Unique         4.48, 4.88 A)
 &rst
  ixpk= 1164, nxpk= 10, iat=1208,1191, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    9 ALA  HA           79 GLU  HN          5.50    (#   1165:10  Unique         3.77, 4.88 A)
 &rst
  ixpk= 1165, nxpk= 10, iat= 128,1191, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 GLU  HG+          79 GLU  HN          4.50    (#   1167:10  Unique         2.36, 3.83 A)
 &rst
  ixpk= 1167, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1198,1199,
 &end
#
#   79 GLU  HB+          79 GLU  HN          3.50    (#   1168:10  Unique         2.33, 3.21 A)
 &rst
  ixpk= 1168, nxpk= 10, iat=  -1,1191, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1195,1196,
 &end
#
#    0 AMB  10-2:1169    38 VAL  HN          5.50    (#   1169:10  Single Ambig)
 &rst
  ixpk= 1169, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1545, 528, 510, 402,
 &end
#
#   61 TRP  HH2          38 VAL  HN          5.50    (#   1170:10  Unique         3.63, 3.90 A)
 &rst
  ixpk= 1170, nxpk= 10, iat= 937, 559, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 PRO  HD-          38 VAL  HN          6.50    (#   1171:10  Unique         4.86, 5.86 A)
 &rst
  ixpk= 1171, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 783, 784,
 &end
#
#    0 AMB  10-2:1172    80 LEU  HN          5.50    (#   1172:10  Single Ambig)
 &rst
  ixpk= 1172, nxpk= 10, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1180,1181,1180,1181,
 &end
#
#   82 ILE  QD1          80 LEU  HN          5.50    (#   1173:10  Unique         5.35, 6.17 A)
 &rst
  ixpk= 1173, nxpk= 10, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1249,1250,1251,
 &end
#
#   15 GLU  HG+          14 ARG  HN          6.50    (#   1174:10  Unique         4.44, 5.91 A)
 &rst
  ixpk= 1174, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 229, 230,
 &end
#
#   15 GLU  HB-          14 ARG  HN          4.50    (#   1175:10  Unique         4.59, 5.23 A)
 &rst
  ixpk= 1175, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 226, 227,
 &end
#
#    0 AMB  10-2:1177    14 ARG  HN          6.50    (#   1177:10  Single Ambig)
 &rst
  ixpk= 1177, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1213,2049, 116, 117, 118, 120, 121, 122,
 &end
#
#  130 TRP  HE3         132 LEU  HN          6.50    (#   1178:10  Unique         3.93, 4.69 A)
 &rst
  ixpk= 1178, nxpk= 10, iat=1961,1980, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  137 ALA  HN          138 ARG  HN          4.50    (#   1180:10  Unique         3.18, 3.69 A)
 &rst
  ixpk= 1180, nxpk= 10, iat=2061,2071, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1181    90 ASP  HN          6.50    (#   1181:10  Single Ambig)
 &rst
  ixpk= 1181, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 649, 638,
 &end
#
#   90 ASP  HB-          90 ASP  HN          6.50    (#   1182:10  Unique         2.57, 3.13 A)
 &rst
  ixpk= 1182, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1382,1383,
 &end
#
#    0 AMB  10-2:1185    11 THR  HN          5.50    (#   1185:10  Single Ambig)
 &rst
  ixpk= 1185, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 202, 203, 202, 203,
 &end
#
#    0 AMB  10-2:1186    11 THR  HN          5.50    (#   1186:10  Single Ambig)
 &rst
  ixpk= 1186, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 130, 131, 132, 192, 193, 194,
 &end
#
#   53 GLY  HN           62 VAL  HN          5.50    (#   1187:10  Unique         4.45, 4.82 A)
 &rst
  ixpk= 1187, nxpk= 10, iat= 796, 946, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 TRP  HN           62 VAL  HN          5.50    (#   1188:10  Unique         4.37, 4.48 A)
 &rst
  ixpk= 1188, nxpk= 10, iat= 922, 946, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   63 PRO  HD+          62 VAL  HN          5.50    (#   1189:10  Unique         4.47, 4.88 A)
 &rst
  ixpk= 1189, nxpk= 10, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 963, 964,
 &end
#
#   62 VAL  HB           62 VAL  HN          5.50    (#   1190:10  Unique         2.41, 2.85 A)
 &rst
  ixpk= 1190, nxpk= 10, iat= 950, 946, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 MET  HB-          62 VAL  HN          5.50    (#   1191:10  Unique         3.37, 4.43 A)
 &rst
  ixpk= 1191, nxpk= 10, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 753, 754,
 &end
#
#   62 VAL  MGX          62 VAL  HN          4.50    (#   1192:10  Unique         2.56, 4.17 A)
 &rst
  ixpk= 1192, nxpk= 10, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 952, 953, 954, 956, 957, 958,
 &end
#
#   47 TRP  HN           48 ARG  HN          5.50    (#   1193:10  Unique         4.37, 4.48 A)
 &rst
  ixpk= 1193, nxpk= 10, iat= 682, 706, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1194    48 ARG  HN          6.50    (#   1194:10  Single Ambig)
 &rst
  ixpk= 1194, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1= 628, 632,1155,
 &end
#
#    0 AMB  10-2:1195    48 ARG  HN          5.50    (#   1195:10  Single Ambig)
 &rst
  ixpk= 1195, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 620, 603,
 &end
#
#   48 ARG  HA           48 ARG  HN          3.50    (#   1196:10  Unique         2.84, 2.94 A)
 &rst
  ixpk= 1196, nxpk= 10, iat= 708, 706, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 TRP  HB-          48 ARG  HN          3.50    (#   1197:10  Unique         2.52, 3.39 A)
 &rst
  ixpk= 1197, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 686, 687,
 &end
#
#   41 HIS  HB-          48 ARG  HN          6.50    (#   1198:10  Unique         2.35, 4.00 A)
 &rst
  ixpk= 1198, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 605, 606,
 &end
#
#    0 AMB  10-2:1199    48 ARG  HN          6.50    (#   1199:10  Single Ambig)
 &rst
  ixpk= 1199, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 8.50, r4= 9.00,
 igr1= 676, 677, 678,1451,1452,
 &end
#
#   82 ILE  HN           81 SER  HN          4.50    (#   1200:10  Unique         4.20, 4.34 A)
 &rst
  ixpk= 1200, nxpk= 10, iat=1236,1225, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 LEU  HN           81 SER  HN          4.50    (#   1201:10  Unique         4.42, 4.49 A)
 &rst
  ixpk= 1201, nxpk= 10, iat=1206,1225, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   48 ARG  HN           47 TRP  HN          5.50    (#   1202:10  Unique         4.37, 4.48 A)
 &rst
  ixpk= 1202, nxpk= 10, iat= 706, 682, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 PHE  HE           47 TRP  HN          6.50    (#   1203:10  Unique         5.16, 7.52 A)
 &rst
  ixpk= 1203, nxpk= 10, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 628, 632,
 &end
#
#   42 PHE  HA           47 TRP  HN          5.50    (#   1204:10  Unique         4.52, 4.92 A)
 &rst
  ixpk= 1204, nxpk= 10, iat= 620, 682, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 TRP  HB-          47 TRP  HN          4.50    (#   1207:10  Unique         2.45, 3.45 A)
 &rst
  ixpk= 1207, nxpk= 10, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 686, 687,
 &end
#
#    0 AMB  10-2:1208    47 TRP  HN          4.50    (#   1208:10  Single Ambig)
 &rst
  ixpk= 1208, nxpk= 10, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1118,1119,1118,1119,
 &end
#
#  113 ALA  HA          114 ASN  HD2-        6.50    (#   1209:10  Unique         6.69, 7.42 A)
 &rst
  ixpk= 1209, nxpk= 10, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1743,1744,
 &end
#
#   87 PHE  HN           88 LYS  HN          5.50    (#   1211:10  Unique         3.49, 4.53 A)
 &rst
  ixpk= 1211, nxpk= 10, iat=1322,1342, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   96 GLN  HG-          88 LYS  HN          5.50    (#   1212:10  Unique         3.71, 4.91 A)
 &rst
  ixpk= 1212, nxpk= 10, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1465,1466,
 &end
#
#   73 GLN  HA           72 SER  HN          6.50    (#   1213:10  Unique         4.56, 5.28 A)
 &rst
  ixpk= 1213, nxpk= 10, iat=1099,1086, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   42 PHE  HE           97 VAL  HN          4.50    (#   1214:10  Unique         3.54, 6.14 A)
 &rst
  ixpk= 1214, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 628, 632,
 &end
#
#   41 HIS  HA           97 VAL  HN          4.50    (#   1215:10  Unique         3.76, 3.99 A)
 &rst
  ixpk= 1215, nxpk= 10, iat= 603,1475, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   96 GLN  HG+          97 VAL  HN          5.50    (#   1217:10  Unique         3.81, 5.08 A)
 &rst
  ixpk= 1217, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1465,1466,
 &end
#
#   94 GLN  HG-          97 VAL  HN          6.50    (#   1218:10  Unique         6.49, 7.58 A)
 &rst
  ixpk= 1218, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1434,1435,
 &end
#
#    0 AMB  10-2:1219    97 VAL  HN          5.50    (#   1219:10  Single Ambig)
 &rst
  ixpk= 1219, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 592, 593,1597,1598,1599,
 &end
#
#  126 CYS  HN          108 PHE  HN          4.50    (#   1222:10  Unique         2.68, 2.91 A)
 &rst
  ixpk= 1222, nxpk= 10, iat=1902,1638, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  108 PHE  HE          108 PHE  HN          4.50    (#   1223:10  Unique         4.61, 5.42 A)
 &rst
  ixpk= 1223, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1648,1652,
 &end
#
#  108 PHE  HB+         108 PHE  HN          4.50    (#   1225:10  Unique         3.20, 3.72 A)
 &rst
  ixpk= 1225, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1642,1643,
 &end
#
#  104 GLN  HN          104 GLN  HE2+        5.50    (#   1226:10  Unique         2.76, 4.38 A)
 &rst
  ixpk= 1226, nxpk= 10, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1586,1587,
 &end
#
#  104 GLN  HA          104 GLN  HE2+        5.50    (#   1227:10  Unique         2.94, 5.35 A)
 &rst
  ixpk= 1227, nxpk= 10, iat=1576,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1586,1587,
 &end
#
#    0 AMB  10-2:1229   104 GLN  HE2-        6.50    (#   1229:10  Single Ambig)
 &rst
  ixpk= 1229, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1935,1936,1935,1936,
 igr2=1586,1587,
 &end
#
#  104 GLN  HA          104 GLN  HE2-        5.50    (#   1230:10  Unique         2.94, 5.35 A)
 &rst
  ixpk= 1230, nxpk= 10, iat=1576,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1586,1587,
 &end
#
#   62 VAL  HN           51 VAL  HN          3.50    (#   1232:10  Unique         2.64, 2.81 A)
 &rst
  ixpk= 1232, nxpk= 10, iat= 946, 766, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1233    51 VAL  HN          4.50    (#   1233:10  Single Ambig)
 &rst
  ixpk= 1233, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 749, 575,
 &end
#
#   64 LEU  HN           51 VAL  HN          5.50    (#   1234:10  Unique         3.90, 4.20 A)
 &rst
  ixpk= 1234, nxpk= 10, iat= 976, 766, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1236    51 VAL  HN          6.50    (#   1236:10  Single Ambig)
 &rst
  ixpk= 1236, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 978, 792,
 &end
#
#   51 VAL  HB           51 VAL  HN          5.50    (#   1237:10  Unique         2.49, 3.59 A)
 &rst
  ixpk= 1237, nxpk= 10, iat= 770, 766, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 VAL  MGX          51 VAL  HN          4.50    (#   1238:10  Unique         3.10, 5.50 A)
 &rst
  ixpk= 1238, nxpk= 10, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 952, 953, 954, 956, 957, 958,
 &end
#
#  100 LEU  HN          102 ASP  HN          5.50    (#   1239:10  Unique         4.81, 4.94 A)
 &rst
  ixpk= 1239, nxpk= 10, iat=1526,1555, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 GLN  HN          102 ASP  HN          4.50    (#   1240:10  Unique         3.32, 3.50 A)
 &rst
  ixpk= 1240, nxpk= 10, iat=1574,1555, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   32 THR  HA          102 ASP  HN          6.50    (#   1241:10  Unique         5.75, 6.02 A)
 &rst
  ixpk= 1241, nxpk= 10, iat= 479,1555, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  10-2:1245     0 AMB  10-1:1245   3.50    (#   1245:10  Double Ambig)
 &rst
  ixpk= 1245, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 140, 141,1417,1418,
 igr2= 145, 146,1422,1423,
 &end
#
#   18 ALA  HN           21 THR  HN          5.50    (#   1248:10  Unique         4.64, 4.74 A)
 &rst
  ixpk= 1248, nxpk= 10, iat= 261, 315, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 ALA  HN           21 THR  HN          5.50    (#   1249:10  Unique         4.15, 4.22 A)
 &rst
  ixpk= 1249, nxpk= 10, iat= 339, 315, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ALA  HA           21 THR  HN          4.50    (#   1251:10  Unique         3.85, 3.94 A)
 &rst
  ixpk= 1251, nxpk= 10, iat= 253, 315, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1252    21 THR  HN          5.50    (#   1252:10  Single Ambig)
 &rst
  ixpk= 1252, nxpk= 10, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 353, 354,2015,2016,
 &end
#
#    0 AMB  10-2:1253    21 THR  HN          4.50    (#   1253:10  Single Ambig)
 &rst
  ixpk= 1253, nxpk= 10, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 333, 334, 335,1973,1974, 356,
 &end
#
#    0 AMB  10-2:1255     0 AMB  10-1:1255   3.50    (#   1255:10  Double Ambig)
 &rst
  ixpk= 1255, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1104,1105,1104,1105,
 igr2=1109,1110,1109,1110,
 &end
#
#   46 ALA  MB           73 GLN  HE2+        5.50    (#   1256:10  Unique         5.88, 7.44 A)
 &rst
  ixpk= 1256, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 676, 677, 678,
 igr2=1109,1110,
 &end
#
#  108 PHE  HN          109 SER  HN          5.50    (#   1257:10  Unique         4.32, 4.39 A)
 &rst
  ixpk= 1257, nxpk= 10, iat=1638,1658, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  108 PHE  HE          109 SER  HN          5.50    (#   1258:10  Unique         4.76, 6.26 A)
 &rst
  ixpk= 1258, nxpk= 10, iat=  -1,1658, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1648,1652,
 &end
#
#   84 LEU  HA          109 SER  HN          5.50    (#   1259:10  Unique         4.48, 4.67 A)
 &rst
  ixpk= 1259, nxpk= 10, iat=1274,1658, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   85 GLN  HA          109 SER  HN          6.50    (#   1260:10  Unique         4.69, 4.80 A)
 &rst
  ixpk= 1260, nxpk= 10, iat=1293,1658, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  107 PRO  HA          129 SER  HN          6.50    (#   1263:10  Unique         5.13, 5.72 A)
 &rst
  ixpk= 1263, nxpk= 10, iat=1634,1931, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  127 SER  HB-         129 SER  HN          6.50    (#   1264:10  Unique         3.83, 4.94 A)
 &rst
  ixpk= 1264, nxpk= 10, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1917,1918,
 &end
#
#  107 PRO  HG-         129 SER  HN          6.50    (#   1265:10  Unique         5.41, 6.92 A)
 &rst
  ixpk= 1265, nxpk= 10, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1628,1629,
 &end
#
#  105 ILE  QG2         129 SER  HN          5.50    (#   1266:10  Unique         5.77, 6.57 A)
 &rst
  ixpk= 1266, nxpk= 10, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1597,1598,1599,
 &end
#
#   36 GLN  HB-          35 GLY  HN          6.50    (#   1268:10  Unique         5.24, 5.70 A)
 &rst
  ixpk= 1268, nxpk= 10, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 532, 533,
 &end
#
#   33 LEU  HB+          35 GLY  HN          5.50    (#   1269:10  Unique         5.03, 5.42 A)
 &rst
  ixpk= 1269, nxpk= 10, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 495, 496,
 &end
#
#   73 GLN  HE2+         65 GLN  HE2-        5.50    (#   1271:10  Unique         3.63, 5.90 A)
 &rst
  ixpk= 1271, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1109,1110,
 igr2=1007,1008,
 &end
#
#   69 ALA  HA           65 GLN  HE2-        5.50    (#   1272:10  Unique         2.71, 8.50 A)
 &rst
  ixpk= 1272, nxpk= 10, iat=1051,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1007,1008,
 &end
#
#   35 GLY  HN           34 SER  HN          3.50    (#   1273:10  Unique         2.60, 2.72 A)
 &rst
  ixpk= 1273, nxpk= 10, iat= 521, 510, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  114 ASN  HN          118 GLY  HN          4.50    (#   1276:10  Unique         4.20, 4.39 A)
 &rst
  ixpk= 1276, nxpk= 10, iat=1734,1779, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1277   118 GLY  HN          5.50    (#   1277:10  Single Ambig)
 &rst
  ixpk= 1277, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1793,1794,1793,1794,
 &end
#
#    0 AMB  10-2:1278    85 GLN  HE2-        6.50    (#   1278:10  Single Ambig)
 &rst
  ixpk= 1278, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1660,1690,
 igr2=1303,1304,
 &end
#
#   59 TRP  HA           36 GLN  HE2-        5.50    (#   1279:10  Unique         2.60, 4.44 A)
 &rst
  ixpk= 1279, nxpk= 10, iat= 876,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 540, 541,
 &end
#
#   85 GLN  HA           85 GLN  HE2-        5.50    (#   1280:10  Unique         4.15, 4.85 A)
 &rst
  ixpk= 1280, nxpk= 10, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1303,1304,
 &end
#
#    0 AMB  10-2:1281    85 GLN  HE2-        6.50    (#   1281:10  Single Ambig)
 &rst
  ixpk= 1281, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1662,1663,1662,1663,
 igr2=1303,1304,
 &end
#
#    0 AMB  10-2:1282     0 AMB  10-1:1282   6.50    (#   1282:10  Double Ambig)
 &rst
  ixpk= 1282, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
 igr1=1371,1372, 846, 847,1805,1806,
 igr2=1303,1304, 540, 541,
 &end
#
#  105 ILE  QG2         128 GLY  HN          5.50    (#   1283:10  Unique         5.43, 6.40 A)
 &rst
  ixpk= 1283, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1597,1598,1599,
 &end
#
#   43 SER  HA           45 SER  HN          5.50    (#   1285:10  Unique         4.02, 4.31 A)
 &rst
  ixpk= 1285, nxpk= 10, iat= 640, 661, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1288     0 AMB  10-1:1288   3.50    (#   1288:10  Double Ambig)
 &rst
  ixpk= 1288, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=2018,2019,2015,2016,
 igr2=2023,2024,2023,2024,
 &end
#
#    0 AMB  10-2:1289   134 GLN  HE2-        3.50    (#   1289:10  Single Ambig)
 &rst
  ixpk= 1289, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2018,2019,2015,2016,
 igr2=2023,2024,
 &end
#
#  134 GLN  HB+         134 GLN  HE2-        4.50    (#   1290:10  Unique         2.40, 3.97 A)
 &rst
  ixpk= 1290, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2015,2016,
 igr2=2023,2024,
 &end
#
#  134 GLN  HB+         134 GLN  HE2+        4.50    (#   1291:10  Unique         2.40, 3.97 A)
 &rst
  ixpk= 1291, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2015,2016,
 igr2=2023,2024,
 &end
#
#  122 LEU  HB-         134 GLN  HE2+        4.50    (#   1292:10  Unique         4.93, 6.06 A)
 &rst
  ixpk= 1292, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1838,1839,
 igr2=2023,2024,
 &end
#
#    0 AMB  10-2:1293     0 AMB  10-1:1293   4.50    (#   1293:10  Double Ambig)
 &rst
  ixpk= 1293, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 255, 256, 257,1841,
 igr2=2023,2024,2023,2024,
 &end
#
#    0 AMB  10-2:1294   134 GLN  HE2-        4.50    (#   1294:10  Single Ambig)
 &rst
  ixpk= 1294, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 255, 256, 257,1841,
 igr2=2023,2024,
 &end
#
#  122 LEU  HB-         134 GLN  HE2-        5.50    (#   1295:10  Unique         4.93, 6.06 A)
 &rst
  ixpk= 1295, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1838,1839,
 igr2=2023,2024,
 &end
#
#  122 LEU  MDX         134 GLN  HE2+        4.50    (#   1296:10  Unique         1.86, 4.05 A)
 &rst
  ixpk= 1296, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1843,1844,1845,1847,1848,1849,
 igr2=2023,2024,
 &end
#
#  124 LEU  MDX         134 GLN  HE2+        4.50    (#   1297:10  Unique         2.77, 5.72 A)
 &rst
  ixpk= 1297, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1876,1877,1878,1880,1881,1882,
 igr2=2023,2024,
 &end
#
#  122 LEU  MDX         134 GLN  HE2-        4.50    (#   1298:10  Unique         1.86, 4.05 A)
 &rst
  ixpk= 1298, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1843,1844,1845,1847,1848,1849,
 igr2=2023,2024,
 &end
#
#  124 LEU  MDX         134 GLN  HE2-        5.50    (#   1299:10  Unique         2.77, 5.72 A)
 &rst
  ixpk= 1299, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1876,1877,1878,1880,1881,1882,
 igr2=2023,2024,
 &end
#
#  114 ASN  HN          117 THR  HN          5.50    (#   1300:10  Unique         4.90, 5.16 A)
 &rst
  ixpk= 1300, nxpk= 10, iat=1734,1765, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  114 ASN  HD2+        117 THR  HN          5.50    (#   1301:10  Unique         3.04, 3.98 A)
 &rst
  ixpk= 1301, nxpk= 10, iat=  -1,1765, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1743,1744,
 &end
#
#    7 ASP  HB-           7 ASP  HN          4.50    (#   1304:10  Unique         2.02, 2.76 A)
 &rst
  ixpk= 1304, nxpk= 10, iat=  -1,  98, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 102, 103,
 &end
#
#    0 AMB  10-2:1312    84 LEU  HN          6.50    (#   1312:10  Single Ambig)
 &rst
  ixpk= 1312, nxpk= 10, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1298,1299,1298,1299,
 &end
#
#   89 PRO  HB+          84 LEU  HN          6.50    (#   1313:10  Unique         1.92, 3.24 A)
 &rst
  ixpk= 1313, nxpk= 10, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1371,1372,
 &end
#
#  112 MET  HN          111 LEU  HN          5.50    (#   1315:10  Unique         4.42, 4.51 A)
 &rst
  ixpk= 1315, nxpk= 10, iat=1707,1688, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  128 GLY  HN          127 SER  HN          4.50    (#   1318:10  Unique         2.38, 2.58 A)
 &rst
  ixpk= 1318, nxpk= 10, iat=1924,1913, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  129 SER  HN          127 SER  HN          5.50    (#   1319:10  Unique         3.17, 3.31 A)
 &rst
  ixpk= 1319, nxpk= 10, iat=1931,1913, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 CYS  HA          127 SER  HN          3.50    (#   1320:10  Unique         2.11, 2.14 A)
 &rst
  ixpk= 1320, nxpk= 10, iat=1904,1913, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  127 SER  HA          127 SER  HN          3.50    (#   1322:10  Unique         2.94, 2.96 A)
 &rst
  ixpk= 1322, nxpk= 10, iat=1915,1913, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  127 SER  HB-         127 SER  HN          4.50    (#   1325:10  Unique         2.55, 3.20 A)
 &rst
  ixpk= 1325, nxpk= 10, iat=  -1,1913, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1917,1918,
 &end
#
#  127 SER  HB+         127 SER  HN          4.50    (#   1326:10  Unique         2.55, 3.20 A)
 &rst
  ixpk= 1326, nxpk= 10, iat=  -1,1913, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1917,1918,
 &end
#
#  126 CYS  HB-         127 SER  HN          5.50    (#   1327:10  Unique         2.73, 4.24 A)
 &rst
  ixpk= 1327, nxpk= 10, iat=  -1,1913, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1906,1907,
 &end
#
#  126 CYS  HB+         127 SER  HN          5.50    (#   1328:10  Unique         2.73, 4.24 A)
 &rst
  ixpk= 1328, nxpk= 10, iat=  -1,1913, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1906,1907,
 &end
#
#  132 LEU  HG          127 SER  HN          6.50    (#   1329:10  Unique         4.05, 4.51 A)
 &rst
  ixpk= 1329, nxpk= 10, iat=1987,1913, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   84 LEU  MDX         110 LEU  HN          5.50    (#   1331:10  Unique         4.04, 6.48 A)
 &rst
  ixpk= 1331, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1281,1282,1283,1285,1286,1287,
 &end
#
#    0 AMB  10-2:1332   110 LEU  HN          4.50    (#   1332:10  Single Ambig)
 &rst
  ixpk= 1332, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 &end
#
#  125 VAL  MGY         110 LEU  HN          4.50    (#   1333:10  Unique         3.38, 5.47 A)
 &rst
  ixpk= 1333, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#  123 THR  MG2         110 LEU  HN          4.50    (#   1334:10  Unique         3.17, 4.34 A)
 &rst
  ixpk= 1334, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1859,1860,1861,
 &end
#
#  110 LEU  HG          110 LEU  HN          4.50    (#   1335:10  Unique         3.86, 4.04 A)
 &rst
  ixpk= 1335, nxpk= 10, iat=1676,1669, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  110 LEU  HB+         110 LEU  HN          3.50    (#   1336:10  Unique         2.09, 2.84 A)
 &rst
  ixpk= 1336, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1673,1674,
 &end
#
#  110 LEU  HB-         110 LEU  HN          3.50    (#   1338:10  Unique         2.09, 2.84 A)
 &rst
  ixpk= 1338, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1673,1674,
 &end
#
#    0 AMB  10-2:1339   110 LEU  HN          4.50    (#   1339:10  Single Ambig)
 &rst
  ixpk= 1339, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1871,1872,1692,1693,
 &end
#
#   42 PHE  HB-          42 PHE  HN          5.50    (#   1340:10  Unique         2.37, 3.24 A)
 &rst
  ixpk= 1340, nxpk= 10, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 622, 623,
 &end
#
#    0 AMB  10-2:1341   110 LEU  HN          3.50    (#   1341:10  Single Ambig)
 &rst
  ixpk= 1341, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1662,1663,1662,1663,
 &end
#
#  125 VAL  HA          110 LEU  HN          4.50    (#   1342:10  Unique         3.33, 3.52 A)
 &rst
  ixpk= 1342, nxpk= 10, iat=1888,1669, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  109 SER  HA          110 LEU  HN          2.80    (#   1344:10  Unique         2.06, 2.13 A)
 &rst
  ixpk= 1344, nxpk= 10, iat=1660,1669, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  123 THR  HA          110 LEU  HN          5.50    (#   1345:10  Unique         4.53, 4.77 A)
 &rst
  ixpk= 1345, nxpk= 10, iat=1855,1669, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  108 PHE  HE          110 LEU  HN          4.50    (#   1346:10  Unique         3.81, 5.89 A)
 &rst
  ixpk= 1346, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1648,1652,
 &end
#
#  108 PHE  HD          110 LEU  HN          4.50    (#   1347:10  Unique         3.22, 5.54 A)
 &rst
  ixpk= 1347, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1646,1654,
 &end
#
#   42 PHE  HD           42 PHE  HN          4.50    (#   1348:10  Unique         2.95, 4.30 A)
 &rst
  ixpk= 1348, nxpk= 10, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 626, 634,
 &end
#
#  109 SER  HN          110 LEU  HN          4.50    (#   1349:10  Unique         4.02, 4.31 A)
 &rst
  ixpk= 1349, nxpk= 10, iat=1658,1669, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  124 LEU  HN          110 LEU  HN          4.50    (#   1350:10  Unique         2.87, 3.08 A)
 &rst
  ixpk= 1350, nxpk= 10, iat=1867,1669, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 ILE  HG1+        106 THR  HN          5.50    (#   1351:10  Unique         4.41, 5.50 A)
 &rst
  ixpk= 1351, nxpk= 10, iat=  -1,1610, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1517,1518,
 &end
#
#    0 AMB  10-2:1355    22 ALA  HN          6.50    (#   1355:10  Single Ambig)
 &rst
  ixpk= 1355, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 358, 359, 360, 362, 363, 364,1876,1877,1878,1880,
      1881,1882,
 &end
#
#   21 THR  MG2          22 ALA  HN          4.50    (#   1356:10  Unique         3.81, 4.59 A)
 &rst
  ixpk= 1356, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 321, 322, 323,
 &end
#
#   22 ALA  MB           22 ALA  HN          2.80    (#   1357:10  Unique         2.48, 2.87 A)
 &rst
  ixpk= 1357, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 333, 334, 335,
 &end
#
#    0 AMB  10-2:1358    22 ALA  HN          5.50    (#   1358:10  Single Ambig)
 &rst
  ixpk= 1358, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 353, 354, 387, 388, 375, 376,
 &end
#
#   25 GLU  HB+          22 ALA  HN          5.50    (#   1359:10  Unique         5.02, 5.38 A)
 &rst
  ixpk= 1359, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 372, 373,
 &end
#
#    0 AMB  10-2:1360    22 ALA  HN          4.50    (#   1360:10  Single Ambig)
 &rst
  ixpk= 1360, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 317, 297,
 &end
#
#   19 ARG  HA           22 ALA  HN          4.50    (#   1361:10  Unique         3.09, 3.37 A)
 &rst
  ixpk= 1361, nxpk= 10, iat= 273, 329, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   23 ALA  HN           22 ALA  HN          3.50    (#   1364:10  Unique         2.75, 2.78 A)
 &rst
  ixpk= 1364, nxpk= 10, iat= 339, 329, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 ALA  HN           22 ALA  HN          6.50    (#   1365:10  Unique         6.05, 6.18 A)
 &rst
  ixpk= 1365, nxpk= 10, iat= 261, 329, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   21 THR  HN           22 ALA  HN          3.50    (#   1366:10  Unique         2.86, 2.89 A)
 &rst
  ixpk= 1366, nxpk= 10, iat= 315, 329, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  113 ALA  HA          119 GLU  HN          5.50    (#   1368:10  Unique         4.39, 4.89 A)
 &rst
  ixpk= 1368, nxpk= 10, iat=1726,1786, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 ALA  HN           18 ALA  HN          6.50    (#   1369:10  Unique         6.05, 6.18 A)
 &rst
  ixpk= 1369, nxpk= 10, iat= 329, 261, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   68 ALA  HN           69 ALA  HN          3.50    (#   1370:10  Unique         2.26, 2.73 A)
 &rst
  ixpk= 1370, nxpk= 10, iat=1039,1049, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1371     0 AMB  10-1:1371   6.50    (#   1371:10  Double Ambig)
 &rst
  ixpk= 1371, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.81, r4=12.31,
 igr1=1876,1877,1878,1880,1881,1882,1876,1877,1878,1880,
      1881,1882, 952, 953, 954, 956, 957, 958,
 igr2= 261,1049,
 &end
#
#  134 GLN  HN          135 THR  HN          4.50    (#   1375:10  Unique         3.94, 4.31 A)
 &rst
  ixpk= 1375, nxpk= 10, iat=2011,2028, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   68 ALA  HN           67 ASP  HN          4.50    (#   1376:10  Unique         2.02, 2.52 A)
 &rst
  ixpk= 1376, nxpk= 10, iat=1039,1027, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 LEU  HN           25 GLU  HN          3.50    (#   1377:10  Unique         2.55, 2.62 A)
 &rst
  ixpk= 1377, nxpk= 10, iat= 349, 368, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1379   122 LEU  HN          5.50    (#   1379:10  Single Ambig)
 &rst
  ixpk= 1379, nxpk= 10, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
 igr1=1215,1216,1217,1219,1220,1221,2049,1876,1877,1878,
      1880,1881,1882,
 &end
#
#  115 ALA  MB          114 ASN  HN          6.50    (#   1381:10  Unique         6.14, 6.91 A)
 &rst
  ixpk= 1381, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1752,1753,1754,
 &end
#
#  121 LEU  HB+         114 ASN  HN          5.50    (#   1382:10  Unique         2.52, 4.80 A)
 &rst
  ixpk= 1382, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1819,1820,
 &end
#
#    0 AMB  10-2:1384     0 AMB  10-1:1384   5.50    (#   1384:10  Double Ambig)
 &rst
  ixpk= 1384, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1601,1602,1601,1602, 532, 533,
 igr2=1574, 874,
 &end
#
#   31 ALA  HA           30 ARG  HN          5.50    (#   1385:10  Unique         5.36, 5.39 A)
 &rst
  ixpk= 1385, nxpk= 10, iat= 469, 443, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 ALA  HN           26 LEU  HN          5.50    (#   1387:10  Unique         4.70, 4.73 A)
 &rst
  ixpk= 1387, nxpk= 10, iat= 339, 383, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  100 LEU  HN           38 VAL  HN          6.50    (#   1389:10  Unique         4.95, 5.14 A)
 &rst
  ixpk= 1389, nxpk= 10, iat=1526, 559, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   15 GLU  HB+          14 ARG  HN          4.50    (#   1390:10  Unique         4.59, 5.23 A)
 &rst
  ixpk= 1390, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 226, 227,
 &end
#
#  131 PRO  HD-         132 LEU  HN          6.50    (#   1392:10  Unique         2.94, 4.54 A)
 &rst
  ixpk= 1392, nxpk= 10, iat=  -1,1980, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1967,1968,
 &end
#
#  128 GLY  HN          108 PHE  HN          5.50    (#   1400:10  Unique         4.40, 4.98 A)
 &rst
  ixpk= 1400, nxpk= 10, iat=1924,1638, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   93 ASN  HB-          93 ASN  HD2+        5.50    (#   1404:10  Unique         2.26, 3.20 A)
 &rst
  ixpk= 1404, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1417,1418,
 igr2=1422,1423,
 &end
#
#   93 ASN  HB+          93 ASN  HD2+        5.50    (#   1405:10  Unique         2.26, 3.20 A)
 &rst
  ixpk= 1405, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1417,1418,
 igr2=1422,1423,
 &end
#
#    0 AMB  10-2:1410     0 AMB  10-1:1410   4.50    (#   1410:10  Double Ambig)
 &rst
  ixpk= 1410, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 969, 970,1002,1003,
 igr2=1007,1008,1007,1008,
 &end
#
#   65 GLN  HB+          65 GLN  HE2+        5.50    (#   1411:10  Unique         2.38, 4.38 A)
 &rst
  ixpk= 1411, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 999,1000,
 igr2=1007,1008,
 &end
#
#   69 ALA  HA           65 GLN  HE2+        5.50    (#   1413:10  Unique         2.71, 8.50 A)
 &rst
  ixpk= 1413, nxpk= 10, iat=1051,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1007,1008,
 &end
#
#   61 TRP  HE1          94 GLN  HE2-        5.50    (#   1417:10  Unique         4.59, 5.19 A)
 &rst
  ixpk= 1417, nxpk= 10, iat= 932,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1439,1440,
 &end
#
#   94 GLN  HA           94 GLN  HE2-        6.50    (#   1419:10  Unique         4.82, 5.52 A)
 &rst
  ixpk= 1419, nxpk= 10, iat=1429,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1439,1440,
 &end
#
#   94 GLN  HA           94 GLN  HE2+        5.50    (#   1420:10  Unique         4.82, 5.52 A)
 &rst
  ixpk= 1420, nxpk= 10, iat=1429,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1439,1440,
 &end
#
#   94 GLN  HG-          94 GLN  HE2-        4.50    (#   1421:10  Unique         2.23, 3.37 A)
 &rst
  ixpk= 1421, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1434,1435,
 igr2=1439,1440,
 &end
#
#   94 GLN  HG+          94 GLN  HE2-        4.50    (#   1422:10  Unique         2.23, 3.37 A)
 &rst
  ixpk= 1422, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1434,1435,
 igr2=1439,1440,
 &end
#
#   95 PRO  HG+          94 GLN  HE2-        5.50    (#   1424:10  Unique         3.66, 5.41 A)
 &rst
  ixpk= 1424, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1448,1449,
 igr2=1439,1440,
 &end
#
#   61 TRP  HE1          94 GLN  HE2+        5.50    (#   1425:10  Unique         4.59, 5.19 A)
 &rst
  ixpk= 1425, nxpk= 10, iat= 932,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1439,1440,
 &end
#
#   34 SER  HB+          32 THR  HN          6.50    (#   1427:10  Unique         5.03, 6.47 A)
 &rst
  ixpk= 1427, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 514, 515,
 &end
#
#   30 ARG  HB+          32 THR  HN          5.50    (#   1429:10  Unique         5.16, 5.70 A)
 &rst
  ixpk= 1429, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 447, 448,
 &end
#
#   33 LEU  HB-          32 THR  HN          4.50    (#   1430:10  Unique         4.55, 5.38 A)
 &rst
  ixpk= 1430, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 495, 496,
 &end
#
#   33 LEU  HB+          32 THR  HN          5.50    (#   1431:10  Unique         4.55, 5.38 A)
 &rst
  ixpk= 1431, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 495, 496,
 &end
#
#  113 ALA  MB          118 GLY  HN          5.50    (#   1435:10  Unique         4.08, 5.43 A)
 &rst
  ixpk= 1435, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1728,1729,1730,
 &end
#
#    0 AMB  10-2:1436     0 AMB  10-1:1436   6.50    (#   1436:10  Double Ambig)
 &rst
  ixpk= 1436, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1660,1690,
 igr2=1303,1304,1303,1304,
 &end
#
#   85 GLN  HA           85 GLN  HE2+        5.50    (#   1437:10  Unique         4.15, 4.85 A)
 &rst
  ixpk= 1437, nxpk= 10, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1303,1304,
 &end
#
#    0 AMB  10-2:1438     0 AMB  10-1:1438   5.50    (#   1438:10  Double Ambig)
 &rst
  ixpk= 1438, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1662,1663,1662,1663,
 igr2=1303,1304,1303,1304,
 &end
#
#   85 GLN  HB+          85 GLN  HE2+        5.50    (#   1440:10  Unique         2.01, 3.69 A)
 &rst
  ixpk= 1440, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1295,1296,
 igr2=1303,1304,
 &end
#
#   90 ASP  HN           96 GLN  HE2+        4.50    (#   1442:10  Unique         2.07, 2.83 A)
 &rst
  ixpk= 1442, nxpk= 10, iat=1378,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1470,1471,
 &end
#
#  127 SER  HN          128 GLY  HN          3.50    (#   1443:10  Unique         2.38, 2.58 A)
 &rst
  ixpk= 1443, nxpk= 10, iat=1913,1924, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  126 CYS  HN          128 GLY  HN          6.50    (#   1444:10  Unique         5.12, 5.35 A)
 &rst
  ixpk= 1444, nxpk= 10, iat=1902,1924, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  126 CYS  HA          128 GLY  HN          4.50    (#   1445:10  Unique         3.30, 3.59 A)
 &rst
  ixpk= 1445, nxpk= 10, iat=1904,1924, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  129 SER  HA          128 GLY  HN          5.50    (#   1446:10  Unique         4.63, 4.86 A)
 &rst
  ixpk= 1446, nxpk= 10, iat=1933,1924, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  107 PRO  HA          128 GLY  HN          4.50    (#   1449:10  Unique         2.75, 3.53 A)
 &rst
  ixpk= 1449, nxpk= 10, iat=1634,1924, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  127 SER  HB-         128 GLY  HN          4.50    (#   1450:10  Unique         4.03, 4.39 A)
 &rst
  ixpk= 1450, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1917,1918,
 &end
#
#    0 AMB  10-2:1451   128 GLY  HN          4.50    (#   1451:10  Single Ambig)
 &rst
  ixpk= 1451, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1917,1918,1935,1936,1935,1936,
 &end
#
#  126 CYS  HB-         128 GLY  HN          4.50    (#   1452:10  Unique         2.54, 4.11 A)
 &rst
  ixpk= 1452, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1906,1907,
 &end
#
#  107 PRO  HG+         128 GLY  HN          5.50    (#   1453:10  Unique         3.39, 4.97 A)
 &rst
  ixpk= 1453, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1628,1629,
 &end
#
#  107 PRO  HB+         128 GLY  HN          5.50    (#   1454:10  Unique         2.64, 4.98 A)
 &rst
  ixpk= 1454, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1631,1632,
 &end
#
#  107 PRO  HB-         128 GLY  HN          4.50    (#   1455:10  Unique         2.64, 4.98 A)
 &rst
  ixpk= 1455, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1631,1632,
 &end
#
#  107 PRO  HG-         128 GLY  HN          5.50    (#   1456:10  Unique         3.39, 4.97 A)
 &rst
  ixpk= 1456, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1628,1629,
 &end
#
#  105 ILE  HB          128 GLY  HN          5.50    (#   1457:10  Unique         3.91, 4.31 A)
 &rst
  ixpk= 1457, nxpk= 10, iat=1595,1924, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 ILE  QD1         128 GLY  HN          6.50    (#   1458:10  Unique         5.88, 7.54 A)
 &rst
  ixpk= 1458, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1604,1605,1606,
 &end
#
#  129 SER  HN          128 GLY  HN          3.50    (#   1460:10  Unique         2.13, 2.36 A)
 &rst
  ixpk= 1460, nxpk= 10, iat=1931,1924, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ALA  HN          134 GLN  HE2+        5.50    (#   1461:10  Unique         4.56, 5.23 A)
 &rst
  ixpk= 1461, nxpk= 10, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2023,2024,
 &end
#
#   17 ALA  HN          134 GLN  HE2-        6.50    (#   1462:10  Unique         4.56, 5.23 A)
 &rst
  ixpk= 1462, nxpk= 10, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=2023,2024,
 &end
#
#  134 GLN  HA          134 GLN  HE2+        5.50    (#   1463:10  Unique         3.91, 5.30 A)
 &rst
  ixpk= 1463, nxpk= 10, iat=2013,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2023,2024,
 &end
#
#   18 ALA  HA          134 GLN  HE2-        5.50    (#   1465:10  Unique         4.52, 5.67 A)
 &rst
  ixpk= 1465, nxpk= 10, iat= 263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2023,2024,
 &end
#
#   14 ARG  HA          134 GLN  HE2+        6.50    (#   1466:10  Unique         2.62, 3.48 A)
 &rst
  ixpk= 1466, nxpk= 10, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=2023,2024,
 &end
#
#  121 LEU  HG           10 ASN  HN          5.50    (#   1471:10  Unique         3.14, 3.68 A)
 &rst
  ixpk= 1471, nxpk= 10, iat=1822, 136, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1472    10 ASN  HN          4.50    (#   1472:10  Single Ambig)
 &rst
  ixpk= 1472, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1824,1825,1826,1828,1829,1830,1824,1825,1826,1828,
      1829,1830,
 &end
#
#    0 AMB  10-2:1473    10 ASN  HN          5.50    (#   1473:10  Single Ambig)
 &rst
  ixpk= 1473, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 116, 117, 118, 120, 121, 122,1213,
 &end
#
#    9 ALA  MB           10 ASN  HN          3.50    (#   1474:10  Unique         2.24, 3.42 A)
 &rst
  ixpk= 1474, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 130, 131, 132,
 &end
#
#    0 AMB  10-2:1475    10 ASN  HN          6.50    (#   1475:10  Single Ambig)
 &rst
  ixpk= 1475, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=  90,  91,  90,  91,
 &end
#
#   10 ASN  HB+          10 ASN  HN          2.80    (#   1476:10  Unique         2.31, 2.54 A)
 &rst
  ixpk= 1476, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 140, 141,
 &end
#
#   10 ASN  HB-          10 ASN  HN          2.80    (#   1477:10  Unique         2.31, 2.54 A)
 &rst
  ixpk= 1477, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 140, 141,
 &end
#
#    0 AMB  10-2:1478    10 ASN  HN          4.50    (#   1478:10  Single Ambig)
 &rst
  ixpk= 1478, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 128, 112,
 &end
#
#   10 ASN  HA           10 ASN  HN          3.50    (#   1479:10  Unique         2.75, 2.84 A)
 &rst
  ixpk= 1479, nxpk= 10, iat= 138, 136, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 ASN  HD2+         10 ASN  HN          5.50    (#   1482:10  Unique         4.48, 5.21 A)
 &rst
  ixpk= 1482, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 145, 146,
 &end
#
#   12 ARG  HN           10 ASN  HN          5.50    (#   1483:10  Unique         4.05, 4.31 A)
 &rst
  ixpk= 1483, nxpk= 10, iat= 164, 136, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 ALA  HN           10 ASN  HN          3.50    (#   1484:10  Unique         2.80, 3.03 A)
 &rst
  ixpk= 1484, nxpk= 10, iat= 126, 136, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 ALA  HN           10 ASN  HN          5.50    (#   1485:10  Unique         4.47, 4.61 A)
 &rst
  ixpk= 1485, nxpk= 10, iat= 188, 136, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    6 GLU  HA            6 GLU  HN          5.50    (#   1486:10  Unique         2.23, 2.76 A)
 &rst
  ixpk= 1486, nxpk= 10, iat=  85,  83, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 VAL  MGY           8 VAL  HN          3.50    (#   1488:10  Unique         2.04, 3.87 A)
 &rst
  ixpk= 1488, nxpk= 10, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 116, 117, 118, 120, 121, 122,
 &end
#
#    5 ARG  HG+           9 ALA  HN          5.50    (#   1489:10  Unique         3.42, 5.53 A)
 &rst
  ixpk= 1489, nxpk= 10, iat=  -1, 126, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  66,  67,
 &end
#
#   10 ASN  HN            9 ALA  HN          3.50    (#   1490:10  Unique         2.80, 3.03 A)
 &rst
  ixpk= 1490, nxpk= 10, iat= 136, 126, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  114 ASN  HA           10 ASN  HN          6.50    (#   1491:10  Unique         5.55, 5.64 A)
 &rst
  ixpk= 1491, nxpk= 10, iat=1736, 136, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  10-2:1493    13 ALA  HN          5.50    (#   1493:10  Single Ambig)
 &rst
  ixpk= 1493, nxpk= 10, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 154,1736,
 &end
#
#    0 AMB  10-2:1494    16 THR  HN          5.50    (#   1494:10  Single Ambig)
 &rst
  ixpk= 1494, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1215,1216,1217,1219,1220,1221,1843,1844,1845,1847,
      1848,1849,
 &end
#
#   80 LEU  HG           16 THR  HN          6.50    (#   1495:10  Unique         4.62, 5.87 A)
 &rst
  ixpk= 1495, nxpk= 10, iat=1213, 237, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#    0 AMB  10-2:1496    16 THR  HN          4.50    (#   1496:10  Single Ambig)
 &rst
  ixpk= 1496, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1718,1719,1720, 168, 169,
 &end
#
#    0 AMB  10-2:1497    16 THR  HN          4.50    (#   1497:10  Single Ambig)
 &rst
  ixpk= 1497, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 243, 244, 245, 265, 266, 267,
 &end
#
#   15 GLU  HB+          16 THR  HN          4.50    (#   1498:10  Unique         2.33, 3.00 A)
 &rst
  ixpk= 1498, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 226, 227,
 &end
#
#   15 GLU  HB-          16 THR  HN          3.50    (#   1499:10  Unique         2.33, 3.00 A)
 &rst
  ixpk= 1499, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 226, 227,
 &end
#
#   15 GLU  HG+          16 THR  HN          5.50    (#   1500:10  Unique         3.39, 4.63 A)
 &rst
  ixpk= 1500, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 229, 230,
 &end
#
#    0 AMB  10-2:1501    16 THR  HN          3.50    (#   1501:10  Single Ambig)
 &rst
  ixpk= 1501, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 239, 224,
 &end
#
#   16 THR  HB           16 THR  HN          3.50    (#   1502:10  Unique         2.30, 2.45 A)
 &rst
  ixpk= 1502, nxpk= 10, iat= 241, 237, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1503    16 THR  HN          5.50    (#   1503:10  Single Ambig)
 &rst
  ixpk= 1503, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 261, 271,
 &end
#
#   17 ALA  HN           16 THR  HN          3.50    (#   1504:10  Unique         2.57, 2.80 A)
 &rst
  ixpk= 1504, nxpk= 10, iat= 251, 237, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1505    16 THR  HN          5.50    (#   1505:10  Single Ambig)
 &rst
  ixpk= 1505, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 202, 203, 202, 203,
 &end
#
#   13 ALA  HN           17 ALA  HN          6.50    (#   1506:10  Unique         5.81, 5.89 A)
 &rst
  ixpk= 1506, nxpk= 10, iat= 188, 251, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   14 ARG  HN           17 ALA  HN          5.50    (#   1507:10  Unique         4.60, 4.69 A)
 &rst
  ixpk= 1507, nxpk= 10, iat= 198, 251, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ALA  HA           17 ALA  HN          4.50    (#   1508:10  Unique         3.73, 3.87 A)
 &rst
  ixpk= 1508, nxpk= 10, iat= 190, 251, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1509    17 ALA  HN          6.50    (#   1509:10  Single Ambig)
 &rst
  ixpk= 1509, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 226, 227,1714,1715,
 &end
#
#   20 PHE  HN           18 ALA  HN          4.50    (#   1511:10  Unique         4.07, 4.33 A)
 &rst
  ixpk= 1511, nxpk= 10, iat= 295, 261, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1512    69 ALA  HN          3.50    (#   1512:10  Single Ambig)
 &rst
  ixpk= 1512, nxpk= 10, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1043,1044,1045,1053,1054,1055,
 &end
#
#    0 AMB  10-2:1514    69 ALA  HN          5.50    (#   1514:10  Single Ambig)
 &rst
  ixpk= 1514, nxpk= 10, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1031,1032,1063,1064,
 &end
#
#   67 ASP  HB-          69 ALA  HN          6.50    (#   1515:10  Unique         4.71, 5.55 A)
 &rst
  ixpk= 1515, nxpk= 10, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1031,1032,
 &end
#
#   19 ARG  HB+          20 PHE  HN          3.50    (#   1517:10  Unique         2.49, 3.19 A)
 &rst
  ixpk= 1517, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 275, 276,
 &end
#
#   20 PHE  HB-          20 PHE  HN          3.50    (#   1519:10  Unique         2.29, 2.54 A)
 &rst
  ixpk= 1519, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 299, 300,
 &end
#
#    0 AMB  10-2:1520    20 PHE  HN          5.50    (#   1520:10  Single Ambig)
 &rst
  ixpk= 1520, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 333, 334, 335, 255, 256, 257,
 &end
#
#   20 PHE  HA           20 PHE  HN          3.50    (#   1521:10  Unique         2.82, 2.84 A)
 &rst
  ixpk= 1521, nxpk= 10, iat= 297, 295, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ALA  HA           20 PHE  HN          4.50    (#   1522:10  Unique         3.35, 3.44 A)
 &rst
  ixpk= 1522, nxpk= 10, iat= 253, 295, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1523    20 PHE  HN          4.50    (#   1523:10  Single Ambig)
 &rst
  ixpk= 1523, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 273, 263,
 &end
#
#   76 TRP  HZ2          20 PHE  HN          6.50    (#   1525:10  Unique         4.16, 5.46 A)
 &rst
  ixpk= 1525, nxpk= 10, iat=1153, 295, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   19 ARG  HN           20 PHE  HN          3.50    (#   1526:10  Unique         2.69, 2.82 A)
 &rst
  ixpk= 1526, nxpk= 10, iat= 271, 295, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 ARG  HB+          21 THR  HN          5.50    (#   1527:10  Unique         5.05, 5.53 A)
 &rst
  ixpk= 1527, nxpk= 10, iat=  -1, 315, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 275, 276,
 &end
#
#   21 THR  HB           22 ALA  HN          3.50    (#   1528:10  Unique         2.64, 2.77 A)
 &rst
  ixpk= 1528, nxpk= 10, iat= 319, 329, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 ALA  HA           22 ALA  HN          3.50    (#   1529:10  Unique         2.85, 2.87 A)
 &rst
  ixpk= 1529, nxpk= 10, iat= 331, 329, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   25 GLU  HN           24 LEU  HN          3.50    (#   1530:10  Unique         2.55, 2.62 A)
 &rst
  ixpk= 1530, nxpk= 10, iat= 368, 349, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   23 ALA  HN           24 LEU  HN          3.50    (#   1531:10  Unique         2.66, 2.70 A)
 &rst
  ixpk= 1531, nxpk= 10, iat= 339, 349, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1532    24 LEU  HN          3.50    (#   1532:10  Single Ambig)
 &rst
  ixpk= 1532, nxpk= 10, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 351, 317, 297,
 &end
#
#   23 ALA  HA           24 LEU  HN          4.50    (#   1533:10  Unique         3.53, 3.55 A)
 &rst
  ixpk= 1533, nxpk= 10, iat= 341, 349, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 ALA  HA           24 LEU  HN          6.50    (#   1534:10  Unique         4.21, 4.29 A)
 &rst
  ixpk= 1534, nxpk= 10, iat= 331, 349, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   24 LEU  MDX          24 LEU  HN          4.50    (#   1535:10  Unique         4.49, 5.12 A)
 &rst
  ixpk= 1535, nxpk= 10, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 358, 359, 360, 362, 363, 364,
 &end
#
#    0 AMB  10-2:1536    24 LEU  HN          4.50    (#   1536:10  Single Ambig)
 &rst
  ixpk= 1536, nxpk= 10, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 358, 359, 360, 362, 363, 364,1989,1990,1991,1993,
      1994,1995,
 &end
#
#   24 LEU  HB+          24 LEU  HN          3.50    (#   1537:10  Unique         2.35, 2.44 A)
 &rst
  ixpk= 1537, nxpk= 10, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 353, 354,
 &end
#
#   24 LEU  HB-          24 LEU  HN          3.50    (#   1538:10  Unique         2.35, 2.44 A)
 &rst
  ixpk= 1538, nxpk= 10, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 353, 354,
 &end
#
#   23 ALA  MB           24 LEU  HN          3.50    (#   1539:10  Unique         2.78, 3.60 A)
 &rst
  ixpk= 1539, nxpk= 10, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 343, 344, 345,
 &end
#
#   25 GLU  HB-          24 LEU  HN          5.50    (#   1540:10  Unique         4.63, 4.92 A)
 &rst
  ixpk= 1540, nxpk= 10, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 372, 373,
 &end
#
#   40 ILE  QD1          24 LEU  HN          6.50    (#   1541:10  Unique         4.14, 5.07 A)
 &rst
  ixpk= 1541, nxpk= 10, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1= 595, 596, 597,
 &end
#
#   26 LEU  HN           24 LEU  HN          5.50    (#   1542:10  Unique         4.09, 4.16 A)
 &rst
  ixpk= 1542, nxpk= 10, iat= 383, 349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 ALA  HN           25 GLU  HN          5.50    (#   1545:10  Unique         4.03, 4.13 A)
 &rst
  ixpk= 1545, nxpk= 10, iat= 339, 368, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1546    25 GLU  HN          4.50    (#   1546:10  Single Ambig)
 &rst
  ixpk= 1546, nxpk= 10, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 406, 407, 408,1517,1518,
 &end
#
#   26 LEU  HN           27 ALA  HN          3.50    (#   1547:10  Unique         2.84, 2.88 A)
 &rst
  ixpk= 1547, nxpk= 10, iat= 383, 402, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 LEU  HA           27 ALA  HN          4.50    (#   1548:10  Unique         2.90, 3.05 A)
 &rst
  ixpk= 1548, nxpk= 10, iat= 351, 402, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 ALA  HA           27 ALA  HN          3.50    (#   1549:10  Unique         2.84, 2.85 A)
 &rst
  ixpk= 1549, nxpk= 10, iat= 404, 402, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 LEU  HA           27 ALA  HN          3.50    (#   1550:10  Unique         3.57, 3.58 A)
 &rst
  ixpk= 1550, nxpk= 10, iat= 385, 402, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   25 GLU  HA           27 ALA  HN          5.50    (#   1551:10  Unique         4.29, 4.41 A)
 &rst
  ixpk= 1551, nxpk= 10, iat= 370, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 ALA  MB           27 ALA  HN          3.50    (#   1552:10  Unique         2.44, 2.87 A)
 &rst
  ixpk= 1552, nxpk= 10, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 406, 407, 408,
 &end
#
#   26 LEU  HB+          27 ALA  HN          3.50    (#   1553:10  Unique         2.56, 3.37 A)
 &rst
  ixpk= 1553, nxpk= 10, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 387, 388,
 &end
#
#   26 LEU  HB-          27 ALA  HN          3.50    (#   1554:10  Unique         2.56, 3.37 A)
 &rst
  ixpk= 1554, nxpk= 10, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 387, 388,
 &end
#
#   26 LEU  MDX          27 ALA  HN          3.50    (#   1555:10  Unique         3.95, 4.98 A)
 &rst
  ixpk= 1555, nxpk= 10, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 392, 393, 394, 396, 397, 398,
 &end
#
#    0 AMB  10-2:1557    27 ALA  HN          4.50    (#   1557:10  Single Ambig)
 &rst
  ixpk= 1557, nxpk= 10, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 447, 448, 372, 373,
 &end
#
#   24 LEU  MDY          27 ALA  HN          6.50    (#   1558:10  Unique         4.49, 6.57 A)
 &rst
  ixpk= 1558, nxpk= 10, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 358, 359, 360, 362, 363, 364,
 &end
#
#   38 VAL  MGX          27 ALA  HN          5.50    (#   1559:10  Unique         4.72, 6.50 A)
 &rst
  ixpk= 1559, nxpk= 10, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  10-2:1564    70 ASP  HN          3.50    (#   1564:10  Single Ambig)
 &rst
  ixpk= 1564, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1051,1014,
 &end
#
#   70 ASP  HA           70 ASP  HN          3.50    (#   1565:10  Unique         2.21, 2.64 A)
 &rst
  ixpk= 1565, nxpk= 10, iat=1061,1059, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   70 ASP  HB+          70 ASP  HN          3.50    (#   1568:10  Unique         2.37, 3.09 A)
 &rst
  ixpk= 1568, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1063,1064,
 &end
#
#   70 ASP  HB-          70 ASP  HN          3.50    (#   1569:10  Unique         2.37, 3.09 A)
 &rst
  ixpk= 1569, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1063,1064,
 &end
#
#   69 ALA  MB           70 ASP  HN          3.50    (#   1570:10  Unique         2.03, 3.65 A)
 &rst
  ixpk= 1570, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1053,1054,1055,
 &end
#
#   30 ARG  HG+          30 ARG  HN          4.50    (#   1572:10  Unique         2.39, 3.75 A)
 &rst
  ixpk= 1572, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 450, 451,
 &end
#
#    0 AMB  10-2:1573    30 ARG  HN          4.50    (#   1573:10  Single Ambig)
 &rst
  ixpk= 1573, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 406, 407, 408, 983,1517,1518,
 &end
#
#    0 AMB  10-2:1574    30 ARG  HN          6.50    (#   1574:10  Single Ambig)
 &rst
  ixpk= 1574, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
 igr1= 425, 426, 427, 595, 596, 597,
 &end
#
#   29 ASP  HN           28 ILE  HN          3.50    (#   1576:10  Unique         2.61, 2.72 A)
 &rst
  ixpk= 1576, nxpk= 10, iat= 431, 412, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 ALA  HN           28 ILE  HN          5.50    (#   1577:10  Unique         4.52, 4.63 A)
 &rst
  ixpk= 1577, nxpk= 10, iat= 467, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1579     0 AMB  10-1:1579   4.50    (#   1579:10  Double Ambig)
 &rst
  ixpk= 1579, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 878, 879,1559,1560,
 igr2= 874,1574,
 &end
#
#   58 ALA  MB           59 TRP  HN          3.50    (#   1581:10  Unique         2.09, 3.48 A)
 &rst
  ixpk= 1581, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 868, 869, 870,
 &end
#
#  114 ASN  HD2+        114 ASN  HN          5.50    (#   1584:10  Unique         4.61, 5.26 A)
 &rst
  ixpk= 1584, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1743,1744,
 &end
#
#  122 LEU  HB-         113 ALA  HN          6.50    (#   1586:10  Unique         6.18, 6.97 A)
 &rst
  ixpk= 1586, nxpk= 10, iat=  -1,1724, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1838,1839,
 &end
#
#   13 ALA  MB          113 ALA  HN          6.50    (#   1587:10  Unique         5.92, 6.79 A)
 &rst
  ixpk= 1587, nxpk= 10, iat=  -1,1724, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1= 192, 193, 194,
 &end
#
#  116 GLY  HA+         117 THR  HN          4.50    (#   1588:10  Unique         2.61, 6.62 A)
 &rst
  ixpk= 1588, nxpk= 10, iat=  -1,1765, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1760,1761,
 &end
#
#  117 THR  MG2         118 GLY  HN          4.50    (#   1589:10  Unique         4.36, 4.96 A)
 &rst
  ixpk= 1589, nxpk= 10, iat=  -1,1779, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1771,1772,1773,
 &end
#
#   30 ARG  HB-          30 ARG  HN          2.80    (#   1590:10  Unique         2.29, 2.86 A)
 &rst
  ixpk= 1590, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 447, 448,
 &end
#
#   29 ASP  HB-          30 ARG  HN          3.50    (#   1591:10  Unique         2.51, 3.23 A)
 &rst
  ixpk= 1591, nxpk= 10, iat=  -1, 443, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 435, 436,
 &end
#
#   28 ILE  QG2          29 ASP  HN          5.50    (#   1592:10  Unique         3.43, 4.27 A)
 &rst
  ixpk= 1592, nxpk= 10, iat=  -1, 431, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 418, 419, 420,
 &end
#
#    0 AMB  10-2:1593    32 THR  HN          4.50    (#   1593:10  Single Ambig)
 &rst
  ixpk= 1593, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 498, 422, 423,
 &end
#
#   31 ALA  MB           32 THR  HN          3.50    (#   1594:10  Unique         2.54, 3.60 A)
 &rst
  ixpk= 1594, nxpk= 10, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 471, 472, 473,
 &end
#
#   33 LEU  HG           33 LEU  HN          2.80    (#   1595:10  Unique         2.39, 2.51 A)
 &rst
  ixpk= 1595, nxpk= 10, iat= 498, 491, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   37 PRO  HA           36 GLN  HN          5.50    (#   1596:10  Unique         4.84, 5.00 A)
 &rst
  ixpk= 1596, nxpk= 10, iat= 555, 528, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   38 VAL  MGY          38 VAL  HN          3.50    (#   1598:10  Unique         2.39, 4.20 A)
 &rst
  ixpk= 1598, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#   40 ILE  HN           39 GLY  HN          6.50    (#   1599:10  Unique         4.45, 4.48 A)
 &rst
  ixpk= 1599, nxpk= 10, iat= 582, 575, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   98 VAL  HA           39 GLY  HN          5.50    (#   1605:10  Unique         4.77, 4.83 A)
 &rst
  ixpk= 1605, nxpk= 10, iat=1493, 575, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 PRO  HD-          39 GLY  HN          5.50    (#   1606:10  Unique         4.23, 5.36 A)
 &rst
  ixpk= 1606, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 783, 784,
 &end
#
#   38 VAL  HB           39 GLY  HN          4.50    (#   1608:10  Unique         2.30, 3.87 A)
 &rst
  ixpk= 1608, nxpk= 10, iat= 563, 575, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 VAL  MGY          39 GLY  HN          3.50    (#   1609:10  Unique         2.29, 3.82 A)
 &rst
  ixpk= 1609, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#   38 VAL  MGX          39 GLY  HN          3.50    (#   1610:10  Unique         2.29, 3.82 A)
 &rst
  ixpk= 1610, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 565, 566, 567, 569, 570, 571,
 &end
#
#    0 AMB  10-2:1611    39 GLY  HN          4.50    (#   1611:10  Single Ambig)
 &rst
  ixpk= 1611, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 736, 737, 738, 592, 593,
 &end
#
#   40 ILE  QG2          41 HIS  HN          3.50    (#   1612:10  Unique         2.60, 3.41 A)
 &rst
  ixpk= 1612, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 588, 589, 590,
 &end
#
#   40 ILE  QD1          41 HIS  HN          5.50    (#   1614:10  Unique         5.57, 6.20 A)
 &rst
  ixpk= 1614, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 595, 596, 597,
 &end
#
#   95 PRO  HB-          41 HIS  HN          5.50    (#   1615:10  Unique         3.41, 4.14 A)
 &rst
  ixpk= 1615, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1451,1452,
 &end
#
#    0 AMB  10-2:1616    41 HIS  HN          4.50    (#   1616:10  Single Ambig)
 &rst
  ixpk= 1616, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 592, 593, 736, 737, 738,
 &end
#
#   40 ILE  HG1-         41 HIS  HN          5.50    (#   1617:10  Unique         4.30, 4.74 A)
 &rst
  ixpk= 1617, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 592, 593,
 &end
#
#   41 HIS  HB-          41 HIS  HN          4.50    (#   1618:10  Unique         2.05, 2.64 A)
 &rst
  ixpk= 1618, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 605, 606,
 &end
#
#   50 MET  HG+          41 HIS  HN          5.50    (#   1619:10  Unique         2.92, 4.34 A)
 &rst
  ixpk= 1619, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 756, 757,
 &end
#
#    0 AMB  10-2:1622    41 HIS  HN          6.50    (#   1622:10  Single Ambig)
 &rst
  ixpk= 1622, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1101,1102, 969, 970,
 &end
#
#   41 HIS  HB+          41 HIS  HN          3.50    (#   1623:10  Unique         2.05, 2.64 A)
 &rst
  ixpk= 1623, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 605, 606,
 &end
#
#   95 PRO  HA           41 HIS  HN          5.50    (#   1624:10  Unique         3.46, 3.78 A)
 &rst
  ixpk= 1624, nxpk= 10, iat=1454, 601, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  HA           41 HIS  HN          3.50    (#   1625:10  Unique         2.02, 2.07 A)
 &rst
  ixpk= 1625, nxpk= 10, iat= 584, 601, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 HIS  HA           41 HIS  HN          4.50    (#   1626:10  Unique         2.85, 2.97 A)
 &rst
  ixpk= 1626, nxpk= 10, iat= 603, 601, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   44 ASP  HA           45 SER  HN          4.50    (#   1627:10  Unique         2.33, 3.40 A)
 &rst
  ixpk= 1627, nxpk= 10, iat= 651, 661, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   44 ASP  HA           44 ASP  HN          3.50    (#   1629:10  Unique         2.23, 2.85 A)
 &rst
  ixpk= 1629, nxpk= 10, iat= 651, 649, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   42 PHE  HB-          43 SER  HN          5.50    (#   1631:10  Unique         3.10, 3.92 A)
 &rst
  ixpk= 1631, nxpk= 10, iat=  -1, 638, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 622, 623,
 &end
#
#   43 SER  HB+          43 SER  HN          5.50    (#   1632:10  Unique         2.64, 3.17 A)
 &rst
  ixpk= 1632, nxpk= 10, iat=  -1, 638, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 642, 643,
 &end
#
#   43 SER  HB-          43 SER  HN          5.50    (#   1633:10  Unique         2.64, 3.17 A)
 &rst
  ixpk= 1633, nxpk= 10, iat=  -1, 638, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 642, 643,
 &end
#
#   42 PHE  HA           43 SER  HN          3.50    (#   1634:10  Unique         2.07, 2.15 A)
 &rst
  ixpk= 1634, nxpk= 10, iat= 620, 638, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 SER  HA           43 SER  HN          4.50    (#   1635:10  Unique         2.95, 2.97 A)
 &rst
  ixpk= 1635, nxpk= 10, iat= 640, 638, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   47 TRP  HA           43 SER  HN          6.50    (#   1636:10  Unique         2.45, 3.34 A)
 &rst
  ixpk= 1636, nxpk= 10, iat= 684, 638, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   42 PHE  HD           43 SER  HN          5.50    (#   1637:10  Unique         3.54, 5.10 A)
 &rst
  ixpk= 1637, nxpk= 10, iat=  -1, 638, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 634,
 &end
#
#   46 ALA  HN           43 SER  HN          4.50    (#   1638:10  Unique         2.97, 3.27 A)
 &rst
  ixpk= 1638, nxpk= 10, iat= 672, 638, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ASP  HN           43 SER  HN          5.50    (#   1639:10  Unique         4.61, 5.14 A)
 &rst
  ixpk= 1639, nxpk= 10, iat=1378, 638, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1640    42 PHE  HN          5.50    (#   1640:10  Single Ambig)
 &rst
  ixpk= 1640, nxpk= 10, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1465,1466,1465,1466, 622, 623,
 &end
#
#   41 HIS  HB-          42 PHE  HN          5.50    (#   1641:10  Unique         2.66, 4.07 A)
 &rst
  ixpk= 1641, nxpk= 10, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 605, 606,
 &end
#
#    0 AMB  10-2:1642    42 PHE  HN          2.80    (#   1642:10  Single Ambig)
 &rst
  ixpk= 1642, nxpk= 10, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 603, 620,
 &end
#
#    0 AMB  10-2:1643    42 PHE  HN          5.50    (#   1643:10  Single Ambig)
 &rst
  ixpk= 1643, nxpk= 10, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 638, 649,
 &end
#
#   49 ILE  HN           48 ARG  HN          5.50    (#   1644:10  Unique         2.05, 4.26 A)
 &rst
  ixpk= 1644, nxpk= 10, iat= 730, 706, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 MET  HG-          50 MET  HN          4.50    (#   1645:10  Unique         3.05, 3.65 A)
 &rst
  ixpk= 1645, nxpk= 10, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 756, 757,
 &end
#
#   50 MET  HA           51 VAL  HN          3.50    (#   1646:10  Unique         2.10, 2.22 A)
 &rst
  ixpk= 1646, nxpk= 10, iat= 751, 766, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   55 THR  HB           55 THR  HN          6.50    (#   1647:10  Unique         2.84, 3.28 A)
 &rst
  ixpk= 1647, nxpk= 10, iat= 829, 825, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  100 LEU  HA          104 GLN  HN          5.50    (#   1648:10  Unique         5.10, 5.23 A)
 &rst
  ixpk= 1648, nxpk= 10, iat=1528,1574, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  100 LEU  HN          104 GLN  HN          4.50    (#   1650:10  Unique         3.48, 3.70 A)
 &rst
  ixpk= 1650, nxpk= 10, iat=1526,1574, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 TRP  HB+          61 TRP  HN          4.50    (#   1651:10  Unique         2.36, 3.13 A)
 &rst
  ixpk= 1651, nxpk= 10, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 926, 927,
 &end
#
#   61 TRP  HB-          61 TRP  HN          3.50    (#   1652:10  Unique         2.36, 3.13 A)
 &rst
  ixpk= 1652, nxpk= 10, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 926, 927,
 &end
#
#    0 AMB  10-2:1654    61 TRP  HN          4.50    (#   1654:10  Single Ambig)
 &rst
  ixpk= 1654, nxpk= 10, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 905, 906, 905, 906,
 &end
#
#   62 VAL  MGX          61 TRP  HN          5.50    (#   1655:10  Unique         4.37, 6.60 A)
 &rst
  ixpk= 1655, nxpk= 10, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 952, 953, 954, 956, 957, 958,
 &end
#
#   60 ARG  HA           61 TRP  HN          3.50    (#   1656:10  Unique         2.11, 2.22 A)
 &rst
  ixpk= 1656, nxpk= 10, iat= 900, 922, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 TRP  HA           61 TRP  HN          4.50    (#   1657:10  Unique         2.95, 2.98 A)
 &rst
  ixpk= 1657, nxpk= 10, iat= 924, 922, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 TRP  HD1          61 TRP  HN          4.50    (#   1658:10  Unique         3.10, 3.77 A)
 &rst
  ixpk= 1658, nxpk= 10, iat= 930, 922, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   60 ARG  HN           61 TRP  HN          5.50    (#   1659:10  Unique         4.15, 4.33 A)
 &rst
  ixpk= 1659, nxpk= 10, iat= 898, 922, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 VAL  HN           62 VAL  HN          4.50    (#   1660:10  Unique         2.64, 2.81 A)
 &rst
  ixpk= 1660, nxpk= 10, iat= 766, 946, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   67 ASP  HN           66 GLU  HN          4.50    (#   1661:10  Unique         2.42, 3.13 A)
 &rst
  ixpk= 1661, nxpk= 10, iat=1027,1012, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 GLN  HA           65 GLN  HN          4.50    (#   1662:10  Unique         2.19, 2.84 A)
 &rst
  ixpk= 1662, nxpk= 10, iat= 997, 995, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   64 LEU  HA            0 AMB  10-1:1663   3.50    (#   1663:10  Single Ambig)
 &rst
  ixpk= 1663, nxpk= 10, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 995, 976,
 &end
#
#   65 GLN  HB-          65 GLN  HN          4.50    (#   1664:10  Unique         1.96, 3.15 A)
 &rst
  ixpk= 1664, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 999,1000,
 &end
#
#   65 GLN  HB+          65 GLN  HN          3.50    (#   1665:10  Unique         1.96, 3.15 A)
 &rst
  ixpk= 1665, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 999,1000,
 &end
#
#   71 GLU  HN           70 ASP  HN          5.50    (#   1667:10  Unique         1.79, 3.37 A)
 &rst
  ixpk= 1667, nxpk= 10, iat=1071,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 GLU  HA           71 GLU  HN          3.50    (#   1668:10  Unique         2.24, 2.71 A)
 &rst
  ixpk= 1668, nxpk= 10, iat=1073,1071, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   73 GLN  HE2+         71 GLU  HN          6.50    (#   1669:10  Unique         4.33, 6.74 A)
 &rst
  ixpk= 1669, nxpk= 10, iat=  -1,1071, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=1109,1110,
 &end
#
#   70 ASP  HN           71 GLU  HN          5.50    (#   1671:10  Unique         1.79, 3.37 A)
 &rst
  ixpk= 1671, nxpk= 10, iat=1059,1071, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1673    72 SER  HN          3.50    (#   1673:10  Single Ambig)
 &rst
  ixpk= 1673, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1073,1088,
 &end
#
#   72 SER  HB-          72 SER  HN          3.50    (#   1674:10  Unique         2.45, 3.21 A)
 &rst
  ixpk= 1674, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1090,1091,
 &end
#
#   72 SER  HB+          72 SER  HN          3.50    (#   1675:10  Unique         2.45, 3.21 A)
 &rst
  ixpk= 1675, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1090,1091,
 &end
#
#   73 GLN  HN           72 SER  HN          4.50    (#   1677:10  Unique         1.91, 2.84 A)
 &rst
  ixpk= 1677, nxpk= 10, iat=1097,1086, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 GLN  HG-          72 SER  HN          4.50    (#   1678:10  Unique         1.87, 3.73 A)
 &rst
  ixpk= 1678, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1002,1003,
 &end
#
#    0 AMB  10-2:1680    72 SER  HN          4.50    (#   1680:10  Single Ambig)
 &rst
  ixpk= 1680, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 999,1000,1075,1076,
 &end
#
#   81 SER  HA           82 ILE  HN          2.80    (#   1681:10  Unique         2.15, 2.22 A)
 &rst
  ixpk= 1681, nxpk= 10, iat=1227,1236, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1682    82 ILE  HN          4.50    (#   1682:10  Single Ambig)
 &rst
  ixpk= 1682, nxpk= 10, iat=  -1,1236, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1229,1230,1229,1230,
 &end
#
#   82 ILE  HB           82 ILE  HN          3.50    (#   1683:10  Unique         2.26, 2.36 A)
 &rst
  ixpk= 1683, nxpk= 10, iat=1240,1236, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   82 ILE  HG1-         82 ILE  HN          4.50    (#   1685:10  Unique         4.36, 4.48 A)
 &rst
  ixpk= 1685, nxpk= 10, iat=  -1,1236, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1246,1247,
 &end
#
#   82 ILE  QG2          82 ILE  HN          3.50    (#   1686:10  Unique         3.81, 4.36 A)
 &rst
  ixpk= 1686, nxpk= 10, iat=  -1,1236, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1242,1243,1244,
 &end
#
#   79 GLU  HG+          80 LEU  HN          5.50    (#   1688:10  Unique         3.78, 5.15 A)
 &rst
  ixpk= 1688, nxpk= 10, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1198,1199,
 &end
#
#  113 ALA  HN           83 HIS  HN          5.50    (#   1693:10  Unique         4.26, 4.85 A)
 &rst
  ixpk= 1693, nxpk= 10, iat=1724,1255, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ILE  HN           83 HIS  HN          5.50    (#   1694:10  Unique         4.46, 4.49 A)
 &rst
  ixpk= 1694, nxpk= 10, iat=1236,1255, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1696    83 HIS  HN          4.50    (#   1696:10  Single Ambig)
 &rst
  ixpk= 1696, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1709,1690,
 &end
#
#   82 ILE  HA           83 HIS  HN          2.80    (#   1697:10  Unique         2.09, 2.13 A)
 &rst
  ixpk= 1697, nxpk= 10, iat=1238,1255, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   83 HIS  HB-          83 HIS  HN          3.50    (#   1698:10  Unique         2.59, 3.30 A)
 &rst
  ixpk= 1698, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1259,1260,
 &end
#
#   83 HIS  HB+          83 HIS  HN          3.50    (#   1699:10  Unique         2.59, 3.30 A)
 &rst
  ixpk= 1699, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1259,1260,
 &end
#
#  111 LEU  HB-          83 HIS  HN          4.50    (#   1700:10  Unique         3.05, 4.22 A)
 &rst
  ixpk= 1700, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1692,1693,
 &end
#
#    0 AMB  10-2:1701    83 HIS  HN          4.50    (#   1701:10  Single Ambig)
 &rst
  ixpk= 1701, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1240,1279,
 &end
#
#    0 AMB  10-2:1702    83 HIS  HN          5.50    (#   1702:10  Single Ambig)
 &rst
  ixpk= 1702, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1695,1673,1674,
 &end
#
#  111 LEU  MDY          83 HIS  HN          5.50    (#   1703:10  Unique         3.79, 5.88 A)
 &rst
  ixpk= 1703, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1697,1698,1699,1701,1702,1703,
 &end
#
#  110 LEU  MDY          83 HIS  HN          4.50    (#   1704:10  Unique         3.14, 5.67 A)
 &rst
  ixpk= 1704, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1678,1679,1680,1682,1683,1684,
 &end
#
#    0 AMB  10-2:1705    83 HIS  HN          5.50    (#   1705:10  Single Ambig)
 &rst
  ixpk= 1705, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1246,1247,1281,1282,1283,1285,1286,1287,
 &end
#
#   82 ILE  QG2          83 HIS  HN          3.50    (#   1706:10  Unique         2.42, 3.58 A)
 &rst
  ixpk= 1706, nxpk= 10, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1242,1243,1244,
 &end
#
#   83 HIS  HB-          84 LEU  HN          5.50    (#   1707:10  Unique         2.68, 3.74 A)
 &rst
  ixpk= 1707, nxpk= 10, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1259,1260,
 &end
#
#   84 LEU  HA           84 LEU  HN          3.50    (#   1708:10  Unique         2.89, 2.95 A)
 &rst
  ixpk= 1708, nxpk= 10, iat=1274,1272, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   83 HIS  HN           84 LEU  HN          4.50    (#   1710:10  Unique         3.94, 4.30 A)
 &rst
  ixpk= 1710, nxpk= 10, iat=1255,1272, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  109 SER  HN           85 GLN  HN          4.50    (#   1711:10  Unique         2.80, 2.98 A)
 &rst
  ixpk= 1711, nxpk= 10, iat=1658,1291, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 LEU  HN           85 GLN  HN          4.50    (#   1712:10  Unique         4.29, 4.46 A)
 &rst
  ixpk= 1712, nxpk= 10, iat=1272,1291, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  108 PHE  HA           85 GLN  HN          6.50    (#   1714:10  Unique         4.62, 4.89 A)
 &rst
  ixpk= 1714, nxpk= 10, iat=1640,1291, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   84 LEU  HA           85 GLN  HN          2.80    (#   1715:10  Unique         2.05, 2.17 A)
 &rst
  ixpk= 1715, nxpk= 10, iat=1274,1291, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   86 PRO  HA           85 GLN  HN          5.50    (#   1716:10  Unique         4.71, 4.92 A)
 &rst
  ixpk= 1716, nxpk= 10, iat=1318,1291, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   85 GLN  HA           85 GLN  HN          3.50    (#   1717:10  Unique         2.82, 2.95 A)
 &rst
  ixpk= 1717, nxpk= 10, iat=1293,1291, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1718    85 GLN  HN          4.50    (#   1718:10  Single Ambig)
 &rst
  ixpk= 1718, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1662,1663,1662,1663,
 &end
#
#  108 PHE  HB+          85 GLN  HN          5.50    (#   1719:10  Unique         3.53, 4.58 A)
 &rst
  ixpk= 1719, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1642,1643,
 &end
#
#    0 AMB  10-2:1721    85 GLN  HN          4.50    (#   1721:10  Single Ambig)
 &rst
  ixpk= 1721, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1298,1299,1298,1299,
 &end
#
#   85 GLN  HB+          85 GLN  HN          3.50    (#   1722:10  Unique         2.76, 3.44 A)
 &rst
  ixpk= 1722, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1295,1296,
 &end
#
#   85 GLN  HB-          85 GLN  HN          3.50    (#   1723:10  Unique         2.76, 3.44 A)
 &rst
  ixpk= 1723, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1295,1296,
 &end
#
#   84 LEU  HG           85 GLN  HN          5.50    (#   1724:10  Unique         2.43, 4.10 A)
 &rst
  ixpk= 1724, nxpk= 10, iat=1279,1291, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 LEU  HB-          85 GLN  HN          3.50    (#   1725:10  Unique         2.20, 3.78 A)
 &rst
  ixpk= 1725, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1276,1277,
 &end
#
#   84 LEU  HB+          85 GLN  HN          3.50    (#   1726:10  Unique         2.20, 3.78 A)
 &rst
  ixpk= 1726, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1276,1277,
 &end
#
#   84 LEU  MDY          85 GLN  HN          4.50    (#   1727:10  Unique         1.92, 4.04 A)
 &rst
  ixpk= 1727, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1281,1282,1283,1285,1286,1287,
 &end
#
#   84 LEU  MDX          85 GLN  HN          4.50    (#   1728:10  Unique         1.92, 4.04 A)
 &rst
  ixpk= 1728, nxpk= 10, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1281,1282,1283,1285,1286,1287,
 &end
#
#  108 PHE  HD           85 GLN  HE2-        5.50    (#   1729:10  Unique         5.40, 7.87 A)
 &rst
  ixpk= 1729, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1646,1654,
 igr2=1303,1304,
 &end
#
#    0 AMB  10-2:1734     0 AMB  10-1:1734   6.50    (#   1734:10  Double Ambig)
 &rst
  ixpk= 1734, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1=1318,2123,
 igr2=1303,1304,1303,1304,
 &end
#
#    0 AMB  10-2:1737     0 AMB  10-1:1737   6.50    (#   1737:10  Double Ambig)
 &rst
  ixpk= 1737, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.32, r4=10.82,
 igr1=1295,1296,1692,1693,
 igr2=1303,1304,1303,1304,
 &end
#
#   89 PRO  HD-          88 LYS  HN          4.50    (#   1738:10  Unique         3.52, 4.86 A)
 &rst
  ixpk= 1738, nxpk= 10, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1365,1366,
 &end
#
#   89 PRO  HA           90 ASP  HN          3.50    (#   1739:10  Unique         2.20, 2.28 A)
 &rst
  ixpk= 1739, nxpk= 10, iat=1374,1378, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   90 ASP  HA           90 ASP  HN          4.50    (#   1740:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 1740, nxpk= 10, iat=1380,1378, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   43 SER  HA           90 ASP  HN          3.50    (#   1741:10  Unique         2.44, 2.86 A)
 &rst
  ixpk= 1741, nxpk= 10, iat= 640,1378, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   96 GLN  HE2-         90 ASP  HN          4.50    (#   1742:10  Unique         2.07, 2.83 A)
 &rst
  ixpk= 1742, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1470,1471,
 &end
#
#   96 GLN  HE2+         90 ASP  HN          4.50    (#   1743:10  Unique         2.07, 2.83 A)
 &rst
  ixpk= 1743, nxpk= 10, iat=  -1,1378, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1470,1471,
 &end
#
#  110 LEU  HN          109 SER  HN          5.50    (#   1747:10  Unique         4.02, 4.31 A)
 &rst
  ixpk= 1747, nxpk= 10, iat=1669,1658, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  125 VAL  MGY         108 PHE  HN          5.50    (#   1748:10  Unique         4.48, 6.47 A)
 &rst
  ixpk= 1748, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#  105 ILE  QG2         106 THR  HN          3.50    (#   1750:10  Unique         2.28, 3.15 A)
 &rst
  ixpk= 1750, nxpk= 10, iat=  -1,1610, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1597,1598,1599,
 &end
#
#  105 ILE  HA          105 ILE  HN          3.50    (#   1751:10  Unique         2.95, 2.99 A)
 &rst
  ixpk= 1751, nxpk= 10, iat=1593,1591, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  104 GLN  HA          105 ILE  HN          2.80    (#   1752:10  Unique         2.16, 2.22 A)
 &rst
  ixpk= 1752, nxpk= 10, iat=1576,1591, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1753   105 ILE  HN          5.50    (#   1753:10  Single Ambig)
 &rst
  ixpk= 1753, nxpk= 10, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1935,1936,1935,1936,
 &end
#
#  104 GLN  HG+         105 ILE  HN          4.50    (#   1754:10  Unique         4.01, 4.61 A)
 &rst
  ixpk= 1754, nxpk= 10, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1581,1582,
 &end
#
#  104 GLN  HG-         105 ILE  HN          4.50    (#   1755:10  Unique         4.01, 4.61 A)
 &rst
  ixpk= 1755, nxpk= 10, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1581,1582,
 &end
#
#    0 AMB  10-2:1756   105 ILE  HN          3.50    (#   1756:10  Single Ambig)
 &rst
  ixpk= 1756, nxpk= 10, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1578,1579,1578,1579,
 &end
#
#  105 ILE  QD1         105 ILE  HN          3.50    (#   1758:10  Unique         2.95, 4.26 A)
 &rst
  ixpk= 1758, nxpk= 10, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1604,1605,1606,
 &end
#
#  105 ILE  QG2         105 ILE  HN          4.50    (#   1759:10  Unique         4.47, 4.81 A)
 &rst
  ixpk= 1759, nxpk= 10, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1597,1598,1599,
 &end
#
#  105 ILE  HB          105 ILE  HN          3.50    (#   1760:10  Unique         2.77, 2.91 A)
 &rst
  ixpk= 1760, nxpk= 10, iat=1595,1591, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  104 GLN  HN          105 ILE  HN          4.50    (#   1761:10  Unique         4.52, 4.55 A)
 &rst
  ixpk= 1761, nxpk= 10, iat=1574,1591, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  129 SER  HN          105 ILE  HN          6.50    (#   1762:10  Unique         3.96, 4.12 A)
 &rst
  ixpk= 1762, nxpk= 10, iat=1931,1591, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   99 ILE  QG2         105 ILE  HN          6.50    (#   1763:10  Unique         5.57, 6.84 A)
 &rst
  ixpk= 1763, nxpk= 10, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1513,1514,1515,
 &end
#
#  100 LEU  HN          101 ALA  HN          4.50    (#   1766:10  Unique         4.56, 4.57 A)
 &rst
  ixpk= 1766, nxpk= 10, iat=1526,1545, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 ILE  HN          100 LEU  HN          5.50    (#   1767:10  Unique         4.26, 4.36 A)
 &rst
  ixpk= 1767, nxpk= 10, iat=1507,1526, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  101 ALA  HN          100 LEU  HN          5.50    (#   1768:10  Unique         4.56, 4.57 A)
 &rst
  ixpk= 1768, nxpk= 10, iat=1545,1526, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 GLN  HN          100 LEU  HN          4.50    (#   1769:10  Unique         3.48, 3.70 A)
 &rst
  ixpk= 1769, nxpk= 10, iat=1574,1526, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  102 ASP  HN          100 LEU  HN          6.50    (#   1770:10  Unique         4.81, 4.94 A)
 &rst
  ixpk= 1770, nxpk= 10, iat=1555,1526, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  105 ILE  HA          100 LEU  HN          3.50    (#   1771:10  Unique         2.94, 3.27 A)
 &rst
  ixpk= 1771, nxpk= 10, iat=1593,1526, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  100 LEU  HA          100 LEU  HN          3.50    (#   1772:10  Unique         2.94, 2.96 A)
 &rst
  ixpk= 1772, nxpk= 10, iat=1528,1526, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   99 ILE  HA          100 LEU  HN          2.80    (#   1773:10  Unique         2.13, 2.18 A)
 &rst
  ixpk= 1773, nxpk= 10, iat=1509,1526, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  100 LEU  HB-         100 LEU  HN          3.50    (#   1774:10  Unique         2.30, 3.11 A)
 &rst
  ixpk= 1774, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1530,1531,
 &end
#
#    0 AMB  10-2:1775   100 LEU  HN          4.50    (#   1775:10  Single Ambig)
 &rst
  ixpk= 1775, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1511,1616,1617,1618,
 &end
#
#  100 LEU  HB+         100 LEU  HN          3.50    (#   1776:10  Unique         2.30, 3.11 A)
 &rst
  ixpk= 1776, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1530,1531,
 &end
#
#   99 ILE  HG1+        100 LEU  HN          4.50    (#   1777:10  Unique         4.38, 4.97 A)
 &rst
  ixpk= 1777, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1517,1518,
 &end
#
#  105 ILE  QG2         100 LEU  HN          4.50    (#   1778:10  Unique         4.29, 5.69 A)
 &rst
  ixpk= 1778, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1597,1598,1599,
 &end
#
#    0 AMB  10-2:1779   100 LEU  HN          4.50    (#   1779:10  Single Ambig)
 &rst
  ixpk= 1779, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1497,1498,1499,1501,1502,1503,1517,1518,
 &end
#
#   99 ILE  QG2         100 LEU  HN          3.50    (#   1780:10  Unique         2.81, 3.59 A)
 &rst
  ixpk= 1780, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1513,1514,1515,
 &end
#
#   31 ALA  MB          100 LEU  HN          5.50    (#   1781:10  Unique         4.95, 5.38 A)
 &rst
  ixpk= 1781, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 471, 472, 473,
 &end
#
#  105 ILE  QD1         100 LEU  HN          3.50    (#   1782:10  Unique         3.12, 4.35 A)
 &rst
  ixpk= 1782, nxpk= 10, iat=  -1,1526, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1604,1605,1606,
 &end
#
#  100 LEU  HN           99 ILE  HN          5.50    (#   1783:10  Unique         4.26, 4.36 A)
 &rst
  ixpk= 1783, nxpk= 10, iat=1526,1507, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1785    99 ILE  HN          4.50    (#   1785:10  Single Ambig)
 &rst
  ixpk= 1785, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 565, 566, 567, 569, 570, 571,1597,1598,1599,
 &end
#
#  106 THR  HB           98 VAL  HN          3.50    (#   1787:10  Unique         2.31, 3.43 A)
 &rst
  ixpk= 1787, nxpk= 10, iat=1614,1491, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   42 PHE  HD           97 VAL  HN          3.50    (#   1788:10  Unique         3.07, 5.53 A)
 &rst
  ixpk= 1788, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 626, 634,
 &end
#
#  121 LEU  HG          121 LEU  HN          4.50    (#   1790:10  Unique         4.03, 4.34 A)
 &rst
  ixpk= 1790, nxpk= 10, iat=1822,1815, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1791   121 LEU  HN          3.50    (#   1791:10  Single Ambig)
 &rst
  ixpk= 1791, nxpk= 10, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1824,1825,1826,1828,1829,1830,1824,1825,1826,1828,
      1829,1830,
 &end
#
#  113 ALA  MB          121 LEU  HN          4.50    (#   1792:10  Unique         3.87, 4.95 A)
 &rst
  ixpk= 1792, nxpk= 10, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1728,1729,1730,
 &end
#
#  121 LEU  HB+         121 LEU  HN          3.50    (#   1793:10  Unique         2.34, 3.07 A)
 &rst
  ixpk= 1793, nxpk= 10, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1819,1820,
 &end
#
#  121 LEU  HB-         121 LEU  HN          3.50    (#   1795:10  Unique         2.34, 3.07 A)
 &rst
  ixpk= 1795, nxpk= 10, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1819,1820,
 &end
#
#    0 AMB  10-2:1796     0 AMB  10-1:1796   5.50    (#   1796:10  Double Ambig)
 &rst
  ixpk= 1796, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1838,1839, 760, 761, 762,
 igr2=1815,1402,
 &end
#
#  120 PRO  HB-         121 LEU  HN          4.50    (#   1797:10  Unique         3.15, 3.67 A)
 &rst
  ixpk= 1797, nxpk= 10, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1808,1809,
 &end
#
#    0 AMB  10-2:1798     0 AMB  10-1:1798   5.50    (#   1798:10  Double Ambig)
 &rst
  ixpk= 1798, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1434,1435,1793,1794,1793,1794,1714,1715,
 igr2=1402,1815,
 &end
#
#  113 ALA  HA          121 LEU  HN          3.50    (#   1799:10  Unique         2.06, 2.64 A)
 &rst
  ixpk= 1799, nxpk= 10, iat=1726,1815, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  122 LEU  HN          121 LEU  HN          3.50    (#   1801:10  Unique         1.96, 2.12 A)
 &rst
  ixpk= 1801, nxpk= 10, iat=1834,1815, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  114 ASN  HN          121 LEU  HN          5.50    (#   1802:10  Unique         3.51, 4.05 A)
 &rst
  ixpk= 1802, nxpk= 10, iat=1734,1815, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 LEU  HN          123 THR  HN          4.50    (#   1807:10  Unique         4.27, 4.34 A)
 &rst
  ixpk= 1807, nxpk= 10, iat=1867,1853, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  137 ALA  HA          123 THR  HN          5.50    (#   1808:10  Unique         3.70, 4.73 A)
 &rst
  ixpk= 1808, nxpk= 10, iat=2063,1853, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  135 THR  HB          123 THR  HN          5.50    (#   1809:10  Unique         4.50, 5.05 A)
 &rst
  ixpk= 1809, nxpk= 10, iat=2032,1853, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1810   123 THR  HN          6.50    (#   1810:10  Single Ambig)
 &rst
  ixpk= 1810, nxpk= 10, iat=  -1,1853, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=2015,2016,2018,2019,
 &end
#
#  134 GLN  HG-         123 THR  HN          6.50    (#   1811:10  Unique         4.58, 5.88 A)
 &rst
  ixpk= 1811, nxpk= 10, iat=  -1,1853, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1=2018,2019,
 &end
#
#  135 THR  MG2         123 THR  HN          4.50    (#   1812:10  Unique         2.31, 3.71 A)
 &rst
  ixpk= 1812, nxpk= 10, iat=  -1,1853, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2034,2035,2036,
 &end
#
#  110 LEU  HN          124 LEU  HN          4.50    (#   1813:10  Unique         2.87, 3.08 A)
 &rst
  ixpk= 1813, nxpk= 10, iat=1669,1867, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1814   124 LEU  HN          4.50    (#   1814:10  Single Ambig)
 &rst
  ixpk= 1814, nxpk= 10, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1886,1853,
 &end
#
#  111 LEU  HA          124 LEU  HN          3.50    (#   1815:10  Unique         2.92, 3.32 A)
 &rst
  ixpk= 1815, nxpk= 10, iat=1690,1867, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  124 LEU  HA          124 LEU  HN          3.50    (#   1816:10  Unique         2.95, 2.97 A)
 &rst
  ixpk= 1816, nxpk= 10, iat=1869,1867, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  123 THR  HA          124 LEU  HN          2.80    (#   1817:10  Unique         2.14, 2.19 A)
 &rst
  ixpk= 1817, nxpk= 10, iat=1855,1867, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1819   124 LEU  HN          5.50    (#   1819:10  Single Ambig)
 &rst
  ixpk= 1819, nxpk= 10, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1662,1663,1662,1663,
 &end
#
#  123 THR  HB          124 LEU  HN          4.50    (#   1820:10  Unique         3.86, 4.05 A)
 &rst
  ixpk= 1820, nxpk= 10, iat=1857,1867, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  124 LEU  HB-         124 LEU  HN          3.50    (#   1821:10  Unique         2.31, 3.09 A)
 &rst
  ixpk= 1821, nxpk= 10, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1871,1872,
 &end
#
#  124 LEU  HG          124 LEU  HN          4.50    (#   1822:10  Unique         2.78, 4.07 A)
 &rst
  ixpk= 1822, nxpk= 10, iat=1874,1867, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1823   124 LEU  HN          3.50    (#   1823:10  Single Ambig)
 &rst
  ixpk= 1823, nxpk= 10, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1871,1872,1673,1674,
 &end
#
#  123 THR  MG2         124 LEU  HN          3.50    (#   1824:10  Unique         2.55, 3.38 A)
 &rst
  ixpk= 1824, nxpk= 10, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1859,1860,1861,
 &end
#
#    0 AMB  10-2:1825   124 LEU  HN          4.50    (#   1825:10  Single Ambig)
 &rst
  ixpk= 1825, nxpk= 10, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1843,1844,1845,1847,1848,1849,1697,1698,1699,1701,
      1702,1703,
 &end
#
#    0 AMB  10-2:1826   124 LEU  HN          4.50    (#   1826:10  Single Ambig)
 &rst
  ixpk= 1826, nxpk= 10, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1678,1679,1680,1682,1683,1684,1678,1679,1680,1682,
      1683,1684,
 &end
#
#  123 THR  HB          125 VAL  HN          6.50    (#   1828:10  Unique         5.31, 6.10 A)
 &rst
  ixpk= 1828, nxpk= 10, iat=1857,1886, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#  110 LEU  HN          126 CYS  HN          5.50    (#   1829:10  Unique         4.54, 5.08 A)
 &rst
  ixpk= 1829, nxpk= 10, iat=1669,1902, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 THR  MG2         126 CYS  HN          6.50    (#   1832:10  Unique         6.31, 7.57 A)
 &rst
  ixpk= 1832, nxpk= 10, iat=  -1,1902, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1=1859,1860,1861,
 &end
#
#  130 TRP  HA          130 TRP  HE1         6.50    (#   1837:10  Unique         5.88, 5.95 A)
 &rst
  ixpk= 1837, nxpk= 10, iat=1944,1952, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   25 GLU  HB-         130 TRP  HE1         6.50    (#   1838:10  Unique         5.30, 6.63 A)
 &rst
  ixpk= 1838, nxpk= 10, iat=  -1,1952, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 372, 373,
 &end
#
#   28 ILE  QD1         130 TRP  HE1         6.50    (#   1839:10  Unique         4.54, 5.60 A)
 &rst
  ixpk= 1839, nxpk= 10, iat=  -1,1952, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr1= 425, 426, 427,
 &end
#
#  126 CYS  HA          133 ASP  HN          4.50    (#   1840:10  Unique         3.49, 3.66 A)
 &rst
  ixpk= 1840, nxpk= 10, iat=1904,1999, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  133 ASP  HB-         133 ASP  HN          2.80    (#   1841:10  Unique         2.33, 2.56 A)
 &rst
  ixpk= 1841, nxpk= 10, iat=  -1,1999, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2003,2004,
 &end
#
#  135 THR  HA          134 GLN  HN          5.50    (#   1842:10  Unique         4.53, 5.03 A)
 &rst
  ixpk= 1842, nxpk= 10, iat=2030,2011, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  134 GLN  HG-         134 GLN  HE2+        3.50    (#   1844:10  Unique         2.35, 3.35 A)
 &rst
  ixpk= 1844, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2018,2019,
 igr2=2023,2024,
 &end
#
#  134 GLN  HG-         134 GLN  HE2-        3.50    (#   1845:10  Unique         2.35, 3.35 A)
 &rst
  ixpk= 1845, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2018,2019,
 igr2=2023,2024,
 &end
#
#  136 LEU  HG          136 LEU  HN          4.50    (#   1847:10  Unique         2.53, 3.81 A)
 &rst
  ixpk= 1847, nxpk= 10, iat=2049,2042, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  135 THR  MG2         136 LEU  HN          4.50    (#   1848:10  Unique         3.25, 4.34 A)
 &rst
  ixpk= 1848, nxpk= 10, iat=  -1,2042, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2034,2035,2036,
 &end
#
#  136 LEU  HB+         136 LEU  HN          3.50    (#   1849:10  Unique         2.30, 2.98 A)
 &rst
  ixpk= 1849, nxpk= 10, iat=  -1,2042, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2046,2047,
 &end
#
#  136 LEU  HB-         136 LEU  HN          3.50    (#   1850:10  Unique         2.30, 2.98 A)
 &rst
  ixpk= 1850, nxpk= 10, iat=  -1,2042, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2046,2047,
 &end
#
#  135 THR  HA          136 LEU  HN          2.80    (#   1851:10  Unique         2.27, 2.35 A)
 &rst
  ixpk= 1851, nxpk= 10, iat=2030,2042, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1852   140 THR  HN          4.50    (#   1852:10  Single Ambig)
 &rst
  ixpk= 1852, nxpk= 10, iat=  -1,2107, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2109,2111,
 &end
#
#  141 ARG  HB+         141 ARG  HN          4.50    (#   1853:10  Unique         2.13, 2.77 A)
 &rst
  ixpk= 1853, nxpk= 10, iat=  -1,2121, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2125,2126,
 &end
#
#    0 AMB  10-2:1854   141 ARG  HN          3.50    (#   1854:10  Single Ambig)
 &rst
  ixpk= 1854, nxpk= 10, iat=  -1,2121, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2075,2076,2075,2076,
 &end
#
#  141 ARG  HA          141 ARG  HN          4.50    (#   1855:10  Unique         2.83, 2.95 A)
 &rst
  ixpk= 1855, nxpk= 10, iat=2123,2121, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  140 THR  HN          141 ARG  HN          5.50    (#   1858:10  Unique         2.39, 2.70 A)
 &rst
  ixpk= 1858, nxpk= 10, iat=2107,2121, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 LEU  HA           10 ASN  HD2-        4.50    (#   1860:10  Unique         3.59, 4.63 A)
 &rst
  ixpk= 1860, nxpk= 10, iat=1817,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 145, 146,
 &end
#
#  121 LEU  HA           10 ASN  HD2+        4.50    (#   1861:10  Unique         3.59, 4.63 A)
 &rst
  ixpk= 1861, nxpk= 10, iat=1817,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 145, 146,
 &end
#
#   10 ASN  HA           10 ASN  HD2-        4.50    (#   1862:10  Unique         3.06, 3.83 A)
 &rst
  ixpk= 1862, nxpk= 10, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 145, 146,
 &end
#
#   10 ASN  HA           10 ASN  HD2+        4.50    (#   1863:10  Unique         3.06, 3.83 A)
 &rst
  ixpk= 1863, nxpk= 10, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 145, 146,
 &end
#
#   10 ASN  HB+          10 ASN  HD2-        3.50    (#   1864:10  Unique         2.17, 3.29 A)
 &rst
  ixpk= 1864, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 140, 141,
 igr2= 145, 146,
 &end
#
#   10 ASN  HB+          10 ASN  HD2+        3.50    (#   1865:10  Unique         2.17, 3.29 A)
 &rst
  ixpk= 1865, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 140, 141,
 igr2= 145, 146,
 &end
#
#   10 ASN  HB-          10 ASN  HD2+        3.50    (#   1866:10  Unique         2.17, 3.29 A)
 &rst
  ixpk= 1866, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 140, 141,
 igr2= 145, 146,
 &end
#
#  121 LEU  MDY          10 ASN  HD2+        4.50    (#   1868:10  Unique         1.93, 5.11 A)
 &rst
  ixpk= 1868, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1824,1825,1826,1828,1829,1830,
 igr2= 145, 146,
 &end
#
#   80 LEU  MDY          10 ASN  HD2+        6.50    (#   1869:10  Unique         6.44, 9.66 A)
 &rst
  ixpk= 1869, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1=1215,1216,1217,1219,1220,1221,
 igr2= 145, 146,
 &end
#
#  136 LEU  HG           10 ASN  HD2-        6.50    (#   1870:10  Unique         3.18, 5.22 A)
 &rst
  ixpk= 1870, nxpk= 10, iat=2049,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2= 145, 146,
 &end
#
#   42 PHE  HN           41 HIS  HN          4.50    (#   1871:10  Unique         3.03, 4.40 A)
 &rst
  ixpk= 1871, nxpk= 10, iat= 618, 601, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   54 LYS  HB-          55 THR  HN          6.50    (#   1872:10  Unique         2.33, 3.54 A)
 &rst
  ixpk= 1872, nxpk= 10, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 807, 808,
 &end
#
#   59 TRP  HZ2          59 TRP  HE1         4.50    (#   1873:10  Unique         2.87, 2.88 A)
 &rst
  ixpk= 1873, nxpk= 10, iat= 887, 884, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   59 TRP  HD1          59 TRP  HE1         3.50    (#   1875:10  Unique         2.54, 2.56 A)
 &rst
  ixpk= 1875, nxpk= 10, iat= 882, 884, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 VAL  HN           61 TRP  HN          6.50    (#   1876:10  Unique         4.37, 4.48 A)
 &rst
  ixpk= 1876, nxpk= 10, iat= 946, 922, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   64 LEU  MDX          65 GLN  HN          4.50    (#   1877:10  Unique         2.62, 5.14 A)
 &rst
  ixpk= 1877, nxpk= 10, iat=  -1, 995, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 985, 986, 987, 989, 990, 991,
 &end
#
#   65 GLN  HB-          65 GLN  HE2+        6.50    (#   1879:10  Unique         2.38, 4.38 A)
 &rst
  ixpk= 1879, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 999,1000,
 igr2=1007,1008,
 &end
#
#   66 GLU  HN           67 ASP  HN          4.50    (#   1881:10  Unique         2.42, 3.13 A)
 &rst
  ixpk= 1881, nxpk= 10, iat=1012,1027, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   68 ALA  HN           67 ASP  HN          4.50    (#   1882:10  Unique         2.02, 2.52 A)
 &rst
  ixpk= 1882, nxpk= 10, iat=1039,1027, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 TRP  HA           53 GLY  HN          5.50    (#   1883:10  Unique         3.17, 3.94 A)
 &rst
  ixpk= 1883, nxpk= 10, iat= 924, 796, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 TRP  HZ2          47 TRP  HE1         4.50    (#   1884:10  Unique         2.85, 2.88 A)
 &rst
  ixpk= 1884, nxpk= 10, iat= 695, 692, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   76 TRP  HD1          47 TRP  HE1         5.50    (#   1885:10  Unique         3.04, 4.76 A)
 &rst
  ixpk= 1885, nxpk= 10, iat=1148, 692, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLN  HN           93 ASN  HN          4.50    (#   1888:10  Unique         2.54, 2.64 A)
 &rst
  ixpk= 1888, nxpk= 10, iat=1427,1413, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   92 SER  HA           93 ASN  HN          4.50    (#   1889:10  Unique         2.21, 2.53 A)
 &rst
  ixpk= 1889, nxpk= 10, iat=1404,1413, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   92 SER  HB+          93 ASN  HN          4.50    (#   1890:10  Unique         3.41, 3.96 A)
 &rst
  ixpk= 1890, nxpk= 10, iat=  -1,1413, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1406,1407,
 &end
#
#   92 SER  HB-          93 ASN  HN          5.50    (#   1891:10  Unique         3.41, 3.96 A)
 &rst
  ixpk= 1891, nxpk= 10, iat=  -1,1413, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1406,1407,
 &end
#
#   93 ASN  HB+          93 ASN  HN          5.50    (#   1892:10  Unique         2.37, 2.99 A)
 &rst
  ixpk= 1892, nxpk= 10, iat=  -1,1413, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1417,1418,
 &end
#
#   95 PRO  HB-          97 VAL  HN          3.50    (#   1893:10  Unique         2.45, 3.83 A)
 &rst
  ixpk= 1893, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1451,1452,
 &end
#
#   47 TRP  HZ2          76 TRP  HE1         6.50    (#   1896:10  Unique         2.83, 4.79 A)
 &rst
  ixpk= 1896, nxpk= 10, iat= 695,1150, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   76 TRP  HD1          76 TRP  HE1         4.50    (#   1897:10  Unique         2.54, 2.56 A)
 &rst
  ixpk= 1897, nxpk= 10, iat=1148,1150, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1898    48 ARG  HN          5.50    (#   1898:10  Single Ambig)
 &rst
  ixpk= 1898, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 716, 717, 716, 717,
 &end
#
#   52 PRO  HB-          53 GLY  HN          5.50    (#   1899:10  Unique         2.59, 3.32 A)
 &rst
  ixpk= 1899, nxpk= 10, iat=  -1, 796, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 789, 790,
 &end
#
#   19 ARG  HB-          19 ARG  HN          2.80    (#   1901:10  Unique         2.21, 2.80 A)
 &rst
  ixpk= 1901, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 275, 276,
 &end
#
#   43 SER  HB-          44 ASP  HN          4.50    (#   1902:10  Unique         1.98, 3.19 A)
 &rst
  ixpk= 1902, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 642, 643,
 &end
#
#    0 AMB  10-2:1903    50 MET  HN          5.50    (#   1903:10  Single Ambig)
 &rst
  ixpk= 1903, nxpk= 10, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 406, 407, 408, 586,
 &end
#
#   83 HIS  HN           82 ILE  HN          4.50    (#   1904:10  Unique         4.46, 4.49 A)
 &rst
  ixpk= 1904, nxpk= 10, iat=1255,1236, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 ASP  HB-          29 ASP  HN          3.50    (#   1908:10  Unique         2.29, 2.48 A)
 &rst
  ixpk= 1908, nxpk= 10, iat=  -1, 431, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 435, 436,
 &end
#
#   10 ASN  HB+          11 THR  HN          3.50    (#   1911:10  Unique         2.34, 3.17 A)
 &rst
  ixpk= 1911, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 140, 141,
 &end
#
#   10 ASN  HB-          11 THR  HN          3.50    (#   1912:10  Unique         2.34, 3.17 A)
 &rst
  ixpk= 1912, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 140, 141,
 &end
#
#   15 GLU  HB-          15 GLU  HN          2.80    (#   1913:10  Unique         2.15, 2.82 A)
 &rst
  ixpk= 1913, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 226, 227,
 &end
#
#   42 PHE  HN           43 SER  HN          6.50    (#   1915:10  Unique         3.75, 4.18 A)
 &rst
  ixpk= 1915, nxpk= 10, iat= 618, 638, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   40 ILE  HB           97 VAL  HN          4.50    (#   1916:10  Unique         3.44, 3.82 A)
 &rst
  ixpk= 1916, nxpk= 10, iat= 586,1475, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  104 GLN  HB+         104 GLN  HN          3.50    (#   1917:10  Unique         2.38, 3.08 A)
 &rst
  ixpk= 1917, nxpk= 10, iat=  -1,1574, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1578,1579,
 &end
#
#   50 MET  HG-          41 HIS  HN          6.50    (#   1918:10  Unique         2.92, 4.34 A)
 &rst
  ixpk= 1918, nxpk= 10, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 756, 757,
 &end
#
#    0 AMB  10-2:1920     0 AMB  10-1:1920   6.50    (#   1920:10  Double Ambig)
 &rst
  ixpk= 1920, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
 igr1= 237, 164,
 igr2= 180, 181, 180, 181,
 &end
#
#    0 AMB  10-2:1922     0 AMB  10-1:1922   5.50    (#   1922:10  Double Ambig)
 &rst
  ixpk= 1922, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 166,1178,
 igr2= 180, 181, 180, 181,
 &end
#
#   12 ARG  HD+          12 ARG  HH1+        4.50    (#   1923:10  Unique         1.94, 3.34 A)
 &rst
  ixpk= 1923, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 174, 175,
 igr2= 180, 181,
 &end
#
#   12 ARG  HD-          12 ARG  HH1+        4.50    (#   1924:10  Unique         1.94, 3.34 A)
 &rst
  ixpk= 1924, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 174, 175,
 igr2= 180, 181,
 &end
#
#   12 ARG  HB+          12 ARG  HH1+        4.50    (#   1925:10  Unique         3.23, 5.36 A)
 &rst
  ixpk= 1925, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 168, 169,
 igr2= 180, 181,
 &end
#
#   12 ARG  HG+          12 ARG  HH1+        5.50    (#   1926:10  Unique         2.17, 4.57 A)
 &rst
  ixpk= 1926, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 171, 172,
 igr2= 180, 181,
 &end
#
#    8 VAL  MGY          12 ARG  HH1+        5.50    (#   1927:10  Unique         2.49, 6.51 A)
 &rst
  ixpk= 1927, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 116, 117, 118, 120, 121, 122,
 igr2= 180, 181,
 &end
#
#    0 AMB  10-2:1928   110 LEU  HN          4.50    (#   1928:10  Single Ambig)
 &rst
  ixpk= 1928, nxpk= 10, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1688,1902,
 &end
#
#  125 VAL  MGY         126 CYS  HN          3.50    (#   1929:10  Unique         2.67, 4.16 A)
 &rst
  ixpk= 1929, nxpk= 10, iat=  -1,1902, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#  124 LEU  MDX         123 THR  HN          4.50    (#   1930:10  Unique         3.49, 6.05 A)
 &rst
  ixpk= 1930, nxpk= 10, iat=  -1,1853, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1876,1877,1878,1880,1881,1882,
 &end
#
#  131 PRO  HB+         132 LEU  HN          4.50    (#   1931:10  Unique         2.33, 3.75 A)
 &rst
  ixpk= 1931, nxpk= 10, iat=  -1,1980, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1973,1974,
 &end
#
#  100 LEU  MDX          38 VAL  HN          5.50    (#   1932:10  Unique         4.75, 6.83 A)
 &rst
  ixpk= 1932, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1535,1536,1537,1539,1540,1541,
 &end
#
#    0 AMB  10-2:1933     0 AMB  10-1:1933   6.50    (#   1933:10  Double Ambig)
 &rst
  ixpk= 1933, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
 igr1= 950,1434,1435,
 igr2= 540, 541, 540, 541,
 &end
#
#   61 TRP  HH2          36 GLN  HE2+        3.50    (#   1935:10  Unique         3.06, 4.13 A)
 &rst
  ixpk= 1935, nxpk= 10, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 540, 541,
 &end
#
#   37 PRO  HD-          36 GLN  HE2-        6.50    (#   1936:10  Unique         2.86, 5.46 A)
 &rst
  ixpk= 1936, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 546, 547,
 igr2= 540, 541,
 &end
#
#    0 AMB  10-2:1938    36 GLN  HE2-        3.50    (#   1938:10  Single Ambig)
 &rst
  ixpk= 1938, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 535, 536, 535, 536,
 igr2= 540, 541,
 &end
#
#   99 ILE  QD1          99 ILE  HN          3.50    (#   1944:10  Unique         2.37, 3.32 A)
 &rst
  ixpk= 1944, nxpk= 10, iat=  -1,1507, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1520,1521,1522,
 &end
#
#  108 PHE  HN          128 GLY  HN          5.50    (#   1945:10  Unique         4.40, 4.98 A)
 &rst
  ixpk= 1945, nxpk= 10, iat=1638,1924, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1946   108 PHE  HN          6.50    (#   1946:10  Single Ambig)
 &rst
  ixpk= 1946, nxpk= 10, iat=  -1,1638, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1=1662,1663,1662,1663,
 &end
#
#   40 ILE  HB           40 ILE  HN          3.50    (#   1947:10  Unique         2.77, 2.85 A)
 &rst
  ixpk= 1947, nxpk= 10, iat= 586, 582, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1948    26 LEU  HN          4.50    (#   1948:10  Single Ambig)
 &rst
  ixpk= 1948, nxpk= 10, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 392, 393, 394, 396, 397, 398, 736, 737, 738,
 &end
#
#  103 GLY  HA-         102 ASP  HN          4.50    (#    454:10  Unique         )
 &rst
  ixpk= 454, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1569,1570,
 &end
#
#  103 GLY  HA+         103 GLY  HN          2.80    (#    469:10  Unique         )
 &rst
  ixpk= 469, nxpk= 10, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1569,1570,
 &end
#
#  103 GLY  HA+         102 ASP  HN          5.50    (#    456:10  Unique         )
 &rst
  ixpk= 456, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1569,1570,
 &end
#
#  103 GLY  HA-         103 GLY  HN          3.50    (#    467:10  Unique         )
 &rst
  ixpk= 467, nxpk= 10, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1569,1570,
 &end
#
#  103 GLY  HA+         104 GLN  HN          3.50    (#    482:10  Unique         )
 &rst
  ixpk= 482, nxpk= 10, iat=  -1,1574, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1569,1570,
 &end
#
#  103 GLY  HA-         104 GLN  HN          4.50    (#    480:10  Unique         )
 &rst
  ixpk= 480, nxpk= 10, iat=  -1,1574, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1569,1570,
 &end
#
#  104 GLN  HG-         104 GLN  HN          2.80    (#   1142:10  Unique         )
 &rst
  ixpk= 1142, nxpk= 10, iat=  -1,1574, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1581,1582,
 &end
#
#  104 GLN  HN          104 GLN  HE2+        3.50    (#    479:10  Unique)
 &rst
  ixpk= 479, nxpk= 10, iat=1574,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1586,1587,
 &end
#
#  110 LEU  HN          111 LEU  HN          4.50    (#   1316:10  Unique)
 &rst
  ixpk= 1316, nxpk= 10, iat=1669,1688, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  116 GLY  HA-         116 GLY  HN          2.80    (#   1303:10  Unique         )
 &rst
  ixpk= 1303, nxpk= 10, iat=  -1,1758, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1760,1761,
 &end
#
#  116 GLY  HA-         117 THR  HN          3.50    (#    603:10  Unique         )
 &rst
  ixpk= 603, nxpk= 10, iat=  -1,1765, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1760,1761,
 &end
#
#  123 THR  MG2         123 THR  HN          4.50    (#    629:10  Unique)
 &rst
  ixpk= 629, nxpk= 10, iat=  -1,1853, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1859,1860,1861,
 &end
#
#  125 VAL  MGX         126 CYS  HN          2.80    (#    648:10  Unique)
 &rst
  ixpk= 648, nxpk= 10, iat=  -1,1902, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1892,1893,1894,1896,1897,1898,
 &end
#
#  128 GLY  HA+         127 SER  HN          5.50    (#   1323:10  Unique         )
 &rst
  ixpk= 1323, nxpk= 10, iat=  -1,1913, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1926,1927,
 &end
#
#  128 GLY  HA-         128 GLY  HN          2.80    (#   1447:10  Unique         )
 &rst
  ixpk= 1447, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1926,1927,
 &end
#
#  128 GLY  HA+         128 GLY  HN          3.50    (#   1448:10  Unique         )
 &rst
  ixpk= 1448, nxpk= 10, iat=  -1,1924, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1926,1927,
 &end
#
#  128 GLY  HA-         129 SER  HN          3.50    (#    683:10  Unique         )
 &rst
  ixpk= 683, nxpk= 10, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1926,1927,
 &end
#
#  128 GLY  HA+         129 SER  HN          3.50    (#    684:10  Unique         )
 &rst
  ixpk= 684, nxpk= 10, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1926,1927,
 &end
#
#  141 ARG  HG+         141 ARG  HN          4.50    (#    747:10  Unique)
 &rst
  ixpk= 747, nxpk= 10, iat=  -1,2121, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2128,2129,
 &end
#
#   15 GLU  HB-          15 GLU  HN          2.80    (#     70:10  Unique )
 &rst
  ixpk= 70, nxpk= 10, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 226, 227,
 &end
#
#   17 ALA  MB           18 ALA  HN          2.80    (#   1513:10  Unique)
 &rst
  ixpk= 1513, nxpk= 10, iat=  -1, 261, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 255, 256, 257,
 &end
#
#   19 ARG  HB+          19 ARG  HN          2.80    (#     96:10  Unique)
 &rst
  ixpk= 96, nxpk= 10, iat=  -1, 271, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 275, 276,
 &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1  -0.503  10.341   3.955
    2    H2   MET   1           H2       MET   1  -1.772   9.911   3.021
    3    H3   MET   1           H3       MET   1  -1.813   9.647   4.638
    4    HA   MET   1           HA       MET   1  -0.010   8.050   4.487
    5    HB2  MET   1           HB2      MET   1  -2.359   7.466   2.626
    6    HB3  MET   1           HB3      MET   1  -1.167   6.270   3.118
    7    HG2  MET   1           HG2      MET   1  -3.062   7.768   4.958
    8    HG3  MET   1           HG3      MET   1  -3.177   6.085   4.476
    9    HE1  MET   1           HE1      MET   1  -1.783   4.122   5.429
   10    HE2  MET   1           HE2      MET   1  -0.283   4.833   4.786
   11    HE3  MET   1           HE3      MET   1  -0.362   4.307   6.479
   12    H    ALA   2           H        ALA   2   1.593   7.008   3.319
   13    HA   ALA   2           HA       ALA   2   2.023   7.603   0.464
   14    HB1  ALA   2           HB1      ALA   2   3.989   8.426   2.656
   15    HB2  ALA   2           HB2      ALA   2   4.280   8.515   0.905
   16    HB3  ALA   2           HB3      ALA   2   3.037   9.536   1.644
   17    H    TYR   3           H        TYR   3   3.890   6.358  -0.410
   18    HA   TYR   3           HA       TYR   3   3.873   3.619   0.605
   19    HB2  TYR   3           HB2      TYR   3   5.150   5.056  -1.723
   20    HB3  TYR   3           HB3      TYR   3   5.623   3.418  -1.327
   21    HD1  TYR   3           HD1      TYR   3   2.527   5.446  -2.064
   22    HD2  TYR   3           HD2      TYR   3   4.467   1.594  -2.202
   23    HE1  TYR   3           HE1      TYR   3   0.623   4.532  -3.377
   24    HE2  TYR   3           HE2      TYR   3   2.569   0.686  -3.520
   25    HH   TYR   3           HH       TYR   3   0.533   1.121  -4.476
   26    H    GLY   4           H        GLY   4   5.943   6.309   1.321
   27    HA2  GLY   4           HA2      GLY   4   7.805   6.476   2.668
   28    HA3  GLY   4           HA3      GLY   4   7.568   4.792   3.139
   29    H    ARG   5           H        ARG   5   8.041   5.670  -0.206
   30    HA   ARG   5           HA       ARG   5  10.857   4.666  -0.298
   31    HB2  ARG   5           HB2      ARG   5   9.230   2.802  -0.523
   32    HB3  ARG   5           HB3      ARG   5   8.484   3.597  -1.894
   33    HG2  ARG   5           HG2      ARG   5  11.390   3.265  -2.299
   34    HG3  ARG   5           HG3      ARG   5  10.630   1.730  -1.881
   35    HD2  ARG   5           HD2      ARG   5   9.050   1.888  -3.688
   36    HD3  ARG   5           HD3      ARG   5   9.502   3.553  -4.036
   37    HE   ARG   5           HE       ARG   5  10.918   1.135  -4.867
   38   HH11  ARG   5          HH11      ARG   5  11.340   4.606  -4.385
   39   HH12  ARG   5          HH12      ARG   5  12.462   4.693  -5.757
   40   HH21  ARG   5          HH21      ARG   5  12.395   1.405  -6.526
   41   HH22  ARG   5          HH22      ARG   5  13.015   3.002  -6.895
   42    H    GLU   6           H        GLU   6   9.874   7.320  -0.500
   43    HA   GLU   6           HA       GLU   6   9.802   8.027  -3.381
   44    HB2  GLU   6           HB2      GLU   6   9.306   9.663  -0.871
   45    HB3  GLU   6           HB3      GLU   6   9.112  10.248  -2.525
   46    HG2  GLU   6           HG2      GLU   6   7.332   8.596  -2.938
   47    HG3  GLU   6           HG3      GLU   6   7.506   7.969  -1.294
   48    H    ASP   7           H        ASP   7  12.069   8.448  -0.676
   49    HA   ASP   7           HA       ASP   7  13.241  10.850  -1.451
   50    HB2  ASP   7           HB2      ASP   7  13.569   9.694   0.703
   51    HB3  ASP   7           HB3      ASP   7  14.564   8.475  -0.093
   52    H    VAL   8           H        VAL   8  14.162   7.630  -2.600
   53    HA   VAL   8           HA       VAL   8  16.477   8.443  -4.115
   54    HB   VAL   8           HB       VAL   8  14.692   6.059  -4.736
   55   HG11  VAL   8          HG11      VAL   8  17.693   6.506  -5.102
   56   HG12  VAL   8          HG12      VAL   8  16.771   5.063  -5.584
   57   HG13  VAL   8          HG13      VAL   8  16.492   6.603  -6.401
   58   HG21  VAL   8          HG21      VAL   8  15.200   5.867  -2.374
   59   HG22  VAL   8          HG22      VAL   8  16.184   4.721  -3.276
   60   HG23  VAL   8          HG23      VAL   8  16.919   6.227  -2.676
   61    H    ALA   9           H        ALA   9  13.068   7.862  -5.098
   62    HA   ALA   9           HA       ALA   9  13.421   8.673  -7.821
   63    HB1  ALA   9           HB1      ALA   9  11.567   7.240  -7.037
   64    HB2  ALA   9           HB2      ALA   9  10.920   8.590  -6.076
   65    HB3  ALA   9           HB3      ALA   9  10.958   8.691  -7.854
   66    H    ASN  10           H        ASN  10  12.431  10.514  -4.903
   67    HA   ASN  10           HA       ASN  10  11.899  12.988  -6.232
   68    HB2  ASN  10           HB2      ASN  10  11.165  12.440  -3.934
   69    HB3  ASN  10           HB3      ASN  10  12.839  12.354  -3.395
   70   HD21  ASN  10          HD22      ASN  10  10.182  14.549  -4.130
   71   HD22  ASN  10          HD21      ASN  10  11.067  15.985  -3.670
   72    H    THR  11           H        THR  11  14.952  11.669  -4.875
   73    HA   THR  11           HA       THR  11  16.590  13.912  -5.647
   74    HB   THR  11           HB       THR  11  17.421  11.005  -5.321
   75    HG1  THR  11           HG1      THR  11  16.506  11.639  -3.448
   76   HG21  THR  11          HG21      THR  11  19.597  12.006  -4.668
   77   HG22  THR  11          HG22      THR  11  19.192  12.398  -6.344
   78   HG23  THR  11          HG23      THR  11  18.981  13.623  -5.076
   79    H    ARG  12           H        ARG  12  15.926  10.823  -7.387
   80    HA   ARG  12           HA       ARG  12  17.316  11.610  -9.772
   81    HB2  ARG  12           HB2      ARG  12  15.067   9.629  -9.283
   82    HB3  ARG  12           HB3      ARG  12  15.818   9.841 -10.863
   83    HG2  ARG  12           HG2      ARG  12  17.339   9.026  -8.343
   84    HG3  ARG  12           HG3      ARG  12  16.728   7.915  -9.570
   85    HD2  ARG  12           HD2      ARG  12  18.142   9.018 -11.285
   86    HD3  ARG  12           HD3      ARG  12  18.815  10.074 -10.048
   87    HE   ARG  12           HE       ARG  12  19.351   7.177 -10.422
   88   HH11  ARG  12          HH12      ARG  12  20.198  10.028  -8.477
   89   HH12  ARG  12          HH11      ARG  12  21.333   9.071  -7.564
   90   HH21  ARG  12          HH21      ARG  12  20.864   6.227  -9.426
   91   HH22  ARG  12          HH22      ARG  12  21.781   6.983  -8.120
   92    H    ALA  13           H        ALA  13  13.950  12.400  -8.811
   93    HA   ALA  13           HA       ALA  13  13.186  13.579 -11.293
   94    HB1  ALA  13           HB1      ALA  13  12.328  14.330  -8.477
   95    HB2  ALA  13           HB2      ALA  13  11.471  14.671  -9.993
   96    HB3  ALA  13           HB3      ALA  13  11.638  12.999  -9.435
   97    H    ARG  14           H        ARG  14  14.731  15.034  -8.396
   98    HA   ARG  14           HA       ARG  14  14.924  17.710  -9.465
   99    HB2  ARG  14           HB2      ARG  14  16.465  16.237  -7.277
  100    HB3  ARG  14           HB3      ARG  14  16.677  17.958  -7.648
  101    HG2  ARG  14           HG2      ARG  14  14.288  18.374  -7.239
  102    HG3  ARG  14           HG3      ARG  14  14.013  16.673  -6.855
  103    HD2  ARG  14           HD2      ARG  14  16.083  18.306  -5.349
  104    HD3  ARG  14           HD3      ARG  14  14.361  18.422  -4.954
  105    HE   ARG  14           HE       ARG  14  14.288  16.157  -4.274
  106   HH11  ARG  14          HH11      ARG  14  17.640  17.067  -4.851
  107   HH12  ARG  14          HH12      ARG  14  18.208  15.793  -3.813
  108   HH21  ARG  14          HH21      ARG  14  15.044  14.662  -3.066
  109   HH22  ARG  14          HH22      ARG  14  16.748  14.259  -3.028
  110    H    GLU  15           H        GLU  15  17.204  15.008  -9.488
  111    HA   GLU  15           HA       GLU  15  19.252  16.256 -11.098
  112    HB2  GLU  15           HB2      GLU  15  18.285  13.375 -10.895
  113    HB3  GLU  15           HB3      GLU  15  19.657  13.884 -11.877
  114    HG2  GLU  15           HG2      GLU  15  20.925  14.543  -9.942
  115    HG3  GLU  15           HG3      GLU  15  19.550  14.230  -8.872
  116    H    THR  16           H        THR  16  16.434  14.281 -12.157
  117    HA   THR  16           HA       THR  16  16.939  14.452 -14.941
  118    HB   THR  16           HB       THR  16  14.282  14.118 -13.495
  119    HG1  THR  16           HG1      THR  16  15.711  12.543 -12.958
  120   HG21  THR  16          HG21      THR  16  13.876  14.577 -15.902
  121   HG22  THR  16          HG22      THR  16  15.070  13.327 -16.333
  122   HG23  THR  16          HG23      THR  16  13.568  12.879 -15.495
  123    H    ALA  17           H        ALA  17  15.151  16.670 -12.819
  124    HA   ALA  17           HA       ALA  17  14.347  18.481 -14.882
  125    HB1  ALA  17           HB1      ALA  17  13.315  18.441 -12.676
  126    HB2  ALA  17           HB2      ALA  17  14.853  18.903 -11.910
  127    HB3  ALA  17           HB3      ALA  17  14.020  20.050 -12.980
  128    H    ALA  18           H        ALA  18  17.341  18.452 -12.847
  129    HA   ALA  18           HA       ALA  18  18.455  20.823 -14.028
  130    HB1  ALA  18           HB1      ALA  18  19.854  18.402 -12.801
  131    HB2  ALA  18           HB2      ALA  18  20.570  20.000 -13.087
  132    HB3  ALA  18           HB3      ALA  18  19.251  19.819 -11.914
  133    H    ARG  19           H        ARG  19  18.736  17.371 -14.919
  134    HA   ARG  19           HA       ARG  19  20.464  17.711 -17.209
  135    HB2  ARG  19           HB2      ARG  19  18.459  15.529 -16.480
  136    HB3  ARG  19           HB3      ARG  19  19.527  15.449 -17.889
  137    HG2  ARG  19           HG2      ARG  19  21.514  15.603 -16.469
  138    HG3  ARG  19           HG3      ARG  19  20.519  15.777 -15.023
  139    HD2  ARG  19           HD2      ARG  19  19.566  13.517 -15.416
  140    HD3  ARG  19           HD3      ARG  19  20.631  13.329 -16.826
  141    HE   ARG  19           HE       ARG  19  22.542  13.745 -15.162
  142   HH11  ARG  19          HH11      ARG  19  19.718  11.865 -14.046
  143   HH12  ARG  19          HH12      ARG  19  20.494  11.719 -12.461
  144   HH21  ARG  19          HH21      ARG  19  23.339  13.274 -13.107
  145   HH22  ARG  19          HH22      ARG  19  22.288  12.382 -12.008
  146    H    PHE  20           H        PHE  20  16.881  17.544 -17.041
  147    HA   PHE  20           HA       PHE  20  16.405  18.115 -19.779
  148    HB2  PHE  20           HB2      PHE  20  14.634  17.330 -18.292
  149    HB3  PHE  20           HB3      PHE  20  14.786  18.767 -17.291
  150    HD1  PHE  20           HD2      PHE  20  14.334  18.013 -20.987
  151    HD2  PHE  20           HD1      PHE  20  13.184  20.431 -17.602
  152    HE1  PHE  20           HE2      PHE  20  12.692  19.209 -22.388
  153    HE2  PHE  20           HE1      PHE  20  11.578  21.663 -19.035
  154    HZ   PHE  20           HZ       PHE  20  11.337  21.057 -21.442
  155    H    THR  21           H        THR  21  16.793  20.427 -17.029
  156    HA   THR  21           HA       THR  21  16.331  22.781 -18.559
  157    HB   THR  21           HB       THR  21  18.117  22.492 -16.112
  158    HG1  THR  21           HG1      THR  21  16.074  21.773 -15.675
  159   HG21  THR  21          HG21      THR  21  18.452  24.696 -17.082
  160   HG22  THR  21          HG22      THR  21  16.699  24.916 -17.321
  161   HG23  THR  21          HG23      THR  21  17.383  24.872 -15.689
  162    H    ALA  22           H        ALA  22  19.463  21.053 -17.955
  163    HA   ALA  22           HA       ALA  22  21.001  22.806 -19.616
  164    HB1  ALA  22           HB1      ALA  22  22.649  20.963 -19.586
  165    HB2  ALA  22           HB2      ALA  22  21.975  21.241 -17.968
  166    HB3  ALA  22           HB3      ALA  22  21.419  19.858 -18.936
  167    H    ALA  23           H        ALA  23  19.208  19.816 -20.449
  168    HA   ALA  23           HA       ALA  23  19.962  19.751 -23.206
  169    HB1  ALA  23           HB1      ALA  23  17.425  18.684 -21.916
  170    HB2  ALA  23           HB2      ALA  23  18.161  18.156 -23.445
  171    HB3  ALA  23           HB3      ALA  23  18.999  17.856 -21.916
  172    H    LEU  24           H        LEU  24  17.336  21.488 -21.556
  173    HA   LEU  24           HA       LEU  24  16.130  22.566 -23.941
  174    HB2  LEU  24           HB2      LEU  24  14.990  22.227 -21.766
  175    HB3  LEU  24           HB3      LEU  24  16.034  23.425 -21.030
  176    HG   LEU  24           HG       LEU  24  15.048  25.158 -22.615
  177   HD11  LEU  24          HD11      LEU  24  12.894  24.583 -23.699
  178   HD12  LEU  24          HD12      LEU  24  14.213  23.615 -24.373
  179   HD13  LEU  24          HD13      LEU  24  13.086  22.888 -23.208
  180   HD21  LEU  24          HD21      LEU  24  13.101  23.633 -20.840
  181   HD22  LEU  24          HD22      LEU  24  14.237  24.881 -20.292
  182   HD23  LEU  24          HD23      LEU  24  12.913  25.316 -21.388
  183    H    GLU  25           H        GLU  25  18.740  23.730 -21.762
  184    HA   GLU  25           HA       GLU  25  19.145  26.264 -23.062
  185    HB2  GLU  25           HB2      GLU  25  20.200  25.460 -20.870
  186    HB3  GLU  25           HB3      GLU  25  21.332  24.530 -21.845
  187    HG2  GLU  25           HG2      GLU  25  22.056  26.627 -22.982
  188    HG3  GLU  25           HG3      GLU  25  20.913  27.544 -21.999
  189    H    LEU  26           H        LEU  26  20.575  23.042 -23.661
  190    HA   LEU  26           HA       LEU  26  22.040  23.528 -26.026
  191    HB2  LEU  26           HB2      LEU  26  22.372  21.438 -25.099
  192    HB3  LEU  26           HB3      LEU  26  20.698  21.231 -24.684
  193    HG   LEU  26           HG       LEU  26  20.192  20.784 -27.151
  194   HD11  LEU  26          HD11      LEU  26  23.224  20.478 -27.246
  195   HD12  LEU  26          HD12      LEU  26  22.075  20.032 -28.527
  196   HD13  LEU  26          HD13      LEU  26  22.292  21.734 -28.091
  197   HD21  LEU  26          HD21      LEU  26  20.243  19.029 -25.483
  198   HD22  LEU  26          HD22      LEU  26  20.969  18.462 -26.992
  199   HD23  LEU  26          HD23      LEU  26  22.014  18.903 -25.620
  200    H    ALA  27           H        ALA  27  18.563  22.735 -25.721
  201    HA   ALA  27           HA       ALA  27  17.959  22.851 -28.479
  202    HB1  ALA  27           HB1      ALA  27  16.432  21.885 -26.847
  203    HB2  ALA  27           HB2      ALA  27  16.225  23.455 -26.046
  204    HB3  ALA  27           HB3      ALA  27  15.612  23.233 -27.677
  205    H    ILE  28           H        ILE  28  17.830  25.537 -26.078
  206    HA   ILE  28           HA       ILE  28  16.952  27.564 -27.920
  207    HB   ILE  28           HB       ILE  28  18.561  27.745 -25.343
  208   HG12  ILE  28          HG12      ILE  28  15.623  28.426 -25.777
  209   HG13  ILE  28          HG13      ILE  28  16.128  26.799 -25.353
  210   HG21  ILE  28          HG21      ILE  28  17.206  29.964 -26.949
  211   HG22  ILE  28          HG22      ILE  28  17.829  30.152 -25.296
  212   HG23  ILE  28          HG23      ILE  28  18.943  29.809 -26.610
  213   HD11  ILE  28          HD11      ILE  28  15.482  27.846 -23.359
  214   HD12  ILE  28          HD12      ILE  28  17.243  27.676 -23.305
  215   HD13  ILE  28          HD13      ILE  28  16.515  29.265 -23.655
  216    H    ASP  29           H        ASP  29  20.259  26.568 -26.912
  217    HA   ASP  29           HA       ASP  29  21.678  28.386 -28.582
  218    HB2  ASP  29           HB2      ASP  29  22.641  27.125 -26.681
  219    HB3  ASP  29           HB3      ASP  29  22.469  25.622 -27.587
  220    H    ARG  30           H        ARG  30  20.369  25.158 -29.295
  221    HA   ARG  30           HA       ARG  30  21.490  25.039 -31.973
  222    HB2  ARG  30           HB2      ARG  30  20.975  23.040 -30.631
  223    HB3  ARG  30           HB3      ARG  30  19.264  23.450 -30.615
  224    HG2  ARG  30           HG2      ARG  30  19.777  21.646 -32.196
  225    HG3  ARG  30           HG3      ARG  30  19.088  23.043 -33.010
  226    HD2  ARG  30           HD2      ARG  30  21.391  23.729 -33.728
  227    HD3  ARG  30           HD3      ARG  30  22.050  22.312 -32.911
  228    HE   ARG  30           HE       ARG  30  20.193  22.326 -35.274
  229   HH11  ARG  30          HH11      ARG  30  22.732  20.575 -33.509
  230   HH12  ARG  30          HH12      ARG  30  22.652  19.258 -34.691
  231   HH21  ARG  30          HH21      ARG  30  20.368  20.534 -36.714
  232   HH22  ARG  30          HH22      ARG  30  21.491  19.244 -36.266
  233    H    ALA  31           H        ALA  31  18.380  26.236 -30.724
  234    HA   ALA  31           HA       ALA  31  17.013  26.338 -33.196
  235    HB1  ALA  31           HB1      ALA  31  15.518  27.942 -32.030
  236    HB2  ALA  31           HB2      ALA  31  15.923  26.557 -31.003
  237    HB3  ALA  31           HB3      ALA  31  16.723  28.109 -30.729
  238    H    THR  32           H        THR  32  19.243  28.824 -31.897
  239    HA   THR  32           HA       THR  32  18.628  30.696 -34.050
  240    HB   THR  32           HB       THR  32  19.553  31.385 -31.855
  241    HG1  THR  32           HG1      THR  32  20.837  32.961 -32.775
  242   HG21  THR  32          HG21      THR  32  21.345  29.707 -31.556
  243   HG22  THR  32          HG22      THR  32  22.228  30.392 -32.941
  244   HG23  THR  32          HG23      THR  32  21.966  31.356 -31.474
  245    H    LEU  33           H        LEU  33  20.820  27.978 -33.754
  246    HA   LEU  33           HA       LEU  33  22.359  28.591 -36.132
  247    HB2  LEU  33           HB2      LEU  33  22.099  26.084 -34.425
  248    HB3  LEU  33           HB3      LEU  33  23.302  26.317 -35.694
  249    HG   LEU  33           HG       LEU  33  23.088  27.931 -33.116
  250   HD11  LEU  33          HD11      LEU  33  25.124  25.856 -34.027
  251   HD12  LEU  33          HD12      LEU  33  25.171  26.780 -32.508
  252   HD13  LEU  33          HD13      LEU  33  23.870  25.616 -32.789
  253   HD21  LEU  33          HD21      LEU  33  25.161  28.047 -35.348
  254   HD22  LEU  33          HD22      LEU  33  24.038  29.344 -34.876
  255   HD23  LEU  33          HD23      LEU  33  25.313  28.842 -33.765
  256    H    SER  34           H        SER  34  19.533  26.641 -35.368
  257    HA   SER  34           HA       SER  34  19.644  24.999 -37.742
  258    HB2  SER  34           HB2      SER  34  17.441  25.391 -35.685
  259    HB3  SER  34           HB3      SER  34  17.494  24.119 -36.924
  260    HG   SER  34           HG       SER  34  19.290  24.561 -34.782
  261    H    GLY  35           H        GLY  35  18.142  28.114 -37.202
  262    HA2  GLY  35           HA2      GLY  35  17.089  29.501 -38.739
  263    HA3  GLY  35           HA3      GLY  35  17.242  28.249 -39.970
  264    H    GLN  36           H        GLN  36  15.716  26.910 -37.324
  265    HA   GLN  36           HA       GLN  36  12.958  27.826 -37.782
  266    HB2  GLN  36           HB2      GLN  36  13.279  25.803 -39.283
  267    HB3  GLN  36           HB3      GLN  36  13.821  24.897 -37.870
  268    HG2  GLN  36           HG2      GLN  36  11.519  25.311 -36.837
  269    HG3  GLN  36           HG3      GLN  36  11.023  25.943 -38.407
  270   HE21  GLN  36          HE22      GLN  36  11.896  23.055 -36.519
  271   HE22  GLN  36          HE21      GLN  36  11.398  21.911 -37.776
  272    HA   PRO  37           HA       PRO  37  13.005  27.357 -33.239
  273    HB2  PRO  37           HB2      PRO  37  10.287  26.134 -33.856
  274    HB3  PRO  37           HB3      PRO  37  10.729  27.192 -32.485
  275    HG2  PRO  37           HG2      PRO  37   9.523  28.277 -34.624
  276    HG3  PRO  37           HG3      PRO  37  10.969  29.093 -33.940
  277    HD2  PRO  37           HD2      PRO  37  10.777  27.351 -36.385
  278    HD3  PRO  37           HD3      PRO  37  11.717  28.849 -36.135
  279    H    VAL  38           H        VAL  38  13.437  25.709 -31.806
  280    HA   VAL  38           HA       VAL  38  13.851  22.930 -32.870
  281    HB   VAL  38           HB       VAL  38  14.961  24.493 -30.522
  282   HG11  VAL  38          HG11      VAL  38  15.316  21.494 -30.905
  283   HG12  VAL  38          HG12      VAL  38  16.270  22.514 -29.852
  284   HG13  VAL  38          HG13      VAL  38  14.550  22.295 -29.517
  285   HG21  VAL  38          HG21      VAL  38  15.986  24.540 -32.864
  286   HG22  VAL  38          HG22      VAL  38  17.079  23.953 -31.592
  287   HG23  VAL  38          HG23      VAL  38  16.285  22.814 -32.696
  288    H    GLY  39           H        GLY  39  13.144  21.131 -31.402
  289    HA2  GLY  39           HA2      GLY  39  11.038  21.887 -29.469
  290    HA3  GLY  39           HA3      GLY  39  10.529  20.859 -30.803
  291    H    ILE  40           H        ILE  40  10.058  19.867 -28.492
  292    HA   ILE  40           HA       ILE  40  12.082  17.731 -28.086
  293    HB   ILE  40           HB       ILE  40  10.719  19.116 -25.756
  294   HG12  ILE  40          HG12      ILE  40  13.546  19.463 -26.838
  295   HG13  ILE  40          HG13      ILE  40  12.289  20.685 -26.758
  296   HG21  ILE  40          HG21      ILE  40  12.944  17.027 -25.907
  297   HG22  ILE  40          HG22      ILE  40  12.288  17.737 -24.416
  298   HG23  ILE  40          HG23      ILE  40  11.270  16.722 -25.418
  299   HD11  ILE  40          HD11      ILE  40  13.744  19.500 -24.389
  300   HD12  ILE  40          HD12      ILE  40  13.861  21.137 -25.036
  301   HD13  ILE  40          HD13      ILE  40  12.343  20.607 -24.282
  302    H    HIS  41           H        HIS  41  11.196  15.894 -28.438
  303    HA   HIS  41           HA       HIS  41   8.317  15.332 -28.481
  304    HB2  HIS  41           HB2      HIS  41   9.923  14.433 -30.144
  305    HB3  HIS  41           HB3      HIS  41  10.835  13.654 -28.858
  306    HD1  HIS  41           HD1      HIS  41   9.869  11.299 -28.012
  307    HD2  HIS  41           HD2      HIS  41   7.476  13.414 -30.758
  308    HE1  HIS  41           HE1      HIS  41   8.047   9.688 -28.764
  309    H    PHE  42           H        PHE  42   7.309  13.917 -27.064
  310    HA   PHE  42           HA       PHE  42   8.680  12.929 -24.632
  311    HB2  PHE  42           HB2      PHE  42   6.438  14.980 -24.696
  312    HB3  PHE  42           HB3      PHE  42   6.661  13.909 -23.330
  313    HD1  PHE  42           HD2      PHE  42   8.769  13.919 -22.007
  314    HD2  PHE  42           HD1      PHE  42   7.898  16.987 -24.929
  315    HE1  PHE  42           HE2      PHE  42  10.398  15.430 -20.910
  316    HE2  PHE  42           HE1      PHE  42   9.485  18.500 -23.788
  317    HZ   PHE  42           HZ       PHE  42  10.731  17.735 -21.780
  318    H    SER  43           H        SER  43   7.935  10.988 -24.073
  319    HA   SER  43           HA       SER  43   5.248  10.011 -24.863
  320    HB2  SER  43           HB2      SER  43   6.197   8.095 -26.065
  321    HB3  SER  43           HB3      SER  43   6.639   9.630 -26.810
  322    HG   SER  43           HG       SER  43   8.623   9.349 -25.333
  323    H    ASP  44           H        ASP  44   6.557  10.555 -22.300
  324    HA   ASP  44           HA       ASP  44   6.756   9.802 -20.200
  325    HB2  ASP  44           HB2      ASP  44   4.499   8.974 -20.610
  326    HB3  ASP  44           HB3      ASP  44   5.135   7.429 -21.157
  327    H    SER  45           H        SER  45   7.195   6.732 -22.036
  328    HA   SER  45           HA       SER  45   9.365   5.811 -20.324
  329    HB2  SER  45           HB2      SER  45   8.458   4.899 -23.084
  330    HB3  SER  45           HB3      SER  45   9.695   4.092 -22.107
  331    HG   SER  45           HG       SER  45   6.982   4.520 -21.342
  332    H    ALA  46           H        ALA  46   9.262   7.878 -23.146
  333    HA   ALA  46           HA       ALA  46  12.097   8.470 -22.822
  334    HB1  ALA  46           HB1      ALA  46  12.141   6.550 -24.410
  335    HB2  ALA  46           HB2      ALA  46  11.049   7.434 -25.498
  336    HB3  ALA  46           HB3      ALA  46  12.689   8.045 -25.177
  337    H    TRP  47           H        TRP  47  12.765  10.187 -24.344
  338    HA   TRP  47           HA       TRP  47  10.835  12.079 -25.423
  339    HB2  TRP  47           HB2      TRP  47  11.722  13.919 -23.978
  340    HB3  TRP  47           HB3      TRP  47  10.865  12.707 -23.036
  341    HD1  TRP  47           HD1      TRP  47  14.364  14.083 -23.686
  342    HE1  TRP  47           HE1      TRP  47  15.962  13.322 -21.850
  343    HE3  TRP  47           HE3      TRP  47  11.287  10.785 -21.237
  344    HZ2  TRP  47           HZ2      TRP  47  16.025  11.295 -19.796
  345    HZ3  TRP  47           HZ3      TRP  47  12.165   9.436 -19.346
  346    HH2  TRP  47           HH2      TRP  47  14.525   9.685 -18.614
  347    H    ARG  48           H        ARG  48  12.174  13.852 -26.558
  348    HA   ARG  48           HA       ARG  48  15.035  13.726 -26.635
  349    HB2  ARG  48           HB2      ARG  48  15.416  13.029 -28.978
  350    HB3  ARG  48           HB3      ARG  48  14.868  11.727 -27.951
  351    HG2  ARG  48           HG2      ARG  48  12.515  12.077 -28.891
  352    HG3  ARG  48           HG3      ARG  48  13.235  13.223 -30.037
  353    HD2  ARG  48           HD2      ARG  48  13.070  11.098 -31.147
  354    HD3  ARG  48           HD3      ARG  48  14.774  11.372 -30.793
  355    HE   ARG  48           HE       ARG  48  14.753   9.615 -29.204
  356   HH11  ARG  48          HH11      ARG  48  11.456  10.040 -30.363
  357   HH12  ARG  48          HH12      ARG  48  10.949   8.549 -29.626
  358   HH21  ARG  48          HH21      ARG  48  14.067   7.814 -28.370
  359   HH22  ARG  48          HH22      ARG  48  12.391   7.303 -28.492
  360    H    ILE  49           H        ILE  49  16.014  15.357 -27.697
  361    HA   ILE  49           HA       ILE  49  14.408  17.695 -28.382
  362    HB   ILE  49           HB       ILE  49  17.355  17.254 -28.939
  363   HG12  ILE  49          HG12      ILE  49  17.109  16.683 -26.603
  364   HG13  ILE  49          HG13      ILE  49  17.964  18.197 -26.813
  365   HG21  ILE  49          HG21      ILE  49  15.651  19.747 -28.504
  366   HG22  ILE  49          HG22      ILE  49  17.424  19.762 -28.550
  367   HG23  ILE  49          HG23      ILE  49  16.515  19.271 -29.980
  368   HD11  ILE  49          HD11      ILE  49  16.415  18.294 -24.916
  369   HD12  ILE  49          HD12      ILE  49  15.932  19.459 -26.155
  370   HD13  ILE  49          HD13      ILE  49  15.056  17.915 -25.973
  371    H    MET  50           H        MET  50  14.250  18.638 -30.529
  372    HA   MET  50           HA       MET  50  14.804  16.885 -32.877
  373    HB2  MET  50           HB2      MET  50  12.095  18.092 -32.152
  374    HB3  MET  50           HB3      MET  50  12.505  17.361 -33.705
  375    HG2  MET  50           HG2      MET  50  13.064  15.224 -32.456
  376    HG3  MET  50           HG3      MET  50  12.382  15.975 -31.016
  377    HE1  MET  50           HE1      MET  50  10.015  14.777 -34.827
  378    HE2  MET  50           HE2      MET  50  11.589  15.601 -34.825
  379    HE3  MET  50           HE3      MET  50  11.482  13.910 -34.299
  380    H    VAL  51           H        VAL  51  14.826  17.916 -34.863
  381    HA   VAL  51           HA       VAL  51  15.118  20.891 -34.935
  382    HB   VAL  51           HB       VAL  51  17.299  20.396 -36.243
  383   HG11  VAL  51          HG11      VAL  51  18.627  20.297 -34.172
  384   HG12  VAL  51          HG12      VAL  51  17.295  21.455 -34.092
  385   HG13  VAL  51          HG13      VAL  51  17.161  19.896 -33.253
  386   HG21  VAL  51          HG21      VAL  51  16.995  17.955 -36.520
  387   HG22  VAL  51          HG22      VAL  51  18.527  18.392 -35.752
  388   HG23  VAL  51          HG23      VAL  51  17.204  17.740 -34.771
  389    HA   PRO  52           HA       PRO  52  13.506  20.505 -39.107
  390    HB2  PRO  52           HB2      PRO  52  15.032  22.255 -40.603
  391    HB3  PRO  52           HB3      PRO  52  13.761  22.765 -39.459
  392    HG2  PRO  52           HG2      PRO  52  16.743  22.521 -38.936
  393    HG3  PRO  52           HG3      PRO  52  15.687  23.929 -38.612
  394    HD2  PRO  52           HD2      PRO  52  16.266  22.217 -36.635
  395    HD3  PRO  52           HD3      PRO  52  14.586  22.783 -36.815
  396    H    GLY  53           H        GLY  53  14.076  19.942 -41.336
  397    HA2  GLY  53           HA2      GLY  53  16.722  18.997 -42.038
  398    HA3  GLY  53           HA3      GLY  53  15.539  17.684 -41.899
  399    H    LYS  54           H        LYS  54  16.722  18.242 -44.305
  400    HA   LYS  54           HA       LYS  54  16.562  18.754 -46.471
  401    HB2  LYS  54           HB2      LYS  54  14.594  17.341 -46.425
  402    HB3  LYS  54           HB3      LYS  54  13.575  18.692 -45.941
  403    HG2  LYS  54           HG2      LYS  54  13.223  18.207 -48.266
  404    HG3  LYS  54           HG3      LYS  54  13.940  19.805 -48.101
  405    HD2  LYS  54           HD2      LYS  54  16.195  18.773 -48.671
  406    HD3  LYS  54           HD3      LYS  54  15.368  17.244 -48.977
  407    HE2  LYS  54           HE2      LYS  54  14.783  19.900 -50.374
  408    HE3  LYS  54           HE3      LYS  54  15.866  18.663 -51.009
  409    HZ1  LYS  54           HZ1      LYS  54  13.669  18.445 -51.987
  410    HZ2  LYS  54           HZ2      LYS  54  13.975  17.122 -51.092
  411    HZ3  LYS  54           HZ3      LYS  54  12.957  18.273 -50.535
  412    H    THR  55           H        THR  55  14.480  21.021 -44.698
  413    HA   THR  55           HA       THR  55  15.943  23.276 -45.866
  414    HB   THR  55           HB       THR  55  14.286  23.004 -47.574
  415    HG1  THR  55           HG1      THR  55  13.501  25.024 -47.497
  416   HG21  THR  55          HG21      THR  55  12.096  23.307 -45.471
  417   HG22  THR  55          HG22      THR  55  11.890  23.189 -47.227
  418   HG23  THR  55          HG23      THR  55  12.486  21.794 -46.318
  419    HA   PRO  56           HA       PRO  56  14.601  24.905 -41.824
  420    HB2  PRO  56           HB2      PRO  56  15.786  27.337 -41.878
  421    HB3  PRO  56           HB3      PRO  56  16.752  25.833 -41.767
  422    HG2  PRO  56           HG2      PRO  56  16.134  27.468 -44.252
  423    HG3  PRO  56           HG3      PRO  56  17.727  26.863 -43.694
  424    HD2  PRO  56           HD2      PRO  56  16.183  25.538 -45.549
  425    HD3  PRO  56           HD3      PRO  56  17.248  24.677 -44.400
  426    H    SER  57           H        SER  57  13.825  26.177 -44.991
  427    HA   SER  57           HA       SER  57  12.392  28.525 -44.172
  428    HB2  SER  57           HB2      SER  57  12.369  27.041 -46.825
  429    HB3  SER  57           HB3      SER  57  11.819  28.704 -46.547
  430    HG   SER  57           HG       SER  57  13.967  28.620 -47.347
  431    H    ALA  58           H        ALA  58  11.336  25.317 -43.969
  432    HA   ALA  58           HA       ALA  58   8.533  26.168 -43.648
  433    HB1  ALA  58           HB1      ALA  58   9.378  23.927 -45.547
  434    HB2  ALA  58           HB2      ALA  58   7.708  24.332 -45.096
  435    HB3  ALA  58           HB3      ALA  58   8.677  25.489 -46.028
  436    H    TRP  59           H        TRP  59   7.309  24.762 -42.370
  437    HA   TRP  59           HA       TRP  59   8.500  23.576 -40.138
  438    HB2  TRP  59           HB2      TRP  59   6.247  24.381 -40.136
  439    HB3  TRP  59           HB3      TRP  59   5.770  23.264 -41.402
  440    HD1  TRP  59           HD1      TRP  59   5.150  20.827 -40.763
  441    HE1  TRP  59           HE1      TRP  59   4.450  19.711 -38.566
  442    HE3  TRP  59           HE3      TRP  59   6.905  24.346 -37.469
  443    HZ2  TRP  59           HZ2      TRP  59   4.513  20.323 -35.752
  444    HZ3  TRP  59           HZ3      TRP  59   6.555  24.049 -35.028
  445    HH2  TRP  59           HH2      TRP  59   5.355  22.055 -34.157
  446    H    ARG  60           H        ARG  60   9.860  21.929 -40.105
  447    HA   ARG  60           HA       ARG  60   8.958  19.262 -40.965
  448    HB2  ARG  60           HB2      ARG  60  10.209  20.370 -42.915
  449    HB3  ARG  60           HB3      ARG  60  11.634  20.427 -41.894
  450    HG2  ARG  60           HG2      ARG  60  11.724  18.585 -43.486
  451    HG3  ARG  60           HG3      ARG  60  11.709  17.952 -41.840
  452    HD2  ARG  60           HD2      ARG  60   9.274  17.432 -42.102
  453    HD3  ARG  60           HD3      ARG  60   9.325  18.115 -43.740
  454    HE   ARG  60           HE       ARG  60  11.328  16.096 -43.523
  455   HH11  ARG  60          HH21      ARG  60   7.827  16.274 -43.665
  456   HH12  ARG  60          HH22      ARG  60   7.692  14.673 -44.330
  457   HH21  ARG  60          HH11      ARG  60  11.064  14.064 -44.372
  458   HH22  ARG  60          HH12      ARG  60   9.472  13.468 -44.719
  459    H    TRP  61           H        TRP  61  10.264  17.528 -39.977
  460    HA   TRP  61           HA       TRP  61  11.891  18.374 -37.639
  461    HB2  TRP  61           HB2      TRP  61   9.335  16.739 -37.559
  462    HB3  TRP  61           HB3      TRP  61  10.499  16.800 -36.246
  463    HD1  TRP  61           HD1      TRP  61   7.424  18.352 -37.175
  464    HE1  TRP  61           HE1      TRP  61   7.059  20.632 -36.011
  465    HE3  TRP  61           HE3      TRP  61  12.167  19.146 -35.444
  466    HZ2  TRP  61           HZ2      TRP  61   8.591  22.443 -34.368
  467    HZ3  TRP  61           HZ3      TRP  61  12.684  21.150 -34.070
  468    HH2  TRP  61           HH2      TRP  61  10.913  22.764 -33.496
  469    H    VAL  62           H        VAL  62  13.365  17.075 -36.941
  470    HA   VAL  62           HA       VAL  62  13.657  14.229 -37.742
  471    HB   VAL  62           HB       VAL  62  15.828  16.382 -37.880
  472   HG11  VAL  62          HG11      VAL  62  17.242  14.649 -38.891
  473   HG12  VAL  62          HG12      VAL  62  16.750  14.165 -37.274
  474   HG13  VAL  62          HG13      VAL  62  15.952  13.448 -38.696
  475   HG21  VAL  62          HG21      VAL  62  14.425  14.917 -40.151
  476   HG22  VAL  62          HG22      VAL  62  14.383  16.665 -39.816
  477   HG23  VAL  62          HG23      VAL  62  15.890  15.910 -40.326
  478    HA   PRO  63           HA       PRO  63  14.649  14.243 -33.301
  479    HB2  PRO  63           HB2      PRO  63  15.872  11.803 -33.020
  480    HB3  PRO  63           HB3      PRO  63  14.104  12.018 -33.219
  481    HG2  PRO  63           HG2      PRO  63  16.145  11.345 -35.356
  482    HG3  PRO  63           HG3      PRO  63  14.569  10.551 -35.037
  483    HD2  PRO  63           HD2      PRO  63  14.845  12.438 -36.962
  484    HD3  PRO  63           HD3      PRO  63  13.366  12.364 -35.963
  485    H    LEU  64           H        LEU  64  16.283  15.208 -32.222
  486    HA   LEU  64           HA       LEU  64  18.807  15.651 -33.601
  487    HB2  LEU  64           HB2      LEU  64  17.681  17.507 -32.458
  488    HB3  LEU  64           HB3      LEU  64  17.829  16.654 -30.928
  489    HG   LEU  64           HG       LEU  64  20.290  16.840 -31.004
  490   HD11  LEU  64          HD11      LEU  64  19.881  18.365 -33.603
  491   HD12  LEU  64          HD12      LEU  64  21.403  18.210 -32.697
  492   HD13  LEU  64          HD13      LEU  64  20.683  16.789 -33.436
  493   HD21  LEU  64          HD21      LEU  64  18.848  19.469 -31.492
  494   HD22  LEU  64          HD22      LEU  64  19.097  18.643 -29.936
  495   HD23  LEU  64          HD23      LEU  64  20.480  19.300 -30.807
  496    H    GLN  65           H        GLN  65  19.369  13.387 -33.623
  497    HA   GLN  65           HA       GLN  65  21.150  12.750 -31.319
  498    HB2  GLN  65           HB2      GLN  65  19.222  10.807 -32.658
  499    HB3  GLN  65           HB3      GLN  65  20.593  10.303 -31.660
  500    HG2  GLN  65           HG2      GLN  65  19.691  11.795 -29.810
  501    HG3  GLN  65           HG3      GLN  65  18.205  11.945 -30.756
  502   HE21  GLN  65          HE22      GLN  65  16.947   9.907 -31.149
  503   HE22  GLN  65          HE21      GLN  65  17.100   8.659 -29.917
  504    H    GLU  66           H        GLU  66  21.555  14.013 -34.007
  505    HA   GLU  66           HA       GLU  66  23.169  12.301 -35.624
  506    HB2  GLU  66           HB2      GLU  66  24.071  14.303 -36.583
  507    HB3  GLU  66           HB3      GLU  66  22.335  14.494 -36.353
  508    HG2  GLU  66           HG2      GLU  66  22.773  15.838 -34.290
  509    HG3  GLU  66           HG3      GLU  66  24.508  15.687 -34.571
  510    H    ASP  67           H        ASP  67  23.845  13.792 -32.555
  511    HA   ASP  67           HA       ASP  67  26.188  12.069 -32.265
  512    HB2  ASP  67           HB2      ASP  67  27.145  14.204 -33.186
  513    HB3  ASP  67           HB3      ASP  67  26.422  15.088 -31.845
  514    H    ALA  68           H        ALA  68  23.823  14.231 -30.730
  515    HA   ALA  68           HA       ALA  68  24.325  13.414 -28.030
  516    HB1  ALA  68           HB1      ALA  68  22.160  14.480 -27.605
  517    HB2  ALA  68           HB2      ALA  68  23.118  15.475 -28.709
  518    HB3  ALA  68           HB3      ALA  68  21.785  14.479 -29.341
  519    H    ALA  69           H        ALA  69  24.168  11.111 -29.906
  520    HA   ALA  69           HA       ALA  69  21.757   9.667 -29.781
  521    HB1  ALA  69           HB1      ALA  69  24.625   8.696 -30.039
  522    HB2  ALA  69           HB2      ALA  69  23.170   7.747 -30.414
  523    HB3  ALA  69           HB3      ALA  69  23.550   9.195 -31.366
  524    H    ASP  70           H        ASP  70  20.734   8.756 -28.097
  525    HA   ASP  70           HA       ASP  70  20.197   8.107 -26.019
  526    HB2  ASP  70           HB2      ASP  70  22.835   6.627 -26.126
  527    HB3  ASP  70           HB3      ASP  70  21.588   6.377 -24.907
  528    H    GLU  71           H        GLU  71  21.791  10.640 -26.298
  529    HA   GLU  71           HA       GLU  71  22.027  11.117 -23.337
  530    HB2  GLU  71           HB2      GLU  71  23.450  12.553 -25.615
  531    HB3  GLU  71           HB3      GLU  71  23.437  13.076 -23.927
  532    HG2  GLU  71           HG2      GLU  71  24.461  10.883 -23.269
  533    HG3  GLU  71           HG3      GLU  71  24.599  10.462 -24.978
  534    H    SER  72           H        SER  72  20.748  12.217 -26.432
  535    HA   SER  72           HA       SER  72  19.113  14.392 -25.498
  536    HB2  SER  72           HB2      SER  72  19.808  13.847 -27.861
  537    HB3  SER  72           HB3      SER  72  18.684  12.482 -27.830
  538    HG   SER  72           HG       SER  72  17.967  14.506 -28.786
  539    H    GLN  73           H        GLN  73  18.810  10.935 -25.127
  540    HA   GLN  73           HA       GLN  73  15.960  11.136 -24.293
  541    HB2  GLN  73           HB2      GLN  73  15.416   9.174 -25.594
  542    HB3  GLN  73           HB3      GLN  73  16.135  10.389 -26.651
  543    HG2  GLN  73           HG2      GLN  73  18.274   9.147 -26.648
  544    HG3  GLN  73           HG3      GLN  73  17.579   7.931 -25.572
  545   HE21  GLN  73          HE22      GLN  73  18.239   6.398 -27.384
  546   HE22  GLN  73          HE21      GLN  73  17.045   6.206 -28.664
  547    H    ASN  74           H        ASN  74  15.186   9.655 -22.940
  548    HA   ASN  74           HA       ASN  74  14.946   8.370 -21.148
  549    HB2  ASN  74           HB2      ASN  74  14.787   6.900 -23.058
  550    HB3  ASN  74           HB3      ASN  74  16.518   6.572 -23.002
  551   HD21  ASN  74          HD22      ASN  74  13.383   5.906 -21.379
  552   HD22  ASN  74          HD21      ASN  74  14.044   4.589 -20.435
  553    H    ASP  75           H        ASP  75  18.467   8.516 -21.671
  554    HA   ASP  75           HA       ASP  75  19.259   6.886 -19.540
  555    HB2  ASP  75           HB2      ASP  75  20.566   7.613 -21.531
  556    HB3  ASP  75           HB3      ASP  75  20.717   9.224 -20.828
  557    H    TRP  76           H        TRP  76  18.002  10.080 -19.199
  558    HA   TRP  76           HA       TRP  76  19.681  11.083 -17.144
  559    HB2  TRP  76           HB2      TRP  76  16.799  11.830 -17.709
  560    HB3  TRP  76           HB3      TRP  76  17.964  12.804 -16.854
  561    HD1  TRP  76           HD1      TRP  76  20.100  11.823 -19.502
  562    HE1  TRP  76           HE1      TRP  76  19.933  13.273 -21.617
  563    HE3  TRP  76           HE3      TRP  76  15.720  14.291 -18.475
  564    HZ2  TRP  76           HZ2      TRP  76  18.221  15.290 -22.663
  565    HZ3  TRP  76           HZ3      TRP  76  14.813  15.925 -20.099
  566    HH2  TRP  76           HH2      TRP  76  16.054  16.455 -22.190
  567    H    ASP  77           H        ASP  77  17.256   8.664 -16.765
  568    HA   ASP  77           HA       ASP  77  17.425   8.904 -13.828
  569    HB2  ASP  77           HB2      ASP  77  15.226   9.280 -13.400
  570    HB3  ASP  77           HB3      ASP  77  15.369  10.202 -14.886
  571    H    GLU  78           H        GLU  78  16.240   7.091 -12.720
  572    HA   GLU  78           HA       GLU  78  15.853   4.599 -14.250
  573    HB2  GLU  78           HB2      GLU  78  17.334   3.290 -12.873
  574    HB3  GLU  78           HB3      GLU  78  18.247   4.647 -13.525
  575    HG2  GLU  78           HG2      GLU  78  17.723   5.848 -11.269
  576    HG3  GLU  78           HG3      GLU  78  17.244   4.258 -10.680
  577    H    GLU  79           H        GLU  79  14.180   6.600 -12.713
  578    HA   GLU  79           HA       GLU  79  12.838   4.837 -10.702
  579    HB2  GLU  79           HB2      GLU  79  14.201   7.502 -10.164
  580    HB3  GLU  79           HB3      GLU  79  12.932   6.906  -9.120
  581    HG2  GLU  79           HG2      GLU  79  15.463   5.311  -9.603
  582    HG3  GLU  79           HG3      GLU  79  15.292   6.530  -8.355
  583    H    LEU  80           H        LEU  80  12.385   7.031 -13.264
  584    HA   LEU  80           HA       LEU  80   9.890   8.153 -12.050
  585    HB2  LEU  80           HB2      LEU  80  11.619   9.288 -14.259
  586    HB3  LEU  80           HB3      LEU  80  10.272  10.084 -13.464
  587    HG   LEU  80           HG       LEU  80  12.953   9.435 -12.153
  588   HD11  LEU  80          HD11      LEU  80  12.949  11.186 -13.917
  589   HD12  LEU  80          HD12      LEU  80  11.757  12.096 -12.960
  590   HD13  LEU  80          HD13      LEU  80  13.382  11.742 -12.310
  591   HD21  LEU  80          HD21      LEU  80  11.124   9.403 -10.484
  592   HD22  LEU  80          HD22      LEU  80  12.128  10.843 -10.315
  593   HD23  LEU  80          HD23      LEU  80  10.534  10.965 -11.093
  594    H    SER  81           H        SER  81   8.203   8.694 -13.255
  595    HA   SER  81           HA       SER  81   7.807   7.748 -16.056
  596    HB2  SER  81           HB2      SER  81   5.793   7.800 -13.762
  597    HB3  SER  81           HB3      SER  81   5.414   7.450 -15.460
  598    HG   SER  81           HG       SER  81   5.694   5.532 -14.260
  599    H    ILE  82           H        ILE  82   6.884   9.342 -17.363
  600    HA   ILE  82           HA       ILE  82   6.779  12.095 -16.168
  601    HB   ILE  82           HB       ILE  82   8.358  10.967 -18.416
  602   HG12  ILE  82          HG12      ILE  82   9.834  12.885 -17.905
  603   HG13  ILE  82          HG13      ILE  82   8.649  13.515 -16.761
  604   HG21  ILE  82          HG21      ILE  82   8.414  13.047 -19.729
  605   HG22  ILE  82          HG22      ILE  82   6.833  12.279 -19.808
  606   HG23  ILE  82          HG23      ILE  82   7.074  13.708 -18.774
  607   HD11  ILE  82          HD11      ILE  82   9.041  11.655 -15.253
  608   HD12  ILE  82          HD12      ILE  82  10.040  10.817 -16.471
  609   HD13  ILE  82          HD13      ILE  82  10.600  12.331 -15.730
  610    H    HIS  83           H        HIS  83   5.258  13.464 -16.755
  611    HA   HIS  83           HA       HIS  83   3.243  12.739 -18.830
  612    HB2  HIS  83           HB2      HIS  83   2.573  13.734 -16.027
  613    HB3  HIS  83           HB3      HIS  83   1.434  13.265 -17.286
  614    HD1  HIS  83           HD1      HIS  83   1.134  10.552 -17.642
  615    HD2  HIS  83           HD2      HIS  83   3.738  11.794 -14.579
  616    HE1  HIS  83           HE1      HIS  83   1.632   8.481 -16.243
  617    H    LEU  84           H        LEU  84   2.131  14.664 -19.679
  618    HA   LEU  84           HA       LEU  84   2.811  17.237 -18.541
  619    HB2  LEU  84           HB2      LEU  84   3.718  18.259 -20.597
  620    HB3  LEU  84           HB3      LEU  84   4.761  17.094 -19.826
  621    HG   LEU  84           HG       LEU  84   4.355  15.440 -21.565
  622   HD11  LEU  84          HD11      LEU  84   2.078  15.877 -22.257
  623   HD12  LEU  84          HD12      LEU  84   2.494  17.534 -22.747
  624   HD13  LEU  84          HD13      LEU  84   3.130  16.138 -23.652
  625   HD21  LEU  84          HD21      LEU  84   6.133  17.121 -21.872
  626   HD22  LEU  84          HD22      LEU  84   5.410  16.687 -23.428
  627   HD23  LEU  84          HD23      LEU  84   4.979  18.223 -22.657
  628    H    GLN  85           H        GLN  85   1.873  19.081 -19.813
  629    HA   GLN  85           HA       GLN  85  -0.573  18.643 -21.335
  630    HB2  GLN  85           HB2      GLN  85  -1.985  19.897 -19.686
  631    HB3  GLN  85           HB3      GLN  85  -1.570  18.270 -19.198
  632    HG2  GLN  85           HG2      GLN  85   0.178  20.527 -18.197
  633    HG3  GLN  85           HG3      GLN  85  -1.444  20.385 -17.549
  634   HE21  GLN  85          HE22      GLN  85   1.788  19.026 -17.361
  635   HE22  GLN  85          HE21      GLN  85   1.333  17.815 -16.165
  636    HA   PRO  86           HA       PRO  86  -2.458  20.415 -21.785
  637    HB2  PRO  86           HB2      PRO  86  -3.058  21.928 -23.951
  638    HB3  PRO  86           HB3      PRO  86  -2.961  22.619 -22.304
  639    HG2  PRO  86           HG2      PRO  86  -0.800  22.618 -24.443
  640    HG3  PRO  86           HG3      PRO  86  -1.422  24.015 -23.504
  641    HD2  PRO  86           HD2      PRO  86   0.826  22.664 -22.757
  642    HD3  PRO  86           HD3      PRO  86  -0.315  23.313 -21.546
  643    H    PHE  87           H        PHE  87   0.368  20.087 -23.739
  644    HA   PHE  87           HA       PHE  87  -0.681  18.403 -25.854
  645    HB2  PHE  87           HB2      PHE  87   2.108  18.692 -24.658
  646    HB3  PHE  87           HB3      PHE  87   1.724  17.839 -26.141
  647    HD1  PHE  87           HD1      PHE  87   1.125  19.026 -28.197
  648    HD2  PHE  87           HD2      PHE  87   2.116  21.166 -24.581
  649    HE1  PHE  87           HE1      PHE  87   1.460  21.108 -29.512
  650    HE2  PHE  87           HE2      PHE  87   2.429  23.244 -25.895
  651    HZ   PHE  87           HZ       PHE  87   2.132  23.209 -28.366
  652    H    LYS  88           H        LYS  88   0.779  16.051 -25.766
  653    HA   LYS  88           HA       LYS  88   0.199  14.741 -23.191
  654    HB2  LYS  88           HB2      LYS  88  -1.244  13.073 -23.994
  655    HB3  LYS  88           HB3      LYS  88  -1.909  14.613 -24.471
  656    HG2  LYS  88           HG2      LYS  88  -0.590  12.538 -26.249
  657    HG3  LYS  88           HG3      LYS  88  -2.287  12.983 -26.162
  658    HD2  LYS  88           HD2      LYS  88  -1.349  15.379 -26.893
  659    HD3  LYS  88           HD3      LYS  88  -0.013  14.409 -27.527
  660    HE2  LYS  88           HE2      LYS  88  -2.979  14.268 -28.219
  661    HE3  LYS  88           HE3      LYS  88  -1.682  14.856 -29.253
  662    HZ1  LYS  88           HZ1      LYS  88  -2.033  12.030 -28.396
  663    HZ2  LYS  88           HZ2      LYS  88  -2.368  12.623 -29.867
  664    HZ3  LYS  88           HZ3      LYS  88  -0.821  12.549 -29.380
  665    HA   PRO  89           HA       PRO  89   3.874  12.465 -24.248
  666    HB2  PRO  89           HB2      PRO  89   3.675  10.266 -22.620
  667    HB3  PRO  89           HB3      PRO  89   4.082  11.905 -22.027
  668    HG2  PRO  89           HG2      PRO  89   1.388  10.523 -22.000
  669    HG3  PRO  89           HG3      PRO  89   2.177  11.445 -20.685
  670    HD2  PRO  89           HD2      PRO  89   0.278  12.537 -22.322
  671    HD3  PRO  89           HD3      PRO  89   1.636  13.503 -21.679
  672    H    ASP  90           H        ASP  90   3.799  11.768 -26.304
  673    HA   ASP  90           HA       ASP  90   2.459   9.275 -27.114
  674    HB2  ASP  90           HB2      ASP  90   0.567  10.752 -27.123
  675    HB3  ASP  90           HB3      ASP  90   1.491  12.059 -27.860
  676    H    ASP  91           H        ASP  91   3.350   8.439 -28.878
  677    HA   ASP  91           HA       ASP  91   5.880   9.322 -29.854
  678    HB2  ASP  91           HB2      ASP  91   5.211   6.990 -29.345
  679    HB3  ASP  91           HB3      ASP  91   4.107   7.017 -30.719
  680    H    SER  92           H        SER  92   4.356  11.376 -30.571
  681    HA   SER  92           HA       SER  92   3.014  11.337 -33.089
  682    HB2  SER  92           HB2      SER  92   2.625  12.997 -31.350
  683    HB3  SER  92           HB3      SER  92   4.274  13.622 -31.532
  684    HG   SER  92           HG       SER  92   2.452  14.703 -32.711
  685    H    ASN  93           H        ASN  93   3.549  12.500 -35.005
  686    HA   ASN  93           HA       ASN  93   6.243  12.078 -36.093
  687    HB2  ASN  93           HB2      ASN  93   3.738  13.418 -37.216
  688    HB3  ASN  93           HB3      ASN  93   5.215  13.133 -38.130
  689   HD21  ASN  93          HD22      ASN  93   2.220  11.934 -37.909
  690   HD22  ASN  93          HD21      ASN  93   2.566  10.242 -38.209
  691    H    GLN  94           H        GLN  94   4.988  14.463 -34.083
  692    HA   GLN  94           HA       GLN  94   7.135  16.380 -34.859
  693    HB2  GLN  94           HB2      GLN  94   5.647  18.250 -34.395
  694    HB3  GLN  94           HB3      GLN  94   4.949  17.253 -35.652
  695    HG2  GLN  94           HG2      GLN  94   3.226  16.471 -34.244
  696    HG3  GLN  94           HG3      GLN  94   4.113  16.833 -32.760
  697   HE21  GLN  94          HE22      GLN  94   4.194  18.980 -31.934
  698   HE22  GLN  94          HE21      GLN  94   3.067  20.197 -32.537
  699    HA   PRO  95           HA       PRO  95   8.031  16.397 -30.447
  700    HB2  PRO  95           HB2      PRO  95   8.663  19.023 -29.933
  701    HB3  PRO  95           HB3      PRO  95   9.749  17.884 -30.787
  702    HG2  PRO  95           HG2      PRO  95   7.837  19.911 -31.991
  703    HG3  PRO  95           HG3      PRO  95   9.566  19.635 -32.405
  704    HD2  PRO  95           HD2      PRO  95   7.607  18.566 -33.876
  705    HD3  PRO  95           HD3      PRO  95   9.068  17.617 -33.519
  706    H    GLN  96           H        GLN  96   7.260  17.258 -28.371
  707    HA   GLN  96           HA       GLN  96   4.408  18.160 -28.450
  708    HB2  GLN  96           HB2      GLN  96   5.980  16.871 -26.194
  709    HB3  GLN  96           HB3      GLN  96   4.262  17.226 -26.184
  710    HG2  GLN  96           HG2      GLN  96   5.633  15.177 -27.989
  711    HG3  GLN  96           HG3      GLN  96   4.764  14.826 -26.507
  712   HE21  GLN  96          HE22      GLN  96   3.886  13.390 -28.592
  713   HE22  GLN  96          HE21      GLN  96   2.383  14.076 -29.184
  714    H    VAL  97           H        VAL  97   7.575  19.299 -27.634
  715    HA   VAL  97           HA       VAL  97   6.378  21.865 -26.625
  716    HB   VAL  97           HB       VAL  97   8.961  20.526 -25.720
  717   HG11  VAL  97          HG11      VAL  97   7.736  23.170 -24.824
  718   HG12  VAL  97          HG12      VAL  97   9.115  22.355 -24.058
  719   HG13  VAL  97          HG13      VAL  97   9.278  22.957 -25.697
  720   HG21  VAL  97          HG21      VAL  97   6.388  21.061 -24.179
  721   HG22  VAL  97          HG22      VAL  97   6.999  19.466 -24.671
  722   HG23  VAL  97          HG23      VAL  97   7.896  20.418 -23.496
  723    H    VAL  98           H        VAL  98   7.459  23.789 -27.398
  724    HA   VAL  98           HA       VAL  98   9.560  23.440 -29.476
  725    HB   VAL  98           HB       VAL  98   6.919  24.857 -29.905
  726   HG11  VAL  98          HG11      VAL  98   9.395  24.917 -31.681
  727   HG12  VAL  98          HG12      VAL  98   7.781  25.496 -32.137
  728   HG13  VAL  98          HG13      VAL  98   8.660  26.314 -30.851
  729   HG21  VAL  98          HG21      VAL  98   6.804  23.376 -31.895
  730   HG22  VAL  98          HG22      VAL  98   8.323  22.600 -31.394
  731   HG23  VAL  98          HG23      VAL  98   6.861  22.453 -30.396
  732    H    ILE  99           H        ILE  99  10.948  25.066 -29.740
  733    HA   ILE  99           HA       ILE  99  11.132  27.217 -27.668
  734    HB   ILE  99           HB       ILE  99  13.278  25.313 -28.747
  735   HG12  ILE  99          HG12      ILE  99  13.494  24.900 -26.141
  736   HG13  ILE  99          HG13      ILE  99  11.804  25.373 -26.117
  737   HG21  ILE  99          HG21      ILE  99  14.782  26.405 -27.118
  738   HG22  ILE  99          HG22      ILE  99  14.268  27.505 -28.371
  739   HG23  ILE  99          HG23      ILE  99  13.526  27.616 -26.765
  740   HD11  ILE  99          HD11      ILE  99  12.146  22.933 -26.206
  741   HD12  ILE  99          HD12      ILE  99  11.278  23.472 -27.642
  742   HD13  ILE  99          HD13      ILE  99  13.010  23.094 -27.750
  743    H    LEU 100           H        LEU 100  11.532  29.194 -28.514
  744    HA   LEU 100           HA       LEU 100  12.239  29.485 -31.375
  745    HB2  LEU 100           HB2      LEU 100  11.863  31.713 -29.353
  746    HB3  LEU 100           HB3      LEU 100  11.869  31.823 -31.107
  747    HG   LEU 100           HG       LEU 100   9.697  30.821 -29.276
  748   HD11  LEU 100          HD11      LEU 100   8.356  32.452 -30.481
  749   HD12  LEU 100          HD12      LEU 100   9.855  33.238 -29.959
  750   HD13  LEU 100          HD13      LEU 100   9.667  32.740 -31.645
  751   HD21  LEU 100          HD21      LEU 100   9.831  30.382 -32.301
  752   HD22  LEU 100          HD22      LEU 100   9.774  29.102 -31.067
  753   HD23  LEU 100          HD23      LEU 100   8.380  30.156 -31.299
  754    H    ALA 101           H        ALA 101  13.900  30.921 -32.032
  755    HA   ALA 101           HA       ALA 101  16.515  30.298 -31.047
  756    HB1  ALA 101           HB1      ALA 101  17.226  31.985 -32.737
  757    HB2  ALA 101           HB2      ALA 101  16.042  30.834 -33.393
  758    HB3  ALA 101           HB3      ALA 101  15.540  32.481 -32.942
  759    H    ASP 102           H        ASP 102  14.355  32.928 -30.250
  760    HA   ASP 102           HA       ASP 102  16.346  34.605 -28.923
  761    HB2  ASP 102           HB2      ASP 102  14.380  35.465 -30.159
  762    HB3  ASP 102           HB3      ASP 102  13.306  34.641 -29.031
  763    H    GLY 103           H        GLY 103  14.813  31.719 -27.973
  764    HA2  GLY 103           HA2      GLY 103  15.026  30.659 -25.916
  765    HA3  GLY 103           HA3      GLY 103  15.363  32.189 -25.105
  766    H    GLN 104           H        GLN 104  12.565  32.511 -27.058
  767    HA   GLN 104           HA       GLN 104  10.693  32.382 -24.837
  768    HB2  GLN 104           HB2      GLN 104  10.301  32.633 -27.835
  769    HB3  GLN 104           HB3      GLN 104   9.019  32.808 -26.630
  770    HG2  GLN 104           HG2      GLN 104  10.067  34.796 -25.710
  771    HG3  GLN 104           HG3      GLN 104  11.525  34.525 -26.676
  772   HE21  GLN 104          HE22      GLN 104  11.718  36.000 -28.159
  773   HE22  GLN 104          HE21      GLN 104  10.424  36.547 -29.243
  774    H    ILE 105           H        ILE 105   9.252  30.769 -24.460
  775    HA   ILE 105           HA       ILE 105   9.626  28.165 -25.896
  776    HB   ILE 105           HB       ILE 105   9.229  28.316 -22.907
  777   HG12  ILE 105          HG12      ILE 105  11.300  29.528 -23.202
  778   HG13  ILE 105          HG13      ILE 105  11.539  27.985 -22.410
  779   HG21  ILE 105          HG21      ILE 105   8.751  26.172 -23.934
  780   HG22  ILE 105          HG22      ILE 105  10.256  26.233 -24.867
  781   HG23  ILE 105          HG23      ILE 105  10.310  26.019 -23.102
  782   HD11  ILE 105          HD11      ILE 105  13.327  28.537 -24.001
  783   HD12  ILE 105          HD12      ILE 105  12.498  27.039 -24.458
  784   HD13  ILE 105          HD13      ILE 105  12.159  28.565 -25.318
  785    H    THR 106           H        THR 106   7.795  27.091 -26.379
  786    HA   THR 106           HA       THR 106   5.243  28.275 -26.261
  787    HB   THR 106           HB       THR 106   5.998  25.350 -26.653
  788    HG1  THR 106           HG1      THR 106   7.162  26.541 -28.078
  789   HG21  THR 106          HG21      THR 106   3.699  27.042 -27.683
  790   HG22  THR 106          HG22      THR 106   4.052  25.361 -28.154
  791   HG23  THR 106          HG23      THR 106   3.574  25.727 -26.480
  792    HA   PRO 107           HA       PRO 107   4.486  27.451 -21.879
  793    HB2  PRO 107           HB2      PRO 107   1.614  27.821 -22.749
  794    HB3  PRO 107           HB3      PRO 107   2.441  28.453 -21.290
  795    HG2  PRO 107           HG2      PRO 107   2.085  30.056 -23.436
  796    HG3  PRO 107           HG3      PRO 107   3.667  30.045 -22.590
  797    HD2  PRO 107           HD2      PRO 107   2.900  28.650 -25.160
  798    HD3  PRO 107           HD3      PRO 107   4.395  29.545 -24.748
  799    H    PHE 108           H        PHE 108   4.268  25.653 -20.711
  800    HA   PHE 108           HA       PHE 108   2.221  23.671 -21.011
  801    HB2  PHE 108           HB2      PHE 108   3.448  21.779 -21.692
  802    HB3  PHE 108           HB3      PHE 108   3.848  22.999 -22.865
  803    HD1  PHE 108           HD1      PHE 108   6.052  24.407 -22.294
  804    HD2  PHE 108           HD2      PHE 108   5.189  20.480 -20.764
  805    HE1  PHE 108           HE1      PHE 108   8.452  24.036 -21.961
  806    HE2  PHE 108           HE2      PHE 108   7.625  20.099 -20.429
  807    HZ   PHE 108           HZ       PHE 108   9.258  21.868 -21.013
  808    H    SER 109           H        SER 109   2.678  21.764 -19.497
  809    HA   SER 109           HA       SER 109   4.530  22.423 -17.277
  810    HB2  SER 109           HB2      SER 109   1.617  21.635 -16.897
  811    HB3  SER 109           HB3      SER 109   2.842  21.604 -15.619
  812    HG   SER 109           HG       SER 109   2.442  23.952 -17.112
  813    H    LEU 110           H        LEU 110   5.509  20.654 -16.434
  814    HA   LEU 110           HA       LEU 110   5.005  17.964 -17.645
  815    HB2  LEU 110           HB2      LEU 110   6.708  18.642 -18.971
  816    HB3  LEU 110           HB3      LEU 110   7.287  19.856 -17.842
  817    HG   LEU 110           HG       LEU 110   8.483  18.174 -16.539
  818   HD11  LEU 110          HD11      LEU 110   7.660  16.235 -18.772
  819   HD12  LEU 110          HD12      LEU 110   8.871  15.904 -17.515
  820   HD13  LEU 110          HD13      LEU 110   7.176  16.088 -17.076
  821   HD21  LEU 110          HD21      LEU 110  10.241  17.772 -18.203
  822   HD22  LEU 110          HD22      LEU 110   9.101  18.106 -19.522
  823   HD23  LEU 110          HD23      LEU 110   9.565  19.396 -18.394
  824    H    LEU 111           H        LEU 111   4.863  16.412 -16.177
  825    HA   LEU 111           HA       LEU 111   5.622  16.957 -13.341
  826    HB2  LEU 111           HB2      LEU 111   3.278  17.218 -13.886
  827    HB3  LEU 111           HB3      LEU 111   3.192  15.612 -14.601
  828    HG   LEU 111           HG       LEU 111   4.033  15.955 -11.722
  829   HD11  LEU 111          HD11      LEU 111   1.978  17.264 -11.935
  830   HD12  LEU 111          HD12      LEU 111   1.167  15.919 -12.770
  831   HD13  LEU 111          HD13      LEU 111   1.640  15.760 -11.064
  832   HD21  LEU 111          HD21      LEU 111   4.098  13.627 -12.704
  833   HD22  LEU 111          HD22      LEU 111   2.883  13.764 -11.440
  834   HD23  LEU 111          HD23      LEU 111   2.393  13.789 -13.144
  835    H    MET 112           H        MET 112   6.474  15.328 -12.125
  836    HA   MET 112           HA       MET 112   7.343  12.828 -13.537
  837    HB2  MET 112           HB2      MET 112   8.856  14.442 -11.446
  838    HB3  MET 112           HB3      MET 112   9.402  12.960 -12.234
  839    HG2  MET 112           HG2      MET 112   9.365  14.146 -14.430
  840    HG3  MET 112           HG3      MET 112   8.906  15.634 -13.594
  841    HE1  MET 112           HE1      MET 112  11.373  15.527 -15.554
  842    HE2  MET 112           HE2      MET 112  10.866  16.971 -14.643
  843    HE3  MET 112           HE3      MET 112  12.566  16.452 -14.614
  844    H    ALA 113           H        ALA 113   6.774  10.994 -12.620
  845    HA   ALA 113           HA       ALA 113   5.946  10.909  -9.752
  846    HB1  ALA 113           HB1      ALA 113   4.008  10.881 -11.257
  847    HB2  ALA 113           HB2      ALA 113   4.700   9.500 -12.139
  848    HB3  ALA 113           HB3      ALA 113   4.207   9.319 -10.440
  849    H    ASN 114           H        ASN 114   6.633   9.274  -8.527
  850    HA   ASN 114           HA       ASN 114   8.987   7.823  -9.187
  851    HB2  ASN 114           HB2      ASN 114   8.449   8.589  -6.991
  852    HB3  ASN 114           HB3      ASN 114   6.937   7.691  -6.946
  853   HD21  ASN 114          HD22      ASN 114   8.362   7.366  -4.833
  854   HD22  ASN 114          HD21      ASN 114   9.328   5.903  -4.824
  855    H    ALA 115           H        ALA 115   9.139   6.164 -10.530
  856    HA   ALA 115           HA       ALA 115   6.983   4.665 -11.582
  857    HB1  ALA 115           HB1      ALA 115   8.765   3.323 -12.631
  858    HB2  ALA 115           HB2      ALA 115   9.123   5.055 -12.724
  859    HB3  ALA 115           HB3      ALA 115   9.965   4.036 -11.531
  860    H    GLY 116           H        GLY 116   8.639   4.172  -8.554
  861    HA2  GLY 116           HA2      GLY 116   8.011   1.304  -8.315
  862    HA3  GLY 116           HA3      GLY 116   8.795   2.349  -7.131
  863    H    THR 117           H        THR 117   6.382   4.335  -7.455
  864    HA   THR 117           HA       THR 117   4.476   2.881  -5.669
  865    HB   THR 117           HB       THR 117   4.472   4.876  -4.334
  866    HG1  THR 117           HG1      THR 117   5.884   6.563  -4.792
  867   HG21  THR 117          HG21      THR 117   6.742   4.913  -3.414
  868   HG22  THR 117          HG22      THR 117   6.299   3.240  -3.821
  869   HG23  THR 117          HG23      THR 117   7.384   4.168  -4.881
  870    H    GLY 118           H        GLY 118   4.868   5.375  -8.144
  871    HA2  GLY 118           HA2      GLY 118   3.219   6.144  -9.637
  872    HA3  GLY 118           HA3      GLY 118   1.936   5.599  -8.551
  873    H    GLU 119           H        GLU 119   4.145   7.155  -6.568
  874    HA   GLU 119           HA       GLU 119   2.347   9.425  -6.258
  875    HB2  GLU 119           HB2      GLU 119   4.922   8.671  -4.821
  876    HB3  GLU 119           HB3      GLU 119   3.865  10.027  -4.392
  877    HG2  GLU 119           HG2      GLU 119   1.965   8.277  -4.227
  878    HG3  GLU 119           HG3      GLU 119   3.234   7.056  -4.254
  879    HA   PRO 120           HA       PRO 120   4.845  12.297  -8.710
  880    HB2  PRO 120           HB2      PRO 120   3.732  14.676  -7.994
  881    HB3  PRO 120           HB3      PRO 120   2.917  13.493  -9.060
  882    HG2  PRO 120           HG2      PRO 120   2.506  13.906  -6.089
  883    HG3  PRO 120           HG3      PRO 120   1.267  13.724  -7.372
  884    HD2  PRO 120           HD2      PRO 120   2.080  11.642  -5.781
  885    HD3  PRO 120           HD3      PRO 120   1.584  11.403  -7.485
  886    H    LEU 121           H        LEU 121   6.737  13.384  -8.375
  887    HA   LEU 121           HA       LEU 121   7.552  14.021  -5.537
  888    HB2  LEU 121           HB2      LEU 121   9.550  13.804  -7.796
  889    HB3  LEU 121           HB3      LEU 121   9.778  13.669  -6.083
  890    HG   LEU 121           HG       LEU 121  10.250  11.584  -7.035
  891   HD11  LEU 121          HD11      LEU 121   8.989  10.174  -5.702
  892   HD12  LEU 121          HD12      LEU 121   8.750  11.722  -4.923
  893   HD13  LEU 121          HD13      LEU 121   7.475  11.079  -5.976
  894   HD21  LEU 121          HD21      LEU 121   7.608  11.342  -8.374
  895   HD22  LEU 121          HD22      LEU 121   9.006  12.123  -9.154
  896   HD23  LEU 121          HD23      LEU 121   9.122  10.436  -8.622
  897    H    LEU 122           H        LEU 122   7.434  15.178  -8.858
  898    HA   LEU 122           HA       LEU 122   8.155  17.943  -8.090
  899    HB2  LEU 122           HB2      LEU 122  10.207  16.288  -8.536
  900    HB3  LEU 122           HB3      LEU 122   9.674  16.343 -10.192
  901    HG   LEU 122           HG       LEU 122   9.842  18.990  -9.878
  902   HD11  LEU 122          HD11      LEU 122  10.216  18.873  -7.409
  903   HD12  LEU 122          HD12      LEU 122  11.706  17.954  -7.687
  904   HD13  LEU 122          HD13      LEU 122  11.574  19.635  -8.242
  905   HD21  LEU 122          HD21      LEU 122  12.141  18.925 -10.596
  906   HD22  LEU 122          HD22      LEU 122  12.342  17.268  -9.967
  907   HD23  LEU 122          HD23      LEU 122  11.272  17.592 -11.350
  908    H    THR 123           H        THR 123   7.595  19.447  -9.656
  909    HA   THR 123           HA       THR 123   6.708  18.550 -12.334
  910    HB   THR 123           HB       THR 123   4.996  20.292 -10.517
  911    HG1  THR 123           HG1      THR 123   4.535  18.292 -10.094
  912   HG21  THR 123          HG21      THR 123   3.326  20.234 -12.291
  913   HG22  THR 123          HG22      THR 123   4.757  21.136 -12.819
  914   HG23  THR 123          HG23      THR 123   4.477  19.453 -13.386
  915    H    LEU 124           H        LEU 124   6.885  20.144 -13.896
  916    HA   LEU 124           HA       LEU 124   8.544  22.544 -13.286
  917    HB2  LEU 124           HB2      LEU 124   8.676  20.766 -15.754
  918    HB3  LEU 124           HB3      LEU 124   9.697  22.153 -15.396
  919    HG   LEU 124           HG       LEU 124   9.720  19.463 -13.959
  920   HD11  LEU 124          HD11      LEU 124  11.961  19.267 -14.936
  921   HD12  LEU 124          HD12      LEU 124  10.753  19.488 -16.208
  922   HD13  LEU 124          HD13      LEU 124  11.781  20.853 -15.717
  923   HD21  LEU 124          HD21      LEU 124  10.278  21.198 -12.338
  924   HD22  LEU 124          HD22      LEU 124  11.728  20.330 -12.790
  925   HD23  LEU 124          HD23      LEU 124  11.429  21.947 -13.472
  926    H    VAL 125           H        VAL 125   7.918  24.385 -14.354
  927    HA   VAL 125           HA       VAL 125   5.417  24.288 -16.022
  928    HB   VAL 125           HB       VAL 125   5.991  26.214 -13.739
  929   HG11  VAL 125          HG11      VAL 125   4.510  27.207 -15.435
  930   HG12  VAL 125          HG12      VAL 125   3.489  25.749 -15.422
  931   HG13  VAL 125          HG13      VAL 125   3.587  26.798 -13.993
  932   HG21  VAL 125          HG21      VAL 125   4.203  23.759 -13.873
  933   HG22  VAL 125          HG22      VAL 125   5.558  24.037 -12.756
  934   HG23  VAL 125          HG23      VAL 125   4.090  25.000 -12.599
  935    H    CYS 126           H        CYS 126   5.240  25.599 -17.716
  936    HA   CYS 126           HA       CYS 126   7.335  27.673 -18.246
  937    HB2  CYS 126           HB2      CYS 126   7.612  25.625 -19.642
  938    HB3  CYS 126           HB3      CYS 126   5.936  25.729 -20.132
  939    HG   CYS 126           HG       CYS 126   7.342  26.518 -22.144
  940    H    SER 127           H        SER 127   6.605  29.641 -18.762
  941    HA   SER 127           HA       SER 127   3.716  30.071 -19.439
  942    HB2  SER 127           HB2      SER 127   5.447  31.745 -17.585
  943    HB3  SER 127           HB3      SER 127   3.747  32.041 -17.994
  944    HG   SER 127           HG       SER 127   3.984  30.943 -16.000
  945    H    GLY 128           H        GLY 128   6.545  30.231 -20.960
  946    HA2  GLY 128           HA2      GLY 128   5.991  31.414 -23.174
  947    HA3  GLY 128           HA3      GLY 128   6.095  32.901 -22.240
  948    H    SER 129           H        SER 129   8.542  31.482 -20.737
  949    HA   SER 129           HA       SER 129  10.610  31.729 -22.817
  950    HB2  SER 129           HB2      SER 129   9.878  34.082 -22.201
  951    HB3  SER 129           HB3      SER 129  10.512  33.769 -20.573
  952    HG   SER 129           HG       SER 129  12.054  34.758 -21.976
  953    H    TRP 130           H        TRP 130  12.698  31.329 -22.145
  954    HA   TRP 130           HA       TRP 130  13.149  29.194 -20.423
  955    HB2  TRP 130           HB2      TRP 130  14.586  29.604 -22.222
  956    HB3  TRP 130           HB3      TRP 130  14.812  31.291 -21.813
  957    HD1  TRP 130           HD1      TRP 130  16.779  31.996 -20.378
  958    HE1  TRP 130           HE1      TRP 130  18.762  30.816 -19.257
  959    HE3  TRP 130           HE3      TRP 130  15.283  27.141 -21.010
  960    HZ2  TRP 130           HZ2      TRP 130  19.633  28.096 -18.765
  961    HZ3  TRP 130           HZ3      TRP 130  16.700  25.288 -20.149
  962    HH2  TRP 130           HH2      TRP 130  18.859  25.759 -19.048
  963    HA   PRO 131           HA       PRO 131  13.972  27.992 -19.018
  964    HB2  PRO 131           HB2      PRO 131  14.794  26.985 -16.677
  965    HB3  PRO 131           HB3      PRO 131  15.937  27.846 -17.738
  966    HG2  PRO 131           HG2      PRO 131  14.501  28.911 -15.307
  967    HG3  PRO 131           HG3      PRO 131  16.232  29.063 -15.759
  968    HD2  PRO 131           HD2      PRO 131  14.280  31.005 -16.284
  969    HD3  PRO 131           HD3      PRO 131  15.782  30.810 -17.230
  970    H    LEU 132           H        LEU 132  12.793  26.119 -17.666
  971    HA   LEU 132           HA       LEU 132  10.136  27.000 -16.877
  972    HB2  LEU 132           HB2      LEU 132  11.544  24.307 -17.045
  973    HB3  LEU 132           HB3      LEU 132  10.097  24.492 -16.064
  974    HG   LEU 132           HG       LEU 132   9.014  25.598 -18.112
  975   HD11  LEU 132          HD11      LEU 132   9.795  24.780 -20.296
  976   HD12  LEU 132          HD12      LEU 132  10.991  25.829 -19.543
  977   HD13  LEU 132          HD13      LEU 132  11.219  24.064 -19.519
  978   HD21  LEU 132          HD21      LEU 132   8.374  23.387 -17.197
  979   HD22  LEU 132          HD22      LEU 132   8.185  23.486 -18.931
  980   HD23  LEU 132          HD23      LEU 132   9.581  22.618 -18.243
  981    H    ASP 133           H        ASP 133   9.177  26.621 -14.920
  982    HA   ASP 133           HA       ASP 133  10.899  27.226 -12.560
  983    HB2  ASP 133           HB2      ASP 133   9.011  28.752 -13.169
  984    HB3  ASP 133           HB3      ASP 133   7.881  27.423 -12.883
  985    H    GLN 134           H        GLN 134  11.386  25.635 -11.173
  986    HA   GLN 134           HA       GLN 134  10.098  23.030 -11.250
  987    HB2  GLN 134           HB2      GLN 134  12.562  23.385 -11.160
  988    HB3  GLN 134           HB3      GLN 134  12.387  24.207  -9.607
  989    HG2  GLN 134           HG2      GLN 134  11.578  22.093  -8.583
  990    HG3  GLN 134           HG3      GLN 134  11.687  21.295 -10.157
  991   HE21  GLN 134          HE22      GLN 134  13.543  19.984 -10.224
  992   HE22  GLN 134          HE21      GLN 134  15.079  20.455  -9.517
  993    H    THR 135           H        THR 135   8.870  22.127  -9.693
  994    HA   THR 135           HA       THR 135   8.456  23.479  -7.075
  995    HB   THR 135           HB       THR 135   6.682  24.146  -8.770
  996    HG1  THR 135           HG1      THR 135   6.341  24.403  -6.606
  997   HG21  THR 135          HG21      THR 135   5.648  21.303  -8.297
  998   HG22  THR 135          HG22      THR 135   4.724  22.651  -8.985
  999   HG23  THR 135          HG23      THR 135   6.136  22.050  -9.846
 1000    H    LEU 136           H        LEU 136   7.935  22.110  -5.372
 1001    HA   LEU 136           HA       LEU 136   8.490  19.243  -5.705
 1002    HB2  LEU 136           HB2      LEU 136   7.803  21.060  -3.377
 1003    HB3  LEU 136           HB3      LEU 136   7.588  19.331  -3.216
 1004    HG   LEU 136           HG       LEU 136   9.711  20.096  -2.284
 1005   HD11  LEU 136          HD11      LEU 136  11.141  18.384  -3.206
 1006   HD12  LEU 136          HD12      LEU 136   9.476  17.777  -3.136
 1007   HD13  LEU 136          HD13      LEU 136  10.176  18.287  -4.690
 1008   HD21  LEU 136          HD21      LEU 136  10.235  21.918  -3.891
 1009   HD22  LEU 136          HD22      LEU 136  11.583  20.795  -3.643
 1010   HD23  LEU 136          HD23      LEU 136  10.617  20.694  -5.126
 1011    H    ALA 137           H        ALA 137   7.075  17.650  -5.786
 1012    HA   ALA 137           HA       ALA 137   5.322  16.718  -6.834
 1013    HB1  ALA 137           HB1      ALA 137   4.803  16.390  -4.469
 1014    HB2  ALA 137           HB2      ALA 137   3.890  17.910  -4.424
 1015    HB3  ALA 137           HB3      ALA 137   3.309  16.542  -5.406
 1016    H    ARG 138           H        ARG 138   2.990  19.157  -5.882
 1017    HA   ARG 138           HA       ARG 138   2.945  20.290  -8.644
 1018    HB2  ARG 138           HB2      ARG 138   0.462  19.205  -7.230
 1019    HB3  ARG 138           HB3      ARG 138   0.500  20.087  -8.744
 1020    HG2  ARG 138           HG2      ARG 138   0.307  18.019  -9.593
 1021    HG3  ARG 138           HG3      ARG 138   2.055  18.172  -9.603
 1022    HD2  ARG 138           HD2      ARG 138   1.440  15.960  -8.811
 1023    HD3  ARG 138           HD3      ARG 138   2.149  16.840  -7.479
 1024    HE   ARG 138           HE       ARG 138   0.114  16.843  -6.348
 1025   HH11  ARG 138          HH11      ARG 138  -0.521  15.656  -9.592
 1026   HH12  ARG 138          HH12      ARG 138  -2.111  15.105  -9.159
 1027   HH21  ARG 138          HH21      ARG 138  -1.925  16.126  -5.896
 1028   HH22  ARG 138          HH22      ARG 138  -2.877  15.371  -7.134
 1029    H    ASP 139           H        ASP 139   3.791  21.274  -5.930
 1030    HA   ASP 139           HA       ASP 139   1.848  22.792  -4.647
 1031    HB2  ASP 139           HB2      ASP 139   4.022  22.068  -3.758
 1032    HB3  ASP 139           HB3      ASP 139   4.838  23.256  -4.759
 1033    H    THR 140           H        THR 140   3.554  23.826  -7.541
 1034    HA   THR 140           HA       THR 140   1.998  26.390  -7.417
 1035    HB   THR 140           HB       THR 140   4.568  26.455  -7.333
 1036    HG1  THR 140           HG1      THR 140   3.116  27.955  -9.233
 1037   HG21  THR 140          HG21      THR 140   5.820  26.378  -9.294
 1038   HG22  THR 140          HG22      THR 140   4.761  24.967  -9.485
 1039   HG23  THR 140          HG23      THR 140   4.406  26.460 -10.359
 1040    H    ARG 141           H        ARG 141   1.379  23.587  -8.662
 1041    HA   ARG 141           HA       ARG 141   0.549  24.563 -11.367
 1042    HB2  ARG 141           HB2      ARG 141   2.776  23.225 -11.208
 1043    HB3  ARG 141           HB3      ARG 141   1.770  21.812 -10.997
 1044    HG2  ARG 141           HG2      ARG 141   1.704  23.763 -13.356
 1045    HG3  ARG 141           HG3      ARG 141   2.555  22.236 -13.312
 1046    HD2  ARG 141           HD2      ARG 141   0.687  21.690 -14.544
 1047    HD3  ARG 141           HD3      ARG 141   0.294  21.091 -12.940
 1048    HE   ARG 141           HE       ARG 141  -1.540  22.499 -12.948
 1049   HH11  ARG 141          HH11      ARG 141   0.651  23.921 -15.363
 1050   HH12  ARG 141          HH12      ARG 141  -0.548  25.121 -15.756
 1051   HH21  ARG 141          HH21      ARG 141  -2.870  23.921 -13.501
 1052   HH22  ARG 141          HH22      ARG 141  -2.536  25.147 -14.729
 1053    HA   PRO 142           HA       PRO 142  -3.133  22.832  -9.047
 1054    HB2  PRO 142           HB2      PRO 142  -4.290  24.853 -10.972
 1055    HB3  PRO 142           HB3      PRO 142  -4.820  24.445  -9.311
 1056    HG2  PRO 142           HG2      PRO 142  -3.336  26.664  -9.758
 1057    HG3  PRO 142           HG3      PRO 142  -2.958  25.605  -8.359
 1058    HD2  PRO 142           HD2      PRO 142  -1.587  25.721 -11.054
 1059    HD3  PRO 142           HD3      PRO 142  -0.876  25.625  -9.415
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1   2.460   8.164   2.032
    2    H2   MET   1           H2       MET   1   2.009   6.808   2.823
    3    H3   MET   1           H3       MET   1   2.836   7.980   3.611
    4    HA   MET   1           HA       MET   1   4.779   7.621   2.242
    5    HB2  MET   1           HB2      MET   1   4.630   6.432   4.385
    6    HB3  MET   1           HB3      MET   1   3.764   5.096   3.621
    7    HG2  MET   1           HG2      MET   1   6.162   4.623   4.022
    8    HG3  MET   1           HG3      MET   1   5.702   4.477   2.336
    9    HE1  MET   1           HE1      MET   1   8.691   4.422   2.966
   10    HE2  MET   1           HE2      MET   1   8.012   4.479   1.322
   11    HE3  MET   1           HE3      MET   1   9.325   5.584   1.779
   12    H    ALA   2           H        ALA   2   5.783   6.679   0.495
   13    HA   ALA   2           HA       ALA   2   4.211   5.810  -1.740
   14    HB1  ALA   2           HB1      ALA   2   6.447   5.564  -2.792
   15    HB2  ALA   2           HB2      ALA   2   6.289   7.088  -1.919
   16    HB3  ALA   2           HB3      ALA   2   7.213   5.740  -1.203
   17    H    TYR   3           H        TYR   3   5.022   3.798  -3.040
   18    HA   TYR   3           HA       TYR   3   4.091   1.457  -1.739
   19    HB2  TYR   3           HB2      TYR   3   4.068   2.058  -4.189
   20    HB3  TYR   3           HB3      TYR   3   5.781   1.671  -4.252
   21    HD1  TYR   3           HD2      TYR   3   2.370   0.302  -3.618
   22    HD2  TYR   3           HD1      TYR   3   6.492  -0.629  -4.492
   23    HE1  TYR   3           HE2      TYR   3   1.731  -2.048  -4.112
   24    HE2  TYR   3           HE1      TYR   3   5.853  -2.989  -4.975
   25    HH   TYR   3           HH       TYR   3   2.462  -4.130  -4.737
   26    H    GLY   4           H        GLY   4   7.320   2.763  -1.816
   27    HA2  GLY   4           HA2      GLY   4   8.231   0.858   0.161
   28    HA3  GLY   4           HA3      GLY   4   9.011   0.568  -1.398
   29    H    ARG   5           H        ARG   5   9.310   3.279  -2.278
   30    HA   ARG   5           HA       ARG   5  10.659   4.824  -0.166
   31    HB2  ARG   5           HB2      ARG   5  12.306   3.097  -1.207
   32    HB3  ARG   5           HB3      ARG   5  12.161   4.017  -2.690
   33    HG2  ARG   5           HG2      ARG   5  14.156   4.689  -1.669
   34    HG3  ARG   5           HG3      ARG   5  13.076   6.045  -1.411
   35    HD2  ARG   5           HD2      ARG   5  13.563   3.858   0.661
   36    HD3  ARG   5           HD3      ARG   5  14.602   5.276   0.521
   37    HE   ARG   5           HE       ARG   5  12.275   6.558   0.862
   38   HH11  ARG   5          HH21      ARG   5  13.486   3.842   2.735
   39   HH12  ARG   5          HH22      ARG   5  12.656   4.400   4.158
   40   HH21  ARG   5          HH12      ARG   5  11.279   7.130   2.550
   41   HH22  ARG   5          HH11      ARG   5  11.425   6.268   4.083
   42    H    GLU   6           H        GLU   6  10.962   6.974  -0.699
   43    HA   GLU   6           HA       GLU   6   9.816   8.055  -3.236
   44    HB2  GLU   6           HB2      GLU   6   8.976   9.895  -1.486
   45    HB3  GLU   6           HB3      GLU   6   8.029   8.511  -1.963
   46    HG2  GLU   6           HG2      GLU   6   7.863   8.903   0.431
   47    HG3  GLU   6           HG3      GLU   6   8.541   7.325   0.089
   48    H    ASP   7           H        ASP   7  11.982   8.743  -0.435
   49    HA   ASP   7           HA       ASP   7  12.877  11.253  -1.262
   50    HB2  ASP   7           HB2      ASP   7  13.317  10.186   0.924
   51    HB3  ASP   7           HB3      ASP   7  14.429   9.053   0.157
   52    H    VAL   8           H        VAL   8  14.118   8.106  -2.318
   53    HA   VAL   8           HA       VAL   8  16.253   9.090  -4.002
   54    HB   VAL   8           HB       VAL   8  14.652   6.506  -4.205
   55   HG11  VAL   8          HG11      VAL   8  15.789   6.941  -6.345
   56   HG12  VAL   8          HG12      VAL   8  17.308   7.296  -5.491
   57   HG13  VAL   8          HG13      VAL   8  16.624   5.656  -5.474
   58   HG21  VAL   8          HG21      VAL   8  15.875   6.716  -2.054
   59   HG22  VAL   8          HG22      VAL   8  16.612   5.490  -3.088
   60   HG23  VAL   8          HG23      VAL   8  17.368   7.091  -2.938
   61    H    ALA   9           H        ALA   9  12.800   8.327  -4.695
   62    HA   ALA   9           HA       ALA   9  12.960   8.975  -7.486
   63    HB1  ALA   9           HB1      ALA   9  10.557   8.956  -5.607
   64    HB2  ALA   9           HB2      ALA   9  10.505   8.970  -7.383
   65    HB3  ALA   9           HB3      ALA   9  11.179   7.569  -6.532
   66    H    ASN  10           H        ASN  10  12.054  11.005  -4.625
   67    HA   ASN  10           HA       ASN  10  11.568  13.404  -6.145
   68    HB2  ASN  10           HB2      ASN  10  10.829  13.065  -3.803
   69    HB3  ASN  10           HB3      ASN  10  12.509  13.039  -3.264
   70   HD21  ASN  10          HD22      ASN  10   9.865  15.123  -4.373
   71   HD22  ASN  10          HD21      ASN  10  10.721  16.615  -4.055
   72    H    THR  11           H        THR  11  14.586  12.204  -4.590
   73    HA   THR  11           HA       THR  11  16.278  14.358  -5.370
   74    HB   THR  11           HB       THR  11  17.011  11.410  -5.087
   75    HG1  THR  11           HG1      THR  11  16.124  12.104  -3.221
   76   HG21  THR  11          HG21      THR  11  18.841  12.658  -6.144
   77   HG22  THR  11          HG22      THR  11  18.713  13.936  -4.913
   78   HG23  THR  11          HG23      THR  11  19.250  12.302  -4.462
   79    H    ARG  12           H        ARG  12  15.716  11.236  -7.070
   80    HA   ARG  12           HA       ARG  12  17.160  11.920  -9.453
   81    HB2  ARG  12           HB2      ARG  12  14.968   9.914  -8.802
   82    HB3  ARG  12           HB3      ARG  12  15.661  10.032 -10.419
   83    HG2  ARG  12           HG2      ARG  12  17.241   9.398  -7.886
   84    HG3  ARG  12           HG3      ARG  12  16.613   8.220  -9.030
   85    HD2  ARG  12           HD2      ARG  12  18.569   8.381 -10.126
   86    HD3  ARG  12           HD3      ARG  12  17.968   9.917 -10.731
   87    HE   ARG  12           HE       ARG  12  19.612  10.988  -9.470
   88   HH11  ARG  12          HH11      ARG  12  19.564   7.678  -8.259
   89   HH12  ARG  12          HH12      ARG  12  20.645   8.095  -6.960
   90   HH21  ARG  12          HH22      ARG  12  21.008  11.383  -7.853
   91   HH22  ARG  12          HH21      ARG  12  21.524  10.072  -6.811
   92    H    ALA  13           H        ALA  13  13.729  12.588  -8.603
   93    HA   ALA  13           HA       ALA  13  12.940  13.487 -11.181
   94    HB1  ALA  13           HB1      ALA  13  11.387  13.079  -9.256
   95    HB2  ALA  13           HB2      ALA  13  11.984  14.559  -8.493
   96    HB3  ALA  13           HB3      ALA  13  11.147  14.630 -10.055
   97    H    ARG  14           H        ARG  14  14.333  15.345  -8.409
   98    HA   ARG  14           HA       ARG  14  14.319  17.860  -9.872
   99    HB2  ARG  14           HB2      ARG  14  15.844  17.068  -7.349
  100    HB3  ARG  14           HB3      ARG  14  15.711  18.709  -8.004
  101    HG2  ARG  14           HG2      ARG  14  13.157  18.451  -7.834
  102    HG3  ARG  14           HG3      ARG  14  13.452  16.961  -6.937
  103    HD2  ARG  14           HD2      ARG  14  13.147  18.577  -5.277
  104    HD3  ARG  14           HD3      ARG  14  14.906  18.375  -5.366
  105    HE   ARG  14           HE       ARG  14  13.738  20.537  -7.044
  106   HH11  ARG  14          HH11      ARG  14  15.216  19.929  -3.922
  107   HH12  ARG  14          HH12      ARG  14  15.638  21.607  -3.729
  108   HH21  ARG  14          HH21      ARG  14  14.309  22.546  -6.773
  109   HH22  ARG  14          HH22      ARG  14  15.125  23.081  -5.314
  110    H    GLU  15           H        GLU  15  16.801  15.383  -9.379
  111    HA   GLU  15           HA       GLU  15  18.856  16.684 -10.935
  112    HB2  GLU  15           HB2      GLU  15  18.173  13.753 -10.519
  113    HB3  GLU  15           HB3      GLU  15  19.575  14.358 -11.427
  114    HG2  GLU  15           HG2      GLU  15  20.458  15.456  -9.437
  115    HG3  GLU  15           HG3      GLU  15  19.091  14.851  -8.487
  116    H    THR  16           H        THR  16  16.207  14.445 -11.989
  117    HA   THR  16           HA       THR  16  16.854  14.412 -14.755
  118    HB   THR  16           HB       THR  16  14.097  14.215 -13.474
  119    HG1  THR  16           HG1      THR  16  15.487  12.642 -12.742
  120   HG21  THR  16          HG21      THR  16  13.517  12.888 -15.486
  121   HG22  THR  16          HG22      THR  16  13.887  14.563 -15.912
  122   HG23  THR  16          HG23      THR  16  15.093  13.291 -16.198
  123    H    ALA  17           H        ALA  17  14.827  16.685 -12.919
  124    HA   ALA  17           HA       ALA  17  14.177  18.390 -15.127
  125    HB1  ALA  17           HB1      ALA  17  14.356  18.893 -12.132
  126    HB2  ALA  17           HB2      ALA  17  13.641  20.011 -13.308
  127    HB3  ALA  17           HB3      ALA  17  12.918  18.400 -13.058
  128    H    ALA  18           H        ALA  18  16.965  18.555 -12.811
  129    HA   ALA  18           HA       ALA  18  18.090  20.934 -13.943
  130    HB1  ALA  18           HB1      ALA  18  18.724  19.993 -11.746
  131    HB2  ALA  18           HB2      ALA  18  19.470  18.594 -12.550
  132    HB3  ALA  18           HB3      ALA  18  20.139  20.219 -12.791
  133    H    ARG  19           H        ARG  19  18.601  17.487 -14.739
  134    HA   ARG  19           HA       ARG  19  20.502  17.857 -16.882
  135    HB2  ARG  19           HB2      ARG  19  18.530  15.620 -16.244
  136    HB3  ARG  19           HB3      ARG  19  19.716  15.537 -17.553
  137    HG2  ARG  19           HG2      ARG  19  21.575  15.690 -16.029
  138    HG3  ARG  19           HG3      ARG  19  20.524  16.057 -14.661
  139    HD2  ARG  19           HD2      ARG  19  19.481  13.814 -14.862
  140    HD3  ARG  19           HD3      ARG  19  20.618  13.421 -16.172
  141    HE   ARG  19           HE       ARG  19  22.420  13.991 -14.390
  142   HH11  ARG  19          HH11      ARG  19  19.482  12.155 -13.478
  143   HH12  ARG  19          HH12      ARG  19  20.111  12.057 -11.833
  144   HH21  ARG  19          HH21      ARG  19  23.054  13.511 -12.288
  145   HH22  ARG  19          HH22      ARG  19  21.911  12.653 -11.261
  146    H    PHE  20           H        PHE  20  16.919  17.560 -16.972
  147    HA   PHE  20           HA       PHE  20  16.610  18.095 -19.738
  148    HB2  PHE  20           HB2      PHE  20  14.741  17.332 -18.345
  149    HB3  PHE  20           HB3      PHE  20  14.826  18.792 -17.381
  150    HD1  PHE  20           HD2      PHE  20  14.750  18.136 -21.127
  151    HD2  PHE  20           HD1      PHE  20  13.036  20.234 -17.760
  152    HE1  PHE  20           HE2      PHE  20  13.180  19.298 -22.640
  153    HE2  PHE  20           HE1      PHE  20  11.483  21.411 -19.294
  154    HZ   PHE  20           HZ       PHE  20  11.548  20.943 -21.738
  155    H    THR  21           H        THR  21  16.806  20.455 -17.015
  156    HA   THR  21           HA       THR  21  16.413  22.769 -18.620
  157    HB   THR  21           HB       THR  21  18.049  22.600 -16.060
  158    HG1  THR  21           HG1      THR  21  15.981  21.774 -15.766
  159   HG21  THR  21          HG21      THR  21  17.166  24.954 -15.751
  160   HG22  THR  21          HG22      THR  21  18.315  24.795 -17.085
  161   HG23  THR  21          HG23      THR  21  16.570  24.904 -17.417
  162    H    ALA  22           H        ALA  22  19.531  21.117 -17.772
  163    HA   ALA  22           HA       ALA  22  21.162  22.881 -19.326
  164    HB1  ALA  22           HB1      ALA  22  22.816  21.049 -19.195
  165    HB2  ALA  22           HB2      ALA  22  22.032  21.312 -17.625
  166    HB3  ALA  22           HB3      ALA  22  21.553  19.931 -18.637
  167    H    ALA  23           H        ALA  23  19.477  19.871 -20.277
  168    HA   ALA  23           HA       ALA  23  20.412  19.837 -22.986
  169    HB1  ALA  23           HB1      ALA  23  17.843  18.651 -21.864
  170    HB2  ALA  23           HB2      ALA  23  18.770  18.109 -23.282
  171    HB3  ALA  23           HB3      ALA  23  19.453  17.921 -21.671
  172    H    LEU  24           H        LEU  24  17.611  21.438 -21.493
  173    HA   LEU  24           HA       LEU  24  16.450  22.461 -23.913
  174    HB2  LEU  24           HB2      LEU  24  15.287  22.115 -21.743
  175    HB3  LEU  24           HB3      LEU  24  16.268  23.378 -21.020
  176    HG   LEU  24           HG       LEU  24  15.229  25.024 -22.656
  177   HD11  LEU  24          HD11      LEU  24  13.100  24.321 -23.733
  178   HD12  LEU  24          HD12      LEU  24  14.476  23.421 -24.387
  179   HD13  LEU  24          HD13      LEU  24  13.386  22.647 -23.216
  180   HD21  LEU  24          HD21      LEU  24  13.086  25.141 -21.451
  181   HD22  LEU  24          HD22      LEU  24  13.313  23.482 -20.856
  182   HD23  LEU  24          HD23      LEU  24  14.411  24.776 -20.333
  183    H    GLU  25           H        GLU  25  19.000  23.701 -21.729
  184    HA   GLU  25           HA       GLU  25  19.330  26.259 -23.004
  185    HB2  GLU  25           HB2      GLU  25  20.417  25.397 -20.815
  186    HB3  GLU  25           HB3      GLU  25  21.607  24.617 -21.849
  187    HG2  GLU  25           HG2      GLU  25  22.131  26.834 -22.882
  188    HG3  GLU  25           HG3      GLU  25  20.963  27.593 -21.801
  189    H    LEU  26           H        LEU  26  20.858  23.083 -23.634
  190    HA   LEU  26           HA       LEU  26  22.337  23.683 -25.976
  191    HB2  LEU  26           HB2      LEU  26  22.795  21.604 -25.130
  192    HB3  LEU  26           HB3      LEU  26  21.157  21.309 -24.638
  193    HG   LEU  26           HG       LEU  26  20.569  20.858 -27.091
  194   HD11  LEU  26          HD11      LEU  26  22.425  20.183 -28.542
  195   HD12  LEU  26          HD12      LEU  26  22.594  21.892 -28.109
  196   HD13  LEU  26          HD13      LEU  26  23.605  20.673 -27.305
  197   HD21  LEU  26          HD21      LEU  26  21.440  18.569 -26.969
  198   HD22  LEU  26          HD22      LEU  26  22.537  19.049 -25.652
  199   HD23  LEU  26          HD23      LEU  26  20.772  19.104 -25.421
  200    H    ALA  27           H        ALA  27  18.903  22.742 -25.704
  201    HA   ALA  27           HA       ALA  27  18.302  22.914 -28.475
  202    HB1  ALA  27           HB1      ALA  27  16.500  23.371 -26.061
  203    HB2  ALA  27           HB2      ALA  27  15.955  23.057 -27.713
  204    HB3  ALA  27           HB3      ALA  27  16.858  21.808 -26.823
  205    H    ILE  28           H        ILE  28  18.064  25.486 -25.963
  206    HA   ILE  28           HA       ILE  28  17.095  27.562 -27.710
  207    HB   ILE  28           HB       ILE  28  18.628  27.620 -25.085
  208   HG12  ILE  28          HG12      ILE  28  15.729  28.380 -25.627
  209   HG13  ILE  28          HG13      ILE  28  16.193  26.724 -25.252
  210   HG21  ILE  28          HG21      ILE  28  17.413  29.962 -26.622
  211   HG22  ILE  28          HG22      ILE  28  17.939  30.038 -24.927
  212   HG23  ILE  28          HG23      ILE  28  19.122  29.743 -26.189
  213   HD11  ILE  28          HD11      ILE  28  17.174  27.474 -23.107
  214   HD12  ILE  28          HD12      ILE  28  16.547  29.111 -23.424
  215   HD13  ILE  28          HD13      ILE  28  15.425  27.745 -23.254
  216    H    ASP  29           H        ASP  29  20.439  26.670 -26.746
  217    HA   ASP  29           HA       ASP  29  21.774  28.661 -28.247
  218    HB2  ASP  29           HB2      ASP  29  22.790  27.229 -26.481
  219    HB3  ASP  29           HB3      ASP  29  22.707  25.847 -27.578
  220    H    ARG  30           H        ARG  30  20.535  25.492 -29.297
  221    HA   ARG  30           HA       ARG  30  21.664  25.833 -32.000
  222    HB2  ARG  30           HB2      ARG  30  21.401  23.616 -30.872
  223    HB3  ARG  30           HB3      ARG  30  19.645  23.770 -31.018
  224    HG2  ARG  30           HG2      ARG  30  19.820  23.854 -33.466
  225    HG3  ARG  30           HG3      ARG  30  21.586  23.902 -33.391
  226    HD2  ARG  30           HD2      ARG  30  19.876  21.583 -32.416
  227    HD3  ARG  30           HD3      ARG  30  20.604  21.697 -34.024
  228    HE   ARG  30           HE       ARG  30  22.359  21.850 -31.612
  229   HH11  ARG  30          HH11      ARG  30  21.511  20.023 -34.497
  230   HH12  ARG  30          HH12      ARG  30  22.681  18.768 -34.129
  231   HH21  ARG  30          HH21      ARG  30  23.890  20.251 -31.312
  232   HH22  ARG  30          HH22      ARG  30  23.943  18.893 -32.415
  233    H    ALA  31           H        ALA  31  18.440  26.367 -30.549
  234    HA   ALA  31           HA       ALA  31  16.998  26.699 -32.945
  235    HB1  ALA  31           HB1      ALA  31  15.995  26.496 -30.680
  236    HB2  ALA  31           HB2      ALA  31  16.577  28.128 -30.283
  237    HB3  ALA  31           HB3      ALA  31  15.366  27.894 -31.562
  238    H    THR  32           H        THR  32  19.136  29.090 -31.433
  239    HA   THR  32           HA       THR  32  18.241  31.220 -33.212
  240    HB   THR  32           HB       THR  32  19.396  31.381 -30.886
  241    HG1  THR  32           HG1      THR  32  18.717  33.097 -31.935
  242   HG21  THR  32          HG21      THR  32  21.765  31.964 -30.965
  243   HG22  THR  32          HG22      THR  32  21.513  30.274 -31.419
  244   HG23  THR  32          HG23      THR  32  21.862  31.487 -32.674
  245    H    LEU  33           H        LEU  33  20.130  28.465 -33.797
  246    HA   LEU  33           HA       LEU  33  21.657  29.697 -35.990
  247    HB2  LEU  33           HB2      LEU  33  22.103  27.106 -34.469
  248    HB3  LEU  33           HB3      LEU  33  23.166  27.757 -35.710
  249    HG   LEU  33           HG       LEU  33  22.610  29.040 -33.005
  250   HD11  LEU  33          HD11      LEU  33  24.899  28.371 -32.452
  251   HD12  LEU  33          HD12      LEU  33  23.896  26.965 -32.817
  252   HD13  LEU  33          HD13      LEU  33  25.059  27.558 -34.029
  253   HD21  LEU  33          HD21      LEU  33  23.196  30.743 -34.696
  254   HD22  LEU  33          HD22      LEU  33  24.525  30.511 -33.555
  255   HD23  LEU  33          HD23      LEU  33  24.616  29.789 -35.178
  256    H    SER  34           H        SER  34  19.388  27.096 -35.218
  257    HA   SER  34           HA       SER  34  19.753  25.494 -37.535
  258    HB2  SER  34           HB2      SER  34  17.601  24.426 -36.706
  259    HB3  SER  34           HB3      SER  34  18.928  24.525 -35.544
  260    HG   SER  34           HG       SER  34  16.452  25.759 -35.462
  261    H    GLY  35           H        GLY  35  17.743  28.331 -37.145
  262    HA2  GLY  35           HA2      GLY  35  16.828  29.569 -38.954
  263    HA3  GLY  35           HA3      GLY  35  16.952  28.155 -40.003
  264    H    GLN  36           H        GLN  36  15.618  26.579 -37.779
  265    HA   GLN  36           HA       GLN  36  12.811  27.563 -37.766
  266    HB2  GLN  36           HB2      GLN  36  12.973  25.671 -39.390
  267    HB3  GLN  36           HB3      GLN  36  13.792  24.705 -38.169
  268    HG2  GLN  36           HG2      GLN  36  11.617  24.964 -36.749
  269    HG3  GLN  36           HG3      GLN  36  10.876  25.516 -38.248
  270   HE21  GLN  36          HE22      GLN  36  12.085  22.774 -36.386
  271   HE22  GLN  36          HE21      GLN  36  11.625  21.563 -37.598
  272    HA   PRO  37           HA       PRO  37  13.231  27.009 -33.268
  273    HB2  PRO  37           HB2      PRO  37  10.555  25.663 -33.804
  274    HB3  PRO  37           HB3      PRO  37  11.008  26.671 -32.398
  275    HG2  PRO  37           HG2      PRO  37   9.657  27.808 -34.407
  276    HG3  PRO  37           HG3      PRO  37  11.103  28.652 -33.758
  277    HD2  PRO  37           HD2      PRO  37  10.842  27.027 -36.275
  278    HD3  PRO  37           HD3      PRO  37  11.764  28.530 -35.988
  279    H    VAL  38           H        VAL  38  13.516  25.391 -31.728
  280    HA   VAL  38           HA       VAL  38  14.096  22.605 -32.720
  281    HB   VAL  38           HB       VAL  38  15.348  24.217 -30.469
  282   HG11  VAL  38          HG11      VAL  38  16.956  22.304 -30.260
  283   HG12  VAL  38          HG12      VAL  38  15.337  21.911 -29.693
  284   HG13  VAL  38          HG13      VAL  38  15.886  21.329 -31.277
  285   HG21  VAL  38          HG21      VAL  38  16.118  24.766 -32.787
  286   HG22  VAL  38          HG22      VAL  38  17.394  24.006 -31.832
  287   HG23  VAL  38          HG23      VAL  38  16.507  23.074 -33.059
  288    H    GLY  39           H        GLY  39  13.579  20.822 -31.008
  289    HA2  GLY  39           HA2      GLY  39  11.675  21.657 -28.915
  290    HA3  GLY  39           HA3      GLY  39  10.956  20.780 -30.257
  291    H    ILE  40           H        ILE  40  10.497  19.662 -28.003
  292    HA   ILE  40           HA       ILE  40  12.305  17.291 -27.886
  293    HB   ILE  40           HB       ILE  40  11.025  18.479 -25.413
  294   HG12  ILE  40          HG12      ILE  40  13.698  18.682 -24.886
  295   HG13  ILE  40          HG13      ILE  40  13.720  19.024 -26.609
  296   HG21  ILE  40          HG21      ILE  40  12.481  16.868 -24.227
  297   HG22  ILE  40          HG22      ILE  40  11.377  16.047 -25.311
  298   HG23  ILE  40          HG23      ILE  40  13.081  16.255 -25.781
  299   HD11  ILE  40          HD11      ILE  40  12.022  20.833 -26.219
  300   HD12  ILE  40          HD12      ILE  40  12.069  20.466 -24.485
  301   HD13  ILE  40          HD13      ILE  40  13.526  21.073 -25.297
  302    H    HIS  41           H        HIS  41  11.343  15.514 -28.249
  303    HA   HIS  41           HA       HIS  41   8.426  15.128 -28.331
  304    HB2  HIS  41           HB2      HIS  41   9.898  14.253 -30.098
  305    HB3  HIS  41           HB3      HIS  41  10.865  13.384 -28.912
  306    HD1  HIS  41           HD1      HIS  41   9.962  11.022 -28.138
  307    HD2  HIS  41           HD2      HIS  41   7.422  13.252 -30.646
  308    HE1  HIS  41           HE1      HIS  41   8.141   9.419 -28.919
  309    H    PHE  42           H        PHE  42   7.340  13.876 -26.863
  310    HA   PHE  42           HA       PHE  42   8.733  12.714 -24.500
  311    HB2  PHE  42           HB2      PHE  42   6.541  14.824 -24.526
  312    HB3  PHE  42           HB3      PHE  42   6.781  13.755 -23.167
  313    HD1  PHE  42           HD1      PHE  42   8.780  13.859 -21.762
  314    HD2  PHE  42           HD2      PHE  42   8.076  16.783 -24.865
  315    HE1  PHE  42           HE1      PHE  42  10.352  15.423 -20.648
  316    HE2  PHE  42           HE2      PHE  42   9.594  18.350 -23.706
  317    HZ   PHE  42           HZ       PHE  42  10.751  17.680 -21.616
  318    H    SER  43           H        SER  43   7.858  10.791 -23.937
  319    HA   SER  43           HA       SER  43   5.113  10.053 -24.768
  320    HB2  SER  43           HB2      SER  43   6.777   9.408 -26.564
  321    HB3  SER  43           HB3      SER  43   7.470   8.264 -25.393
  322    HG   SER  43           HG       SER  43   5.818   7.337 -26.737
  323    H    ASP  44           H        ASP  44   4.981   7.528 -24.025
  324    HA   ASP  44           HA       ASP  44   4.301   7.761 -21.339
  325    HB2  ASP  44           HB2      ASP  44   3.343   6.207 -23.009
  326    HB3  ASP  44           HB3      ASP  44   4.809   5.231 -22.942
  327    H    SER  45           H        SER  45   7.422   6.587 -22.527
  328    HA   SER  45           HA       SER  45   8.344   6.193 -19.705
  329    HB2  SER  45           HB2      SER  45   9.478   4.135 -20.400
  330    HB3  SER  45           HB3      SER  45   7.730   4.030 -20.660
  331    HG   SER  45           HG       SER  45   8.920   3.268 -22.467
  332    H    ALA  46           H        ALA  46   9.025   7.873 -22.542
  333    HA   ALA  46           HA       ALA  46  11.687   8.595 -21.635
  334    HB1  ALA  46           HB1      ALA  46  11.390   7.159 -24.319
  335    HB2  ALA  46           HB2      ALA  46  12.885   7.874 -23.673
  336    HB3  ALA  46           HB3      ALA  46  12.165   6.476 -22.873
  337    H    TRP  47           H        TRP  47  12.740  10.053 -23.370
  338    HA   TRP  47           HA       TRP  47  10.936  11.706 -24.973
  339    HB2  TRP  47           HB2      TRP  47  11.683  13.778 -23.736
  340    HB3  TRP  47           HB3      TRP  47  10.606  12.724 -22.835
  341    HD1  TRP  47           HD1      TRP  47  14.282  13.817 -22.923
  342    HE1  TRP  47           HE1      TRP  47  15.349  13.381 -20.631
  343    HE3  TRP  47           HE3      TRP  47  10.442  11.229 -20.721
  344    HZ2  TRP  47           HZ2      TRP  47  14.649  12.044 -18.180
  345    HZ3  TRP  47           HZ3      TRP  47  10.708  10.321 -18.426
  346    HH2  TRP  47           HH2      TRP  47  12.785  10.753 -17.133
  347    H    ARG  48           H        ARG  48  12.152  13.261 -26.262
  348    HA   ARG  48           HA       ARG  48  15.065  12.980 -26.545
  349    HB2  ARG  48           HB2      ARG  48  14.218  10.872 -27.537
  350    HB3  ARG  48           HB3      ARG  48  13.118  11.783 -28.572
  351    HG2  ARG  48           HG2      ARG  48  14.985  12.711 -29.836
  352    HG3  ARG  48           HG3      ARG  48  16.157  12.042 -28.687
  353    HD2  ARG  48           HD2      ARG  48  16.064  10.698 -30.718
  354    HD3  ARG  48           HD3      ARG  48  15.505   9.759 -29.324
  355    HE   ARG  48           HE       ARG  48  13.237  10.943 -30.581
  356   HH11  ARG  48          HH11      ARG  48  15.596   8.444 -31.339
  357   HH12  ARG  48          HH12      ARG  48  14.452   7.572 -32.327
  358   HH21  ARG  48          HH21      ARG  48  11.859   9.763 -31.862
  359   HH22  ARG  48          HH22      ARG  48  12.418   8.307 -32.618
  360    H    ILE  49           H        ILE  49  15.964  14.679 -27.482
  361    HA   ILE  49           HA       ILE  49  14.349  16.948 -28.295
  362    HB   ILE  49           HB       ILE  49  17.346  16.484 -28.492
  363   HG12  ILE  49          HG12      ILE  49  15.540  17.707 -26.373
  364   HG13  ILE  49          HG13      ILE  49  16.585  16.310 -26.199
  365   HG21  ILE  49          HG21      ILE  49  15.809  19.124 -28.605
  366   HG22  ILE  49          HG22      ILE  49  17.564  18.913 -28.717
  367   HG23  ILE  49          HG23      ILE  49  16.546  18.341 -30.017
  368   HD11  ILE  49          HD11      ILE  49  18.580  17.791 -26.394
  369   HD12  ILE  49          HD12      ILE  49  17.490  19.206 -26.469
  370   HD13  ILE  49          HD13      ILE  49  17.504  18.197 -25.034
  371    H    MET  50           H        MET  50  14.106  17.878 -30.334
  372    HA   MET  50           HA       MET  50  14.872  16.316 -32.742
  373    HB2  MET  50           HB2      MET  50  12.071  17.339 -32.114
  374    HB3  MET  50           HB3      MET  50  12.608  16.767 -33.696
  375    HG2  MET  50           HG2      MET  50  13.124  14.539 -32.694
  376    HG3  MET  50           HG3      MET  50  12.474  15.115 -31.158
  377    HE1  MET  50           HE1      MET  50  11.681  14.983 -34.952
  378    HE2  MET  50           HE2      MET  50  11.406  13.279 -34.550
  379    HE3  MET  50           HE3      MET  50  10.035  14.319 -35.022
  380    H    VAL  51           H        VAL  51  14.886  17.503 -34.654
  381    HA   VAL  51           HA       VAL  51  15.050  20.482 -34.510
  382    HB   VAL  51           HB       VAL  51  17.347  20.249 -35.603
  383   HG11  VAL  51          HG11      VAL  51  17.027  20.902 -33.244
  384   HG12  VAL  51          HG12      VAL  51  17.196  19.206 -32.758
  385   HG13  VAL  51          HG13      VAL  51  18.547  20.051 -33.542
  386   HG21  VAL  51          HG21      VAL  51  17.304  17.404 -34.526
  387   HG22  VAL  51          HG22      VAL  51  17.217  17.856 -36.242
  388   HG23  VAL  51          HG23      VAL  51  18.656  18.253 -35.301
  389    HA   PRO  52           HA       PRO  52  13.909  20.163 -38.884
  390    HB2  PRO  52           HB2      PRO  52  15.513  22.047 -40.116
  391    HB3  PRO  52           HB3      PRO  52  14.053  22.447 -39.166
  392    HG2  PRO  52           HG2      PRO  52  16.942  22.410 -38.227
  393    HG3  PRO  52           HG3      PRO  52  15.745  23.720 -38.007
  394    HD2  PRO  52           HD2      PRO  52  16.201  21.992 -36.024
  395    HD3  PRO  52           HD3      PRO  52  14.520  22.438 -36.407
  396    H    GLY  53           H        GLY  53  14.788  19.382 -40.946
  397    HA2  GLY  53           HA2      GLY  53  17.612  18.454 -41.001
  398    HA3  GLY  53           HA3      GLY  53  16.378  17.198 -40.943
  399    H    LYS  54           H        LYS  54  14.549  17.580 -42.730
  400    HA   LYS  54           HA       LYS  54  15.837  17.488 -45.301
  401    HB2  LYS  54           HB2      LYS  54  12.883  17.770 -44.571
  402    HB3  LYS  54           HB3      LYS  54  13.469  17.488 -46.198
  403    HG2  LYS  54           HG2      LYS  54  13.697  15.604 -43.823
  404    HG3  LYS  54           HG3      LYS  54  12.735  15.391 -45.277
  405    HD2  LYS  54           HD2      LYS  54  15.755  15.240 -44.990
  406    HD3  LYS  54           HD3      LYS  54  14.662  13.945 -45.433
  407    HE2  LYS  54           HE2      LYS  54  15.201  16.429 -47.142
  408    HE3  LYS  54           HE3      LYS  54  16.042  14.893 -47.321
  409    HZ1  LYS  54           HZ1      LYS  54  13.913  13.830 -47.837
  410    HZ2  LYS  54           HZ2      LYS  54  13.110  15.244 -47.690
  411    HZ3  LYS  54           HZ3      LYS  54  14.200  15.041 -48.882
  412    H    THR  55           H        THR  55  14.344  20.169 -43.634
  413    HA   THR  55           HA       THR  55  15.763  21.967 -45.410
  414    HB   THR  55           HB       THR  55  13.881  22.053 -46.753
  415    HG1  THR  55           HG1      THR  55  13.208  24.094 -46.494
  416   HG21  THR  55          HG21      THR  55  12.204  20.869 -45.387
  417   HG22  THR  55          HG22      THR  55  12.086  22.277 -44.308
  418   HG23  THR  55          HG23      THR  55  11.575  22.395 -46.008
  419    HA   PRO  56           HA       PRO  56  15.749  24.100 -41.385
  420    HB2  PRO  56           HB2      PRO  56  17.464  26.116 -41.946
  421    HB3  PRO  56           HB3      PRO  56  18.020  24.417 -41.890
  422    HG2  PRO  56           HG2      PRO  56  17.240  26.038 -44.340
  423    HG3  PRO  56           HG3      PRO  56  18.734  25.081 -44.083
  424    HD2  PRO  56           HD2      PRO  56  16.523  24.095 -45.399
  425    HD3  PRO  56           HD3      PRO  56  17.600  23.050 -44.430
  426    H    SER  57           H        SER  57  14.143  24.996 -44.189
  427    HA   SER  57           HA       SER  57  13.321  27.694 -43.190
  428    HB2  SER  57           HB2      SER  57  13.549  26.607 -46.015
  429    HB3  SER  57           HB3      SER  57  13.021  28.243 -45.574
  430    HG   SER  57           HG       SER  57  15.243  28.172 -46.108
  431    H    ALA  58           H        ALA  58  11.943  24.624 -43.492
  432    HA   ALA  58           HA       ALA  58   9.278  25.824 -43.193
  433    HB1  ALA  58           HB1      ALA  58   9.812  23.710 -45.327
  434    HB2  ALA  58           HB2      ALA  58   8.228  24.367 -44.874
  435    HB3  ALA  58           HB3      ALA  58   9.433  25.417 -45.639
  436    H    TRP  59           H        TRP  59   7.752  24.428 -42.221
  437    HA   TRP  59           HA       TRP  59   8.674  23.144 -39.966
  438    HB2  TRP  59           HB2      TRP  59   6.481  24.124 -40.205
  439    HB3  TRP  59           HB3      TRP  59   6.000  22.880 -41.349
  440    HD1  TRP  59           HD1      TRP  59   5.163  20.614 -40.411
  441    HE1  TRP  59           HE1      TRP  59   4.499  19.766 -38.083
  442    HE3  TRP  59           HE3      TRP  59   7.277  24.319 -37.567
  443    HZ2  TRP  59           HZ2      TRP  59   4.779  20.623 -35.345
  444    HZ3  TRP  59           HZ3      TRP  59   7.049  24.277 -35.094
  445    HH2  TRP  59           HH2      TRP  59   5.801  22.444 -33.973
  446    H    ARG  60           H        ARG  60  10.048  21.482 -39.970
  447    HA   ARG  60           HA       ARG  60   8.867  18.834 -40.303
  448    HB2  ARG  60           HB2      ARG  60   9.877  19.311 -42.566
  449    HB3  ARG  60           HB3      ARG  60  11.440  19.524 -41.802
  450    HG2  ARG  60           HG2      ARG  60  11.190  17.371 -42.940
  451    HG3  ARG  60           HG3      ARG  60  11.559  17.149 -41.247
  452    HD2  ARG  60           HD2      ARG  60   8.642  17.139 -41.942
  453    HD3  ARG  60           HD3      ARG  60   9.588  15.855 -42.685
  454    HE   ARG  60           HE       ARG  60  10.429  15.360 -40.285
  455   HH11  ARG  60          HH21      ARG  60   7.086  16.121 -41.069
  456   HH12  ARG  60          HH22      ARG  60   6.513  15.245 -39.668
  457   HH21  ARG  60          HH11      ARG  60   9.638  14.525 -38.472
  458   HH22  ARG  60          HH12      ARG  60   7.918  14.549 -38.127
  459    H    TRP  61           H        TRP  61  10.117  17.198 -39.259
  460    HA   TRP  61           HA       TRP  61  12.116  18.113 -37.250
  461    HB2  TRP  61           HB2      TRP  61   9.558  16.544 -36.717
  462    HB3  TRP  61           HB3      TRP  61  10.829  16.881 -35.545
  463    HD1  TRP  61           HD1      TRP  61   7.701  18.327 -36.856
  464    HE1  TRP  61           HE1      TRP  61   7.319  20.686 -35.853
  465    HE3  TRP  61           HE3      TRP  61  12.314  19.080 -34.845
  466    HZ2  TRP  61           HZ2      TRP  61   8.793  22.540 -34.178
  467    HZ3  TRP  61           HZ3      TRP  61  12.798  21.101 -33.503
  468    HH2  TRP  61           HH2      TRP  61  11.048  22.819 -33.136
  469    H    VAL  62           H        VAL  62  13.689  16.719 -36.817
  470    HA   VAL  62           HA       VAL  62  13.387  13.801 -37.268
  471    HB   VAL  62           HB       VAL  62  15.686  13.664 -38.151
  472   HG11  VAL  62          HG11      VAL  62  13.753  13.751 -39.709
  473   HG12  VAL  62          HG12      VAL  62  13.996  15.503 -39.880
  474   HG13  VAL  62          HG13      VAL  62  15.255  14.372 -40.412
  475   HG21  VAL  62          HG21      VAL  62  16.889  15.590 -39.008
  476   HG22  VAL  62          HG22      VAL  62  15.643  16.690 -38.392
  477   HG23  VAL  62          HG23      VAL  62  16.652  15.754 -37.267
  478    HA   PRO  63           HA       PRO  63  15.021  13.702 -33.187
  479    HB2  PRO  63           HB2      PRO  63  16.430  11.352 -33.025
  480    HB3  PRO  63           HB3      PRO  63  14.646  11.453 -33.146
  481    HG2  PRO  63           HG2      PRO  63  16.629  10.988 -35.389
  482    HG3  PRO  63           HG3      PRO  63  15.139  10.060 -35.016
  483    HD2  PRO  63           HD2      PRO  63  15.147  12.000 -36.896
  484    HD3  PRO  63           HD3      PRO  63  13.747  11.807 -35.804
  485    H    LEU  64           H        LEU  64  16.601  14.614 -32.064
  486    HA   LEU  64           HA       LEU  64  18.870  15.699 -33.374
  487    HB2  LEU  64           HB2      LEU  64  17.497  16.690 -31.592
  488    HB3  LEU  64           HB3      LEU  64  18.153  15.563 -30.423
  489    HG   LEU  64           HG       LEU  64  18.955  18.030 -30.543
  490   HD11  LEU  64          HD11      LEU  64  19.984  16.498 -29.046
  491   HD12  LEU  64          HD12      LEU  64  20.909  15.747 -30.370
  492   HD13  LEU  64          HD13      LEU  64  21.266  17.412 -29.857
  493   HD21  LEU  64          HD21      LEU  64  20.740  18.588 -31.947
  494   HD22  LEU  64          HD22      LEU  64  20.865  16.956 -32.630
  495   HD23  LEU  64          HD23      LEU  64  19.456  17.970 -33.000
  496    H    GLN  65           H        GLN  65  18.494  12.711 -31.742
  497    HA   GLN  65           HA       GLN  65  21.020  11.756 -31.177
  498    HB2  GLN  65           HB2      GLN  65  18.683  10.410 -32.575
  499    HB3  GLN  65           HB3      GLN  65  20.179   9.540 -32.235
  500    HG2  GLN  65           HG2      GLN  65  19.933  10.068 -29.815
  501    HG3  GLN  65           HG3      GLN  65  18.345  10.771 -30.162
  502   HE21  GLN  65          HE22      GLN  65  20.052   7.861 -29.449
  503   HE22  GLN  65          HE21      GLN  65  18.698   6.772 -29.759
  504    H    GLU  66           H        GLU  66  19.998  12.778 -34.363
  505    HA   GLU  66           HA       GLU  66  21.861  11.526 -36.048
  506    HB2  GLU  66           HB2      GLU  66  20.004  13.018 -36.719
  507    HB3  GLU  66           HB3      GLU  66  20.884  14.410 -36.075
  508    HG2  GLU  66           HG2      GLU  66  22.656  14.109 -37.735
  509    HG3  GLU  66           HG3      GLU  66  21.935  12.592 -38.284
  510    H    ASP  67           H        ASP  67  22.516  14.027 -33.610
  511    HA   ASP  67           HA       ASP  67  25.378  13.438 -34.029
  512    HB2  ASP  67           HB2      ASP  67  26.113  15.728 -34.091
  513    HB3  ASP  67           HB3      ASP  67  24.952  15.457 -35.373
  514    H    ALA  68           H        ALA  68  23.027  13.588 -31.734
  515    HA   ALA  68           HA       ALA  68  25.158  13.277 -29.674
  516    HB1  ALA  68           HB1      ALA  68  24.222  15.508 -29.307
  517    HB2  ALA  68           HB2      ALA  68  22.587  14.829 -29.242
  518    HB3  ALA  68           HB3      ALA  68  23.768  14.407 -27.990
  519    H    ALA  69           H        ALA  69  24.599  11.217 -30.898
  520    HA   ALA  69           HA       ALA  69  22.360   9.811 -30.988
  521    HB1  ALA  69           HB1      ALA  69  23.770   7.822 -31.257
  522    HB2  ALA  69           HB2      ALA  69  24.469   9.236 -32.064
  523    HB3  ALA  69           HB3      ALA  69  25.132   8.680 -30.507
  524    H    ASP  70           H        ASP  70  24.142   9.994 -27.951
  525    HA   ASP  70           HA       ASP  70  22.186   8.123 -26.684
  526    HB2  ASP  70           HB2      ASP  70  23.926   7.152 -25.418
  527    HB3  ASP  70           HB3      ASP  70  24.440   7.138 -27.097
  528    H    GLU  71           H        GLU  71  22.904  11.307 -26.692
  529    HA   GLU  71           HA       GLU  71  22.210  11.658 -23.784
  530    HB2  GLU  71           HB2      GLU  71  24.144  13.322 -25.441
  531    HB3  GLU  71           HB3      GLU  71  23.565  13.743 -23.826
  532    HG2  GLU  71           HG2      GLU  71  24.522  11.610 -22.942
  533    HG3  GLU  71           HG3      GLU  71  25.211  11.285 -24.534
  534    H    SER  72           H        SER  72  21.350  12.380 -27.020
  535    HA   SER  72           HA       SER  72  19.757  14.772 -26.522
  536    HB2  SER  72           HB2      SER  72  18.799  14.212 -28.767
  537    HB3  SER  72           HB3      SER  72  20.572  14.309 -28.745
  538    HG   SER  72           HG       SER  72  20.746  12.184 -28.887
  539    H    GLN  73           H        GLN  73  19.268  11.487 -25.742
  540    HA   GLN  73           HA       GLN  73  16.351  11.923 -25.349
  541    HB2  GLN  73           HB2      GLN  73  15.866   9.777 -26.041
  542    HB3  GLN  73           HB3      GLN  73  17.145  10.222 -27.150
  543    HG2  GLN  73           HG2      GLN  73  17.248   8.329 -24.782
  544    HG3  GLN  73           HG3      GLN  73  17.549   7.971 -26.472
  545   HE21  GLN  73          HE22      GLN  73  19.124   8.209 -23.596
  546   HE22  GLN  73          HE21      GLN  73  20.698   8.767 -24.195
  547    H    ASN  74           H        ASN  74  15.486  10.265 -23.608
  548    HA   ASN  74           HA       ASN  74  16.576  10.947 -21.134
  549    HB2  ASN  74           HB2      ASN  74  14.297  10.003 -21.443
  550    HB3  ASN  74           HB3      ASN  74  15.010   8.407 -21.712
  551   HD21  ASN  74          HD22      ASN  74  13.603   7.828 -19.753
  552   HD22  ASN  74          HD21      ASN  74  14.279   8.198 -18.161
  553    H    ASP  75           H        ASP  75  18.228  10.484 -20.064
  554    HA   ASP  75           HA       ASP  75  19.269   7.836 -19.560
  555    HB2  ASP  75           HB2      ASP  75  20.582   8.563 -21.603
  556    HB3  ASP  75           HB3      ASP  75  21.130   9.979 -20.710
  557    H    TRP  76           H        TRP  76  17.756   9.961 -18.263
  558    HA   TRP  76           HA       TRP  76  19.675  11.293 -16.403
  559    HB2  TRP  76           HB2      TRP  76  16.870  12.065 -17.245
  560    HB3  TRP  76           HB3      TRP  76  17.950  13.039 -16.278
  561    HD1  TRP  76           HD1      TRP  76  20.391  12.201 -18.588
  562    HE1  TRP  76           HE1      TRP  76  20.446  13.571 -20.739
  563    HE3  TRP  76           HE3      TRP  76  15.785  14.427 -18.253
  564    HZ2  TRP  76           HZ2      TRP  76  18.709  15.327 -22.186
  565    HZ3  TRP  76           HZ3      TRP  76  14.997  15.908 -20.081
  566    HH2  TRP  76           HH2      TRP  76  16.439  16.367 -22.050
  567    H    ASP  77           H        ASP  77  17.291   8.844 -16.274
  568    HA   ASP  77           HA       ASP  77  16.995   9.224 -13.336
  569    HB2  ASP  77           HB2      ASP  77  14.732   9.235 -13.353
  570    HB3  ASP  77           HB3      ASP  77  15.006  10.087 -14.860
  571    H    GLU  78           H        GLU  78  15.977   7.300 -12.259
  572    HA   GLU  78           HA       GLU  78  16.361   4.697 -13.640
  573    HB2  GLU  78           HB2      GLU  78  17.651   3.766 -11.862
  574    HB3  GLU  78           HB3      GLU  78  18.435   5.272 -12.335
  575    HG2  GLU  78           HG2      GLU  78  17.204   6.404 -10.407
  576    HG3  GLU  78           HG3      GLU  78  16.682   4.809  -9.875
  577    H    GLU  79           H        GLU  79  14.113   6.553 -12.205
  578    HA   GLU  79           HA       GLU  79  12.534   4.363 -11.088
  579    HB2  GLU  79           HB2      GLU  79  14.314   5.174  -9.310
  580    HB3  GLU  79           HB3      GLU  79  13.297   6.591  -9.161
  581    HG2  GLU  79           HG2      GLU  79  12.792   5.050  -7.399
  582    HG3  GLU  79           HG3      GLU  79  11.397   5.080  -8.452
  583    H    LEU  80           H        LEU  80  12.371   6.808 -13.077
  584    HA   LEU  80           HA       LEU  80   9.933   8.100 -11.906
  585    HB2  LEU  80           HB2      LEU  80  12.280   9.233 -13.462
  586    HB3  LEU  80           HB3      LEU  80  10.748  10.055 -13.411
  587    HG   LEU  80           HG       LEU  80  12.357  11.002 -11.858
  588   HD11  LEU  80          HD11      LEU  80  10.865  11.094  -9.891
  589   HD12  LEU  80          HD12      LEU  80   9.908  11.150 -11.386
  590   HD13  LEU  80          HD13      LEU  80  10.008   9.658 -10.431
  591   HD21  LEU  80          HD21      LEU  80  13.536   8.910 -11.151
  592   HD22  LEU  80          HD22      LEU  80  13.077  10.059  -9.874
  593   HD23  LEU  80          HD23      LEU  80  12.145   8.589 -10.073
  594    H    SER  81           H        SER  81   8.367   8.861 -13.227
  595    HA   SER  81           HA       SER  81   8.294   8.092 -16.106
  596    HB2  SER  81           HB2      SER  81   6.981   6.444 -14.761
  597    HB3  SER  81           HB3      SER  81   6.003   7.782 -14.119
  598    HG   SER  81           HG       SER  81   5.066   6.749 -15.974
  599    H    ILE  82           H        ILE  82   7.208   9.636 -17.397
  600    HA   ILE  82           HA       ILE  82   6.826  12.288 -16.076
  601    HB   ILE  82           HB       ILE  82   8.460  11.380 -18.395
  602   HG12  ILE  82          HG12      ILE  82   9.928  13.207 -17.720
  603   HG13  ILE  82          HG13      ILE  82   8.724  13.817 -16.593
  604   HG21  ILE  82          HG21      ILE  82   6.913  12.752 -19.662
  605   HG22  ILE  82          HG22      ILE  82   7.087  14.093 -18.499
  606   HG23  ILE  82          HG23      ILE  82   8.460  13.580 -19.492
  607   HD11  ILE  82          HD11      ILE  82  10.676  12.559 -15.581
  608   HD12  ILE  82          HD12      ILE  82   9.085  11.981 -15.085
  609   HD13  ILE  82          HD13      ILE  82  10.020  11.075 -16.299
  610    H    HIS  83           H        HIS  83   5.302  13.665 -16.775
  611    HA   HIS  83           HA       HIS  83   3.398  12.889 -18.922
  612    HB2  HIS  83           HB2      HIS  83   2.582  13.824 -16.137
  613    HB3  HIS  83           HB3      HIS  83   1.493  13.556 -17.491
  614    HD1  HIS  83           HD1      HIS  83   0.867  10.978 -18.029
  615    HD2  HIS  83           HD2      HIS  83   3.531  11.637 -14.838
  616    HE1  HIS  83           HE1      HIS  83   1.047   8.765 -16.779
  617    H    LEU  84           H        LEU  84   2.092  14.794 -19.617
  618    HA   LEU  84           HA       LEU  84   3.368  17.448 -19.085
  619    HB2  LEU  84           HB2      LEU  84   2.444  16.363 -21.774
  620    HB3  LEU  84           HB3      LEU  84   2.983  18.007 -21.466
  621    HG   LEU  84           HG       LEU  84   4.709  15.502 -21.399
  622   HD11  LEU  84          HD11      LEU  84   4.072  16.271 -23.643
  623   HD12  LEU  84          HD12      LEU  84   4.577  17.933 -23.245
  624   HD13  LEU  84          HD13      LEU  84   5.777  16.641 -23.339
  625   HD21  LEU  84          HD21      LEU  84   6.622  17.094 -21.180
  626   HD22  LEU  84          HD22      LEU  84   5.462  18.409 -20.879
  627   HD23  LEU  84          HD23      LEU  84   5.605  17.053 -19.742
  628    H    GLN  85           H        GLN  85   2.021  19.266 -19.421
  629    HA   GLN  85           HA       GLN  85  -0.803  18.924 -20.155
  630    HB2  GLN  85           HB2      GLN  85  -0.265  20.565 -17.668
  631    HB3  GLN  85           HB3      GLN  85  -1.770  19.993 -18.313
  632    HG2  GLN  85           HG2      GLN  85  -1.393  18.859 -16.290
  633    HG3  GLN  85           HG3      GLN  85  -1.191  17.672 -17.571
  634   HE21  GLN  85          HE22      GLN  85   1.276  20.111 -16.348
  635   HE22  GLN  85          HE21      GLN  85   2.335  18.843 -15.752
  636    HA   PRO  86           HA       PRO  86  -2.459  20.268 -20.941
  637    HB2  PRO  86           HB2      PRO  86  -3.309  21.738 -23.045
  638    HB3  PRO  86           HB3      PRO  86  -3.282  22.408 -21.387
  639    HG2  PRO  86           HG2      PRO  86  -1.190  22.762 -23.563
  640    HG3  PRO  86           HG3      PRO  86  -1.982  24.034 -22.576
  641    HD2  PRO  86           HD2      PRO  86   0.459  22.965 -21.927
  642    HD3  PRO  86           HD3      PRO  86  -0.707  23.487 -20.679
  643    H    PHE  87           H        PHE  87   0.438  20.415 -22.774
  644    HA   PHE  87           HA       PHE  87  -0.231  18.805 -25.064
  645    HB2  PHE  87           HB2      PHE  87   2.327  19.446 -23.550
  646    HB3  PHE  87           HB3      PHE  87   2.320  18.346 -24.911
  647    HD1  PHE  87           HD2      PHE  87   1.424  19.100 -27.169
  648    HD2  PHE  87           HD1      PHE  87   2.411  21.832 -23.980
  649    HE1  PHE  87           HE2      PHE  87   1.698  20.931 -28.821
  650    HE2  PHE  87           HE1      PHE  87   2.691  23.661 -25.635
  651    HZ   PHE  87           HZ       PHE  87   2.372  23.195 -28.066
  652    H    LYS  88           H        LYS  88   1.142  16.628 -25.222
  653    HA   LYS  88           HA       LYS  88   0.241  14.839 -23.021
  654    HB2  LYS  88           HB2      LYS  88  -0.799  13.343 -24.757
  655    HB3  LYS  88           HB3      LYS  88  -1.599  14.860 -24.420
  656    HG2  LYS  88           HG2      LYS  88  -1.829  14.617 -26.697
  657    HG3  LYS  88           HG3      LYS  88  -0.561  15.818 -26.548
  658    HD2  LYS  88           HD2      LYS  88   1.137  14.033 -27.095
  659    HD3  LYS  88           HD3      LYS  88  -0.173  12.853 -27.128
  660    HE2  LYS  88           HE2      LYS  88   0.366  13.400 -29.374
  661    HE3  LYS  88           HE3      LYS  88  -1.209  14.115 -29.026
  662    HZ1  LYS  88           HZ1      LYS  88   0.324  15.630 -30.219
  663    HZ2  LYS  88           HZ2      LYS  88  -0.118  16.270 -28.789
  664    HZ3  LYS  88           HZ3      LYS  88   1.377  15.616 -28.968
  665    HA   PRO  89           HA       PRO  89   3.945  12.522 -24.130
  666    HB2  PRO  89           HB2      PRO  89   3.667  10.355 -22.514
  667    HB3  PRO  89           HB3      PRO  89   4.044  11.982 -21.876
  668    HG2  PRO  89           HG2      PRO  89   1.364  10.574 -21.954
  669    HG3  PRO  89           HG3      PRO  89   2.093  11.511 -20.619
  670    HD2  PRO  89           HD2      PRO  89   0.244  12.530 -22.431
  671    HD3  PRO  89           HD3      PRO  89   1.444  13.530 -21.562
  672    H    ASP  90           H        ASP  90   3.824  11.769 -26.229
  673    HA   ASP  90           HA       ASP  90   2.704   9.154 -26.737
  674    HB2  ASP  90           HB2      ASP  90   0.672  10.650 -27.007
  675    HB3  ASP  90           HB3      ASP  90   1.527  11.481 -28.312
  676    H    ASP  91           H        ASP  91   3.184   8.373 -28.878
  677    HA   ASP  91           HA       ASP  91   5.848   9.056 -29.768
  678    HB2  ASP  91           HB2      ASP  91   4.928   6.757 -29.437
  679    HB3  ASP  91           HB3      ASP  91   3.861   7.012 -30.816
  680    H    SER  92           H        SER  92   4.208  11.268 -30.298
  681    HA   SER  92           HA       SER  92   2.960  11.417 -32.832
  682    HB2  SER  92           HB2      SER  92   4.252  13.633 -31.197
  683    HB3  SER  92           HB3      SER  92   3.058  13.857 -32.487
  684    HG   SER  92           HG       SER  92   1.602  12.578 -31.226
  685    H    ASN  93           H        ASN  93   3.515  12.564 -34.750
  686    HA   ASN  93           HA       ASN  93   6.104  11.999 -35.850
  687    HB2  ASN  93           HB2      ASN  93   3.900  11.982 -37.053
  688    HB3  ASN  93           HB3      ASN  93   3.827  13.741 -36.907
  689   HD21  ASN  93          HD22      ASN  93   5.850  11.080 -38.257
  690   HD22  ASN  93          HD21      ASN  93   6.426  12.042 -39.601
  691    H    GLN  94           H        GLN  94   5.493  14.380 -33.707
  692    HA   GLN  94           HA       GLN  94   7.620  16.211 -34.615
  693    HB2  GLN  94           HB2      GLN  94   6.182  18.172 -34.191
  694    HB3  GLN  94           HB3      GLN  94   5.498  17.190 -35.470
  695    HG2  GLN  94           HG2      GLN  94   3.715  16.430 -34.093
  696    HG3  GLN  94           HG3      GLN  94   4.547  16.844 -32.596
  697   HE21  GLN  94          HE22      GLN  94   4.674  19.040 -31.878
  698   HE22  GLN  94          HE21      GLN  94   3.553  20.229 -32.542
  699    HA   PRO  95           HA       PRO  95   8.347  16.324 -30.156
  700    HB2  PRO  95           HB2      PRO  95   9.043  18.941 -29.666
  701    HB3  PRO  95           HB3      PRO  95  10.130  17.746 -30.446
  702    HG2  PRO  95           HG2      PRO  95   8.341  19.798 -31.784
  703    HG3  PRO  95           HG3      PRO  95  10.082  19.472 -32.094
  704    HD2  PRO  95           HD2      PRO  95   8.170  18.408 -33.648
  705    HD3  PRO  95           HD3      PRO  95   9.581  17.425 -33.183
  706    H    GLN  96           H        GLN  96   7.406  17.072 -28.176
  707    HA   GLN  96           HA       GLN  96   4.621  18.122 -28.422
  708    HB2  GLN  96           HB2      GLN  96   5.986  17.023 -25.950
  709    HB3  GLN  96           HB3      GLN  96   4.265  17.250 -26.210
  710    HG2  GLN  96           HG2      GLN  96   6.016  15.165 -27.591
  711    HG3  GLN  96           HG3      GLN  96   4.965  14.884 -26.220
  712   HE21  GLN  96          HE22      GLN  96   4.482  13.153 -28.142
  713   HE22  GLN  96          HE21      GLN  96   3.163  13.639 -29.179
  714    H    VAL  97           H        VAL  97   7.785  19.186 -27.472
  715    HA   VAL  97           HA       VAL  97   6.672  21.792 -26.452
  716    HB   VAL  97           HB       VAL  97   9.131  20.257 -25.493
  717   HG11  VAL  97          HG11      VAL  97   9.573  22.680 -25.410
  718   HG12  VAL  97          HG12      VAL  97   8.038  22.940 -24.546
  719   HG13  VAL  97          HG13      VAL  97   9.360  22.029 -23.790
  720   HG21  VAL  97          HG21      VAL  97   7.058  19.301 -24.559
  721   HG22  VAL  97          HG22      VAL  97   7.969  20.154 -23.320
  722   HG23  VAL  97          HG23      VAL  97   6.535  20.919 -24.041
  723    H    VAL  98           H        VAL  98   7.648  23.648 -27.361
  724    HA   VAL  98           HA       VAL  98   9.950  23.198 -29.227
  725    HB   VAL  98           HB       VAL  98   7.339  24.561 -29.926
  726   HG11  VAL  98          HG11      VAL  98   9.898  24.458 -31.558
  727   HG12  VAL  98          HG12      VAL  98   8.311  24.973 -32.158
  728   HG13  VAL  98          HG13      VAL  98   9.107  25.921 -30.911
  729   HG21  VAL  98          HG21      VAL  98   7.313  22.900 -31.768
  730   HG22  VAL  98          HG22      VAL  98   8.802  22.175 -31.124
  731   HG23  VAL  98          HG23      VAL  98   7.290  22.114 -30.192
  732    H    ILE  99           H        ILE  99  11.271  24.858 -29.644
  733    HA   ILE  99           HA       ILE  99  11.394  27.111 -27.691
  734    HB   ILE  99           HB       ILE  99  13.637  25.306 -28.727
  735   HG12  ILE  99          HG12      ILE  99  13.901  25.016 -26.112
  736   HG13  ILE  99          HG13      ILE  99  12.198  25.449 -26.073
  737   HG21  ILE  99          HG21      ILE  99  14.402  27.647 -28.418
  738   HG22  ILE  99          HG22      ILE  99  13.738  27.650 -26.769
  739   HG23  ILE  99          HG23      ILE  99  15.080  26.570 -27.220
  740   HD11  ILE  99          HD11      ILE  99  13.426  23.096 -27.567
  741   HD12  ILE  99          HD12      ILE  99  12.547  23.055 -26.021
  742   HD13  ILE  99          HD13      ILE  99  11.687  23.465 -27.492
  743    H    LEU 100           H        LEU 100  11.367  28.956 -28.658
  744    HA   LEU 100           HA       LEU 100  11.647  29.395 -31.506
  745    HB2  LEU 100           HB2      LEU 100  11.326  31.164 -29.061
  746    HB3  LEU 100           HB3      LEU 100  11.464  31.839 -30.656
  747    HG   LEU 100           HG       LEU 100   9.171  31.755 -29.779
  748   HD11  LEU 100          HD11      LEU 100   9.657  31.909 -32.206
  749   HD12  LEU 100          HD12      LEU 100   9.584  30.135 -32.331
  750   HD13  LEU 100          HD13      LEU 100   8.137  31.062 -31.889
  751   HD21  LEU 100          HD21      LEU 100   9.194  28.759 -30.288
  752   HD22  LEU 100          HD22      LEU 100   9.114  29.537 -28.687
  753   HD23  LEU 100          HD23      LEU 100   7.806  29.766 -29.849
  754    H    ALA 101           H        ALA 101  13.029  30.973 -32.421
  755    HA   ALA 101           HA       ALA 101  15.785  30.419 -32.043
  756    HB1  ALA 101           HB1      ALA 101  16.082  32.016 -33.899
  757    HB2  ALA 101           HB2      ALA 101  14.731  30.912 -34.208
  758    HB3  ALA 101           HB3      ALA 101  14.414  32.588 -33.680
  759    H    ASP 102           H        ASP 102  13.965  32.663 -30.264
  760    HA   ASP 102           HA       ASP 102  16.432  34.094 -29.391
  761    HB2  ASP 102           HB2      ASP 102  15.191  36.043 -29.072
  762    HB3  ASP 102           HB3      ASP 102  14.697  35.450 -30.652
  763    H    GLY 103           H        GLY 103  14.766  31.560 -28.428
  764    HA2  GLY 103           HA2      GLY 103  15.038  30.501 -26.384
  765    HA3  GLY 103           HA3      GLY 103  15.442  32.025 -25.603
  766    H    GLN 104           H        GLN 104  12.427  32.171 -27.325
  767    HA   GLN 104           HA       GLN 104  10.837  32.065 -24.841
  768    HB2  GLN 104           HB2      GLN 104  10.053  32.450 -27.760
  769    HB3  GLN 104           HB3      GLN 104   8.946  32.513 -26.392
  770    HG2  GLN 104           HG2      GLN 104  10.053  34.506 -25.518
  771    HG3  GLN 104           HG3      GLN 104  11.306  34.405 -26.765
  772   HE21  GLN 104          HE22      GLN 104  10.784  34.888 -28.955
  773   HE22  GLN 104          HE21      GLN 104   9.285  35.739 -29.371
  774    H    ILE 105           H        ILE 105   9.197  30.472 -24.610
  775    HA   ILE 105           HA       ILE 105   9.671  27.892 -26.064
  776    HB   ILE 105           HB       ILE 105   9.137  28.002 -23.099
  777   HG12  ILE 105          HG12      ILE 105  11.206  29.293 -23.305
  778   HG13  ILE 105          HG13      ILE 105  11.429  27.775 -22.468
  779   HG21  ILE 105          HG21      ILE 105  10.343  25.954 -24.985
  780   HG22  ILE 105          HG22      ILE 105  10.307  25.755 -23.220
  781   HG23  ILE 105          HG23      ILE 105   8.792  25.850 -24.134
  782   HD11  ILE 105          HD11      ILE 105  12.604  26.834 -24.342
  783   HD12  ILE 105          HD12      ILE 105  12.160  28.227 -25.367
  784   HD13  ILE 105          HD13      ILE 105  13.270  28.443 -24.014
  785    H    THR 106           H        THR 106   7.821  26.595 -26.364
  786    HA   THR 106           HA       THR 106   5.235  27.709 -26.469
  787    HB   THR 106           HB       THR 106   4.546  25.212 -26.375
  788    HG1  THR 106           HG1      THR 106   6.433  24.584 -25.247
  789   HG21  THR 106          HG21      THR 106   6.601  26.125 -28.403
  790   HG22  THR 106          HG22      THR 106   5.463  24.759 -28.589
  791   HG23  THR 106          HG23      THR 106   4.849  26.419 -28.474
  792    HA   PRO 107           HA       PRO 107   4.434  27.849 -21.983
  793    HB2  PRO 107           HB2      PRO 107   1.590  28.193 -22.936
  794    HB3  PRO 107           HB3      PRO 107   2.475  29.079 -21.657
  795    HG2  PRO 107           HG2      PRO 107   2.117  30.185 -24.108
  796    HG3  PRO 107           HG3      PRO 107   3.694  30.337 -23.271
  797    HD2  PRO 107           HD2      PRO 107   2.914  28.415 -25.475
  798    HD3  PRO 107           HD3      PRO 107   4.414  29.374 -25.281
  799    H    PHE 108           H        PHE 108   4.542  25.954 -20.916
  800    HA   PHE 108           HA       PHE 108   2.384  23.983 -21.002
  801    HB2  PHE 108           HB2      PHE 108   3.535  22.199 -21.868
  802    HB3  PHE 108           HB3      PHE 108   4.098  23.478 -22.917
  803    HD1  PHE 108           HD1      PHE 108   6.382  24.693 -21.958
  804    HD2  PHE 108           HD2      PHE 108   5.108  20.698 -21.000
  805    HE1  PHE 108           HE1      PHE 108   8.718  24.061 -21.568
  806    HE2  PHE 108           HE2      PHE 108   7.466  20.070 -20.570
  807    HZ   PHE 108           HZ       PHE 108   9.281  21.739 -20.843
  808    H    SER 109           H        SER 109   3.067  22.012 -19.659
  809    HA   SER 109           HA       SER 109   4.972  22.586 -17.531
  810    HB2  SER 109           HB2      SER 109   3.340  21.824 -15.754
  811    HB3  SER 109           HB3      SER 109   3.028  23.416 -16.454
  812    HG   SER 109           HG       SER 109   1.666  21.916 -18.001
  813    H    LEU 110           H        LEU 110   5.652  20.779 -16.426
  814    HA   LEU 110           HA       LEU 110   5.362  18.130 -17.780
  815    HB2  LEU 110           HB2      LEU 110   7.238  18.826 -18.837
  816    HB3  LEU 110           HB3      LEU 110   7.611  20.070 -17.658
  817    HG   LEU 110           HG       LEU 110   8.662  18.407 -16.183
  818   HD11  LEU 110          HD11      LEU 110   7.501  16.304 -16.940
  819   HD12  LEU 110          HD12      LEU 110   8.213  16.503 -18.550
  820   HD13  LEU 110          HD13      LEU 110   9.247  16.168 -17.148
  821   HD21  LEU 110          HD21      LEU 110  10.654  18.086 -17.576
  822   HD22  LEU 110          HD22      LEU 110   9.710  18.445 -19.038
  823   HD23  LEU 110          HD23      LEU 110   9.965  19.699 -17.807
  824    H    LEU 111           H        LEU 111   4.941  16.586 -16.328
  825    HA   LEU 111           HA       LEU 111   5.519  17.071 -13.437
  826    HB2  LEU 111           HB2      LEU 111   3.185  17.181 -14.040
  827    HB3  LEU 111           HB3      LEU 111   3.243  15.632 -14.862
  828    HG   LEU 111           HG       LEU 111   4.018  15.763 -11.953
  829   HD11  LEU 111          HD11      LEU 111   1.658  15.489 -11.281
  830   HD12  LEU 111          HD12      LEU 111   1.948  17.048 -12.064
  831   HD13  LEU 111          HD13      LEU 111   1.147  15.742 -12.969
  832   HD21  LEU 111          HD21      LEU 111   3.033  13.525 -11.869
  833   HD22  LEU 111          HD22      LEU 111   2.383  13.698 -13.511
  834   HD23  LEU 111          HD23      LEU 111   4.126  13.562 -13.246
  835    H    MET 112           H        MET 112   6.368  15.436 -12.200
  836    HA   MET 112           HA       MET 112   7.382  12.999 -13.615
  837    HB2  MET 112           HB2      MET 112   8.855  14.654 -11.523
  838    HB3  MET 112           HB3      MET 112   9.437  13.195 -12.336
  839    HG2  MET 112           HG2      MET 112   9.193  14.458 -14.530
  840    HG3  MET 112           HG3      MET 112   8.927  15.917 -13.576
  841    HE1  MET 112           HE1      MET 112  11.204  15.570 -15.834
  842    HE2  MET 112           HE2      MET 112  10.871  17.063 -14.921
  843    HE3  MET 112           HE3      MET 112  12.529  16.431 -15.024
  844    H    ALA 113           H        ALA 113   6.922  11.146 -12.670
  845    HA   ALA 113           HA       ALA 113   5.813  11.085  -9.905
  846    HB1  ALA 113           HB1      ALA 113   4.117   9.531 -10.783
  847    HB2  ALA 113           HB2      ALA 113   4.042  11.106 -11.595
  848    HB3  ALA 113           HB3      ALA 113   4.790   9.718 -12.418
  849    H    ASN 114           H        ASN 114   6.270   9.400  -8.634
  850    HA   ASN 114           HA       ASN 114   8.612   7.858  -8.928
  851    HB2  ASN 114           HB2      ASN 114   7.486   8.576  -6.831
  852    HB3  ASN 114           HB3      ASN 114   6.164   7.467  -7.130
  853   HD21  ASN 114          HD22      ASN 114   7.598   7.425  -4.771
  854   HD22  ASN 114          HD21      ASN 114   8.595   5.986  -4.697
  855    H    ALA 115           H        ALA 115   8.907   6.264 -10.436
  856    HA   ALA 115           HA       ALA 115   6.812   4.889 -11.778
  857    HB1  ALA 115           HB1      ALA 115   9.081   5.254 -12.689
  858    HB2  ALA 115           HB2      ALA 115   9.740   4.101 -11.500
  859    HB3  ALA 115           HB3      ALA 115   8.613   3.547 -12.753
  860    H    GLY 116           H        GLY 116   8.177   4.175  -8.647
  861    HA2  GLY 116           HA2      GLY 116   7.350   1.353  -8.588
  862    HA3  GLY 116           HA3      GLY 116   8.002   2.322  -7.266
  863    H    THR 117           H        THR 117   5.741   4.391  -8.054
  864    HA   THR 117           HA       THR 117   3.586   3.079  -6.400
  865    HB   THR 117           HB       THR 117   4.641   5.909  -6.069
  866    HG1  THR 117           HG1      THR 117   6.161   4.412  -5.382
  867   HG21  THR 117          HG21      THR 117   3.480   5.829  -3.896
  868   HG22  THR 117          HG22      THR 117   2.332   5.682  -5.224
  869   HG23  THR 117          HG23      THR 117   2.804   4.234  -4.305
  870    H    GLY 118           H        GLY 118   4.297   5.357  -9.033
  871    HA2  GLY 118           HA2      GLY 118   2.892   6.273 -10.614
  872    HA3  GLY 118           HA3      GLY 118   1.504   5.453  -9.890
  873    H    GLU 119           H        GLU 119   3.792   7.721  -8.282
  874    HA   GLU 119           HA       GLU 119   1.543   9.585  -7.711
  875    HB2  GLU 119           HB2      GLU 119   1.866   8.024  -5.891
  876    HB3  GLU 119           HB3      GLU 119   3.597   8.393  -5.816
  877    HG2  GLU 119           HG2      GLU 119   3.130  10.684  -5.171
  878    HG3  GLU 119           HG3      GLU 119   1.396  10.448  -5.414
  879    HA   PRO 120           HA       PRO 120   4.504  12.616  -9.266
  880    HB2  PRO 120           HB2      PRO 120   2.883  14.503  -7.587
  881    HB3  PRO 120           HB3      PRO 120   3.425  14.681  -9.283
  882    HG2  PRO 120           HG2      PRO 120   0.864  13.984  -8.694
  883    HG3  PRO 120           HG3      PRO 120   1.727  13.184 -10.044
  884    HD2  PRO 120           HD2      PRO 120   1.251  12.148  -7.254
  885    HD3  PRO 120           HD3      PRO 120   1.145  11.302  -8.830
  886    H    LEU 121           H        LEU 121   6.338  13.658  -8.593
  887    HA   LEU 121           HA       LEU 121   6.845  14.088  -5.645
  888    HB2  LEU 121           HB2      LEU 121   9.080  13.952  -7.694
  889    HB3  LEU 121           HB3      LEU 121   9.157  13.820  -5.964
  890    HG   LEU 121           HG       LEU 121   9.784  11.751  -6.941
  891   HD11  LEU 121          HD11      LEU 121   8.412  10.230  -5.781
  892   HD12  LEU 121          HD12      LEU 121   8.336  11.728  -4.861
  893   HD13  LEU 121          HD13      LEU 121   6.976  11.278  -5.915
  894   HD21  LEU 121          HD21      LEU 121   8.590  12.222  -9.088
  895   HD22  LEU 121          HD22      LEU 121   8.725  10.544  -8.512
  896   HD23  LEU 121          HD23      LEU 121   7.190  11.416  -8.324
  897    H    LEU 122           H        LEU 122   7.186  15.291  -8.929
  898    HA   LEU 122           HA       LEU 122   7.731  18.101  -8.092
  899    HB2  LEU 122           HB2      LEU 122   9.898  16.911  -8.238
  900    HB3  LEU 122           HB3      LEU 122   9.415  16.145  -9.738
  901    HG   LEU 122           HG       LEU 122   9.470  18.428 -10.851
  902   HD11  LEU 122          HD11      LEU 122   9.233  19.834  -8.798
  903   HD12  LEU 122          HD12      LEU 122  10.811  19.260  -8.236
  904   HD13  LEU 122          HD13      LEU 122  10.676  20.228  -9.724
  905   HD21  LEU 122          HD21      LEU 122  11.972  17.385  -9.502
  906   HD22  LEU 122          HD22      LEU 122  11.316  16.892 -11.076
  907   HD23  LEU 122          HD23      LEU 122  11.949  18.525 -10.868
  908    H    THR 123           H        THR 123   7.211  19.586  -9.675
  909    HA   THR 123           HA       THR 123   6.549  18.691 -12.402
  910    HB   THR 123           HB       THR 123   4.605  20.355 -10.753
  911    HG1  THR 123           HG1      THR 123   4.939  17.712 -11.007
  912   HG21  THR 123          HG21      THR 123   4.279  19.206 -13.537
  913   HG22  THR 123          HG22      THR 123   3.030  20.021 -12.584
  914   HG23  THR 123          HG23      THR 123   4.438  20.938 -13.140
  915    H    LEU 124           H        LEU 124   6.819  20.292 -13.919
  916    HA   LEU 124           HA       LEU 124   8.204  22.805 -13.101
  917    HB2  LEU 124           HB2      LEU 124   8.728  20.788 -15.307
  918    HB3  LEU 124           HB3      LEU 124   9.098  22.483 -15.568
  919    HG   LEU 124           HG       LEU 124  10.612  22.517 -13.635
  920   HD11  LEU 124          HD11      LEU 124  11.410  20.324 -12.718
  921   HD12  LEU 124          HD12      LEU 124   9.776  20.726 -12.225
  922   HD13  LEU 124          HD13      LEU 124  10.038  19.522 -13.512
  923   HD21  LEU 124          HD21      LEU 124  11.230  20.300 -15.633
  924   HD22  LEU 124          HD22      LEU 124  11.378  22.041 -15.964
  925   HD23  LEU 124          HD23      LEU 124  12.404  21.296 -14.741
  926    H    VAL 125           H        VAL 125   7.599  24.633 -14.189
  927    HA   VAL 125           HA       VAL 125   5.298  24.506 -16.096
  928    HB   VAL 125           HB       VAL 125   5.404  26.341 -13.669
  929   HG11  VAL 125          HG11      VAL 125   4.079  27.299 -15.501
  930   HG12  VAL 125          HG12      VAL 125   3.192  25.767 -15.698
  931   HG13  VAL 125          HG13      VAL 125   3.002  26.742 -14.227
  932   HG21  VAL 125          HG21      VAL 125   3.757  23.801 -14.076
  933   HG22  VAL 125          HG22      VAL 125   5.001  24.075 -12.837
  934   HG23  VAL 125          HG23      VAL 125   3.500  24.988 -12.779
  935    H    CYS 126           H        CYS 126   5.167  26.031 -17.639
  936    HA   CYS 126           HA       CYS 126   7.404  28.000 -17.877
  937    HB2  CYS 126           HB2      CYS 126   7.341  25.969 -19.451
  938    HB3  CYS 126           HB3      CYS 126   5.840  26.616 -20.093
  939    HG   CYS 126           HG       CYS 126   7.762  27.204 -21.737
  940    H    SER 127           H        SER 127   6.779  30.073 -17.759
  941    HA   SER 127           HA       SER 127   4.080  31.046 -18.261
  942    HB2  SER 127           HB2      SER 127   5.194  33.258 -17.940
  943    HB3  SER 127           HB3      SER 127   5.514  32.116 -16.621
  944    HG   SER 127           HG       SER 127   7.424  33.177 -17.348
  945    H    GLY 128           H        GLY 128   6.678  30.236 -20.328
  946    HA2  GLY 128           HA2      GLY 128   6.059  30.484 -22.789
  947    HA3  GLY 128           HA3      GLY 128   5.938  32.213 -22.457
  948    H    SER 129           H        SER 129   8.500  30.971 -20.584
  949    HA   SER 129           HA       SER 129  10.569  31.263 -22.660
  950    HB2  SER 129           HB2      SER 129   9.853  33.582 -21.918
  951    HB3  SER 129           HB3      SER 129  10.512  33.183 -20.317
  952    HG   SER 129           HG       SER 129  12.037  34.223 -21.716
  953    H    TRP 130           H        TRP 130  12.686  30.936 -21.889
  954    HA   TRP 130           HA       TRP 130  13.355  28.792 -20.244
  955    HB2  TRP 130           HB2      TRP 130  14.766  29.733 -21.938
  956    HB3  TRP 130           HB3      TRP 130  14.734  31.320 -21.203
  957    HD1  TRP 130           HD1      TRP 130  16.664  31.996 -19.747
  958    HE1  TRP 130           HE1      TRP 130  18.750  30.862 -18.779
  959    HE3  TRP 130           HE3      TRP 130  15.543  27.138 -20.910
  960    HZ2  TRP 130           HZ2      TRP 130  19.800  28.170 -18.528
  961    HZ3  TRP 130           HZ3      TRP 130  17.076  25.316 -20.234
  962    HH2  TRP 130           HH2      TRP 130  19.181  25.817 -19.028
  963    HA   PRO 131           HA       PRO 131  14.440  27.773 -18.801
  964    HB2  PRO 131           HB2      PRO 131  15.742  27.045 -16.599
  965    HB3  PRO 131           HB3      PRO 131  16.331  28.475 -17.478
  966    HG2  PRO 131           HG2      PRO 131  14.547  28.420 -15.048
  967    HG3  PRO 131           HG3      PRO 131  16.044  29.368 -15.316
  968    HD2  PRO 131           HD2      PRO 131  13.443  30.320 -15.832
  969    HD3  PRO 131           HD3      PRO 131  14.928  30.948 -16.599
  970    H    LEU 132           H        LEU 132  11.743  28.603 -17.333
  971    HA   LEU 132           HA       LEU 132   9.894  27.636 -16.475
  972    HB2  LEU 132           HB2      LEU 132  11.322  24.937 -16.667
  973    HB3  LEU 132           HB3      LEU 132   9.765  25.176 -15.947
  974    HG   LEU 132           HG       LEU 132   9.018  26.259 -18.127
  975   HD11  LEU 132          HD11      LEU 132  11.142  26.514 -19.302
  976   HD12  LEU 132          HD12      LEU 132  11.457  24.768 -19.168
  977   HD13  LEU 132          HD13      LEU 132  10.117  25.375 -20.169
  978   HD21  LEU 132          HD21      LEU 132   8.278  24.055 -17.279
  979   HD22  LEU 132          HD22      LEU 132   8.416  24.055 -19.022
  980   HD23  LEU 132          HD23      LEU 132   9.688  23.287 -18.050
  981    H    ASP 133           H        ASP 133   9.047  26.591 -14.438
  982    HA   ASP 133           HA       ASP 133  10.919  27.075 -12.133
  983    HB2  ASP 133           HB2      ASP 133   9.379  28.987 -12.582
  984    HB3  ASP 133           HB3      ASP 133   8.002  27.893 -12.397
  985    H    GLN 134           H        GLN 134  10.827  25.647 -10.446
  986    HA   GLN 134           HA       GLN 134   9.374  23.133 -10.825
  987    HB2  GLN 134           HB2      GLN 134  11.357  24.082  -8.700
  988    HB3  GLN 134           HB3      GLN 134  10.627  22.481  -8.751
  989    HG2  GLN 134           HG2      GLN 134  11.632  22.233 -11.095
  990    HG3  GLN 134           HG3      GLN 134  12.614  23.649 -10.720
  991   HE21  GLN 134          HE22      GLN 134  13.123  20.532 -11.000
  992   HE22  GLN 134          HE21      GLN 134  14.150  20.241  -9.610
  993    H    THR 135           H        THR 135   8.048  22.205  -9.362
  994    HA   THR 135           HA       THR 135   7.311  23.473  -6.805
  995    HB   THR 135           HB       THR 135   5.664  24.366  -8.379
  996    HG1  THR 135           HG1      THR 135   4.998  23.924  -6.284
  997   HG21  THR 135          HG21      THR 135   4.793  21.497  -8.852
  998   HG22  THR 135          HG22      THR 135   3.911  22.956  -9.353
  999   HG23  THR 135          HG23      THR 135   5.485  22.611 -10.070
 1000    H    LEU 136           H        LEU 136   6.766  21.932  -5.227
 1001    HA   LEU 136           HA       LEU 136   7.275  19.108  -5.836
 1002    HB2  LEU 136           HB2      LEU 136   6.158  20.499  -3.365
 1003    HB3  LEU 136           HB3      LEU 136   6.477  18.770  -3.477
 1004    HG   LEU 136           HG       LEU 136   8.594  20.956  -3.726
 1005   HD11  LEU 136          HD11      LEU 136   7.666  20.735  -1.449
 1006   HD12  LEU 136          HD12      LEU 136   8.005  18.990  -1.475
 1007   HD13  LEU 136          HD13      LEU 136   9.339  20.164  -1.526
 1008   HD21  LEU 136          HD21      LEU 136   8.847  17.917  -3.631
 1009   HD22  LEU 136          HD22      LEU 136   9.295  18.975  -4.990
 1010   HD23  LEU 136          HD23      LEU 136  10.205  19.061  -3.480
 1011    H    ALA 137           H        ALA 137   5.869  17.625  -6.390
 1012    HA   ALA 137           HA       ALA 137   4.018  16.944  -7.619
 1013    HB1  ALA 137           HB1      ALA 137   2.383  16.102  -5.935
 1014    HB2  ALA 137           HB2      ALA 137   4.065  15.873  -5.415
 1015    HB3  ALA 137           HB3      ALA 137   3.091  17.191  -4.726
 1016    H    ARG 138           H        ARG 138   3.863  19.037  -8.789
 1017    HA   ARG 138           HA       ARG 138   2.803  20.835  -9.663
 1018    HB2  ARG 138           HB2      ARG 138   0.749  20.295 -10.692
 1019    HB3  ARG 138           HB3      ARG 138   1.802  18.906 -10.698
 1020    HG2  ARG 138           HG2      ARG 138   0.517  17.828  -8.927
 1021    HG3  ARG 138           HG3      ARG 138  -0.518  19.271  -8.758
 1022    HD2  ARG 138           HD2      ARG 138  -1.281  19.004 -11.077
 1023    HD3  ARG 138           HD3      ARG 138  -0.173  17.638 -11.300
 1024    HE   ARG 138           HE       ARG 138  -1.983  17.207  -9.073
 1025   HH11  ARG 138          HH11      ARG 138  -1.891  16.981 -12.570
 1026   HH12  ARG 138          HH12      ARG 138  -3.138  15.769 -12.607
 1027   HH21  ARG 138          HH21      ARG 138  -3.568  15.663  -9.209
 1028   HH22  ARG 138          HH22      ARG 138  -4.058  15.054 -10.758
 1029    H    ASP 139           H        ASP 139   2.766  21.178  -6.673
 1030    HA   ASP 139           HA       ASP 139   0.288  22.162  -5.849
 1031    HB2  ASP 139           HB2      ASP 139   2.200  21.645  -4.388
 1032    HB3  ASP 139           HB3      ASP 139   3.039  23.083  -4.966
 1033    H    THR 140           H        THR 140   2.656  23.956  -7.802
 1034    HA   THR 140           HA       THR 140   1.045  26.437  -7.644
 1035    HB   THR 140           HB       THR 140   2.723  27.396  -9.151
 1036    HG1  THR 140           HG1      THR 140   4.447  26.169  -9.793
 1037   HG21  THR 140          HG21      THR 140   4.002  25.891  -6.837
 1038   HG22  THR 140          HG22      THR 140   4.669  27.306  -7.676
 1039   HG23  THR 140          HG23      THR 140   3.174  27.456  -6.736
 1040    H    ARG 141           H        ARG 141   0.738  23.645  -9.552
 1041    HA   ARG 141           HA       ARG 141   0.320  24.799 -12.143
 1042    HB2  ARG 141           HB2      ARG 141   0.907  22.447 -11.737
 1043    HB3  ARG 141           HB3      ARG 141  -0.663  22.170 -10.994
 1044    HG2  ARG 141           HG2      ARG 141  -0.624  21.229 -13.179
 1045    HG3  ARG 141           HG3      ARG 141  -1.797  22.533 -13.148
 1046    HD2  ARG 141           HD2      ARG 141   1.040  22.896 -14.216
 1047    HD3  ARG 141           HD3      ARG 141  -0.286  22.273 -15.210
 1048    HE   ARG 141           HE       ARG 141  -1.099  24.719 -13.946
 1049   HH11  ARG 141          HH11      ARG 141   0.742  23.582 -16.706
 1050   HH12  ARG 141          HH12      ARG 141   0.527  25.093 -17.559
 1051   HH21  ARG 141          HH21      ARG 141  -1.293  26.586 -15.058
 1052   HH22  ARG 141          HH22      ARG 141  -0.598  26.748 -16.642
 1053    HA   PRO 142           HA       PRO 142  -4.489  24.601 -11.003
 1054    HB2  PRO 142           HB2      PRO 142  -4.111  25.855  -8.275
 1055    HB3  PRO 142           HB3      PRO 142  -5.469  24.853  -8.879
 1056    HG2  PRO 142           HG2      PRO 142  -3.540  23.722  -7.363
 1057    HG3  PRO 142           HG3      PRO 142  -4.116  22.873  -8.836
 1058    HD2  PRO 142           HD2      PRO 142  -1.627  24.544  -8.473
 1059    HD3  PRO 142           HD3      PRO 142  -1.823  22.972  -9.303
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1   9.388   5.437   4.106
    2    H2   MET   1           H2       MET   1   8.005   5.977   3.424
    3    H3   MET   1           H3       MET   1   7.971   4.690   4.455
    4    HA   MET   1           HA       MET   1   9.157   4.830   1.767
    5    HB2  MET   1           HB2      MET   1  10.611   3.493   3.233
    6    HB3  MET   1           HB3      MET   1   9.251   2.449   3.662
    7    HG2  MET   1           HG2      MET   1  10.682   1.449   1.930
    8    HG3  MET   1           HG3      MET   1   9.046   1.704   1.340
    9    HE1  MET   1           HE1      MET   1  11.271   0.927  -0.598
   10    HE2  MET   1           HE2      MET   1   9.635   1.367  -1.142
   11    HE3  MET   1           HE3      MET   1  11.057   2.076  -1.935
   12    H    ALA   2           H        ALA   2   7.220   5.420   0.882
   13    HA   ALA   2           HA       ALA   2   4.796   3.879   0.984
   14    HB1  ALA   2           HB1      ALA   2   5.885   5.757  -1.162
   15    HB2  ALA   2           HB2      ALA   2   4.179   5.315  -0.897
   16    HB3  ALA   2           HB3      ALA   2   5.035   6.273   0.312
   17    H    TYR   3           H        TYR   3   3.975   3.255  -1.444
   18    HA   TYR   3           HA       TYR   3   4.995   0.734  -2.099
   19    HB2  TYR   3           HB2      TYR   3   3.430   2.491  -4.002
   20    HB3  TYR   3           HB3      TYR   3   3.413   0.744  -3.887
   21    HD1  TYR   3           HD2      TYR   3   2.455  -0.330  -1.738
   22    HD2  TYR   3           HD1      TYR   3   1.868   3.819  -2.783
   23    HE1  TYR   3           HE2      TYR   3   0.517  -0.211  -0.179
   24    HE2  TYR   3           HE1      TYR   3  -0.068   3.934  -1.219
   25    HH   TYR   3           HH       TYR   3  -1.135   1.107   0.705
   26    H    GLY   4           H        GLY   4   6.538   3.610  -2.919
   27    HA2  GLY   4           HA2      GLY   4   8.462   2.200  -4.585
   28    HA3  GLY   4           HA3      GLY   4   7.711   3.596  -5.378
   29    H    ARG   5           H        ARG   5  10.416   3.410  -4.799
   30    HA   ARG   5           HA       ARG   5  11.301   4.386  -2.303
   31    HB2  ARG   5           HB2      ARG   5  12.537   2.979  -4.000
   32    HB3  ARG   5           HB3      ARG   5  12.739   4.425  -4.977
   33    HG2  ARG   5           HG2      ARG   5  14.776   4.064  -3.841
   34    HG3  ARG   5           HG3      ARG   5  14.037   5.455  -3.061
   35    HD2  ARG   5           HD2      ARG   5  13.278   4.008  -1.192
   36    HD3  ARG   5           HD3      ARG   5  14.021   2.610  -1.972
   37    HE   ARG   5           HE       ARG   5  15.402   4.873  -0.618
   38   HH11  ARG   5          HH12      ARG   5  15.962   1.983  -2.550
   39   HH12  ARG   5          HH11      ARG   5  17.663   2.024  -2.187
   40   HH21  ARG   5          HH22      ARG   5  17.409   4.885  -0.262
   41   HH22  ARG   5          HH21      ARG   5  18.499   3.642  -0.881
   42    H    GLU   6           H        GLU   6   9.714   6.218  -2.183
   43    HA   GLU   6           HA       GLU   6  10.093   8.767  -3.251
   44    HB2  GLU   6           HB2      GLU   6   9.093   9.626  -1.254
   45    HB3  GLU   6           HB3      GLU   6   8.334   8.087  -1.660
   46    HG2  GLU   6           HG2      GLU   6   9.905   6.996   0.047
   47    HG3  GLU   6           HG3      GLU   6  10.356   8.624   0.556
   48    H    ASP   7           H        ASP   7  12.044   7.227  -0.753
   49    HA   ASP   7           HA       ASP   7  13.826   9.245   0.003
   50    HB2  ASP   7           HB2      ASP   7  13.533   7.174   1.184
   51    HB3  ASP   7           HB3      ASP   7  14.002   6.230  -0.220
   52    H    VAL   8           H        VAL   8  13.672   7.771  -3.100
   53    HA   VAL   8           HA       VAL   8  16.263   9.076  -3.888
   54    HB   VAL   8           HB       VAL   8  15.007   6.552  -5.022
   55   HG11  VAL   8          HG11      VAL   8  16.938   6.516  -6.598
   56   HG12  VAL   8          HG12      VAL   8  15.834   7.849  -6.921
   57   HG13  VAL   8          HG13      VAL   8  17.371   8.160  -6.079
   58   HG21  VAL   8          HG21      VAL   8  17.161   5.520  -4.424
   59   HG22  VAL   8          HG22      VAL   8  17.753   7.073  -3.794
   60   HG23  VAL   8          HG23      VAL   8  16.418   6.231  -2.986
   61    H    ALA   9           H        ALA   9  12.878   8.297  -4.881
   62    HA   ALA   9           HA       ALA   9  12.867   9.742  -7.263
   63    HB1  ALA   9           HB1      ALA   9  11.100   8.178  -6.519
   64    HB2  ALA   9           HB2      ALA   9  10.562   9.366  -5.309
   65    HB3  ALA   9           HB3      ALA   9  10.429   9.735  -7.036
   66    H    ASN  10           H        ASN  10  12.214  11.086  -3.961
   67    HA   ASN  10           HA       ASN  10  11.486  13.720  -4.778
   68    HB2  ASN  10           HB2      ASN  10  12.656  12.562  -2.245
   69    HB3  ASN  10           HB3      ASN  10  12.477  14.301  -2.443
   70   HD21  ASN  10          HD22      ASN  10  10.315  15.201  -2.882
   71   HD22  ASN  10          HD21      ASN  10   8.931  14.303  -2.293
   72    H    THR  11           H        THR  11  14.720  12.317  -4.424
   73    HA   THR  11           HA       THR  11  16.094  14.853  -5.030
   74    HB   THR  11           HB       THR  11  17.090  11.980  -4.923
   75    HG1  THR  11           HG1      THR  11  17.781  12.568  -2.867
   76   HG21  THR  11          HG21      THR  11  19.321  13.018  -4.543
   77   HG22  THR  11          HG22      THR  11  18.684  13.428  -6.138
   78   HG23  THR  11          HG23      THR  11  18.616  14.628  -4.826
   79    H    ARG  12           H        ARG  12  15.519  11.721  -6.730
   80    HA   ARG  12           HA       ARG  12  16.945  12.514  -9.050
   81    HB2  ARG  12           HB2      ARG  12  16.606  10.184  -8.278
   82    HB3  ARG  12           HB3      ARG  12  14.910  10.263  -8.715
   83    HG2  ARG  12           HG2      ARG  12  16.358   9.063 -10.357
   84    HG3  ARG  12           HG3      ARG  12  15.468  10.403 -11.086
   85    HD2  ARG  12           HD2      ARG  12  17.368  11.784 -11.214
   86    HD3  ARG  12           HD3      ARG  12  18.306  10.800 -10.078
   87    HE   ARG  12           HE       ARG  12  17.959  10.403 -12.958
   88   HH11  ARG  12          HH11      ARG  12  19.049   8.804  -9.996
   89   HH12  ARG  12          HH12      ARG  12  19.675   7.449 -10.940
   90   HH21  ARG  12          HH21      ARG  12  18.965   8.619 -13.985
   91   HH22  ARG  12          HH22      ARG  12  19.609   7.354 -12.939
   92    H    ALA  13           H        ALA  13  13.518  13.031  -8.302
   93    HA   ALA  13           HA       ALA  13  12.735  13.859 -10.941
   94    HB1  ALA  13           HB1      ALA  13  10.983  15.099  -9.782
   95    HB2  ALA  13           HB2      ALA  13  11.172  13.491  -9.069
   96    HB3  ALA  13           HB3      ALA  13  11.838  14.911  -8.231
   97    H    ARG  14           H        ARG  14  14.311  15.634  -8.245
   98    HA   ARG  14           HA       ARG  14  14.310  18.229  -9.576
   99    HB2  ARG  14           HB2      ARG  14  15.910  17.169  -7.200
  100    HB3  ARG  14           HB3      ARG  14  15.910  18.845  -7.753
  101    HG2  ARG  14           HG2      ARG  14  13.501  19.053  -7.295
  102    HG3  ARG  14           HG3      ARG  14  13.402  17.344  -6.864
  103    HD2  ARG  14           HD2      ARG  14  13.443  18.607  -4.836
  104    HD3  ARG  14           HD3      ARG  14  14.966  17.716  -4.979
  105    HE   ARG  14           HE       ARG  14  15.164  20.416  -6.051
  106   HH11  ARG  14          HH11      ARG  14  15.221  18.704  -2.995
  107   HH12  ARG  14          HH12      ARG  14  16.154  19.949  -2.217
  108   HH21  ARG  14          HH21      ARG  14  16.365  21.953  -4.990
  109   HH22  ARG  14          HH22      ARG  14  16.773  21.733  -3.318
  110    H    GLU  15           H        GLU  15  16.677  15.585  -9.278
  111    HA   GLU  15           HA       GLU  15  18.712  16.807 -10.930
  112    HB2  GLU  15           HB2      GLU  15  17.931  13.883 -10.593
  113    HB3  GLU  15           HB3      GLU  15  19.332  14.486 -11.495
  114    HG2  GLU  15           HG2      GLU  15  20.270  15.432  -9.425
  115    HG3  GLU  15           HG3      GLU  15  18.916  14.745  -8.514
  116    H    THR  16           H        THR  16  15.939  14.689 -11.844
  117    HA   THR  16           HA       THR  16  16.417  14.654 -14.642
  118    HB   THR  16           HB       THR  16  13.749  14.515 -13.182
  119    HG1  THR  16           HG1      THR  16  15.122  12.920 -12.505
  120   HG21  THR  16          HG21      THR  16  14.542  13.561 -15.964
  121   HG22  THR  16          HG22      THR  16  13.021  13.172 -15.133
  122   HG23  THR  16          HG23      THR  16  13.369  14.845 -15.591
  123    H    ALA  17           H        ALA  17  14.561  16.967 -12.682
  124    HA   ALA  17           HA       ALA  17  13.788  18.691 -14.814
  125    HB1  ALA  17           HB1      ALA  17  13.311  20.272 -12.975
  126    HB2  ALA  17           HB2      ALA  17  12.752  18.629 -12.573
  127    HB3  ALA  17           HB3      ALA  17  14.245  19.260 -11.857
  128    H    ALA  18           H        ALA  18  16.722  18.806 -12.696
  129    HA   ALA  18           HA       ALA  18  17.834  21.151 -13.907
  130    HB1  ALA  18           HB1      ALA  18  18.566  20.219 -11.739
  131    HB2  ALA  18           HB2      ALA  18  19.226  18.790 -12.564
  132    HB3  ALA  18           HB3      ALA  18  19.927  20.393 -12.864
  133    H    ARG  19           H        ARG  19  18.200  17.686 -14.721
  134    HA   ARG  19           HA       ARG  19  20.023  18.017 -16.946
  135    HB2  ARG  19           HB2      ARG  19  18.024  15.822 -16.249
  136    HB3  ARG  19           HB3      ARG  19  19.110  15.742 -17.643
  137    HG2  ARG  19           HG2      ARG  19  21.079  15.884 -16.211
  138    HG3  ARG  19           HG3      ARG  19  20.075  16.088 -14.773
  139    HD2  ARG  19           HD2      ARG  19  19.069  13.840 -15.193
  140    HD3  ARG  19           HD3      ARG  19  20.185  13.621 -16.554
  141    HE   ARG  19           HE       ARG  19  22.052  13.933 -14.867
  142   HH11  ARG  19          HH11      ARG  19  19.046  12.428 -13.707
  143   HH12  ARG  19          HH12      ARG  19  19.780  12.267 -12.096
  144   HH21  ARG  19          HH21      ARG  19  22.794  13.449 -12.788
  145   HH22  ARG  19          HH22      ARG  19  21.650  12.727 -11.659
  146    H    PHE  20           H        PHE  20  16.442  17.777 -16.904
  147    HA   PHE  20           HA       PHE  20  16.004  18.357 -19.647
  148    HB2  PHE  20           HB2      PHE  20  14.170  17.612 -18.309
  149    HB3  PHE  20           HB3      PHE  20  14.417  18.879 -17.124
  150    HD1  PHE  20           HD2      PHE  20  13.721  18.591 -20.844
  151    HD2  PHE  20           HD1      PHE  20  13.094  20.775 -17.174
  152    HE1  PHE  20           HE2      PHE  20  12.105  20.088 -21.992
  153    HE2  PHE  20           HE1      PHE  20  11.554  22.313 -18.351
  154    HZ   PHE  20           HZ       PHE  20  11.055  21.974 -20.768
  155    H    THR  21           H        THR  21  16.362  20.683 -16.902
  156    HA   THR  21           HA       THR  21  15.964  23.023 -18.474
  157    HB   THR  21           HB       THR  21  17.632  22.752 -15.943
  158    HG1  THR  21           HG1      THR  21  15.557  22.042 -15.612
  159   HG21  THR  21          HG21      THR  21  16.291  25.167 -17.249
  160   HG22  THR  21          HG22      THR  21  16.888  25.140 -15.581
  161   HG23  THR  21          HG23      THR  21  18.026  24.942 -16.915
  162    H    ALA  22           H        ALA  22  19.067  21.311 -17.709
  163    HA   ALA  22           HA       ALA  22  20.691  23.035 -19.315
  164    HB1  ALA  22           HB1      ALA  22  21.045  20.086 -18.605
  165    HB2  ALA  22           HB2      ALA  22  22.313  21.173 -19.208
  166    HB3  ALA  22           HB3      ALA  22  21.577  21.467 -17.620
  167    H    ALA  23           H        ALA  23  18.882  20.074 -20.194
  168    HA   ALA  23           HA       ALA  23  19.730  19.974 -22.917
  169    HB1  ALA  23           HB1      ALA  23  18.699  18.100 -21.680
  170    HB2  ALA  23           HB2      ALA  23  17.138  18.955 -21.699
  171    HB3  ALA  23           HB3      ALA  23  17.893  18.438 -23.219
  172    H    LEU  24           H        LEU  24  17.073  21.778 -21.376
  173    HA   LEU  24           HA       LEU  24  15.978  22.843 -23.818
  174    HB2  LEU  24           HB2      LEU  24  14.760  22.589 -21.670
  175    HB3  LEU  24           HB3      LEU  24  15.811  23.780 -20.933
  176    HG   LEU  24           HG       LEU  24  14.927  25.486 -22.613
  177   HD11  LEU  24          HD11      LEU  24  12.896  23.266 -23.165
  178   HD12  LEU  24          HD12      LEU  24  12.799  24.942 -23.745
  179   HD13  LEU  24          HD13      LEU  24  14.090  23.880 -24.325
  180   HD21  LEU  24          HD21      LEU  24  14.053  25.328 -20.304
  181   HD22  LEU  24          HD22      LEU  24  12.766  25.754 -21.448
  182   HD23  LEU  24          HD23      LEU  24  12.896  24.091 -20.829
  183    H    GLU  25           H        GLU  25  18.538  23.999 -21.582
  184    HA   GLU  25           HA       GLU  25  19.059  26.486 -22.936
  185    HB2  GLU  25           HB2      GLU  25  20.008  25.724 -20.685
  186    HB3  GLU  25           HB3      GLU  25  21.147  24.731 -21.586
  187    HG2  GLU  25           HG2      GLU  25  21.974  26.771 -22.761
  188    HG3  GLU  25           HG3      GLU  25  20.828  27.749 -21.844
  189    H    LEU  26           H        LEU  26  20.416  23.212 -23.392
  190    HA   LEU  26           HA       LEU  26  21.978  23.588 -25.715
  191    HB2  LEU  26           HB2      LEU  26  22.223  21.503 -24.771
  192    HB3  LEU  26           HB3      LEU  26  20.550  21.381 -24.338
  193    HG   LEU  26           HG       LEU  26  20.020  20.897 -26.811
  194   HD11  LEU  26          HD11      LEU  26  23.022  20.379 -26.841
  195   HD12  LEU  26          HD12      LEU  26  21.863  19.973 -28.126
  196   HD13  LEU  26          HD13      LEU  26  22.195  21.671 -27.739
  197   HD21  LEU  26          HD21      LEU  26  19.901  19.194 -25.108
  198   HD22  LEU  26          HD22      LEU  26  20.652  18.532 -26.562
  199   HD23  LEU  26          HD23      LEU  26  21.666  18.957 -25.162
  200    H    ALA  27           H        ALA  27  18.468  22.930 -25.507
  201    HA   ALA  27           HA       ALA  27  17.978  22.995 -28.296
  202    HB1  ALA  27           HB1      ALA  27  15.628  23.258 -27.655
  203    HB2  ALA  27           HB2      ALA  27  16.434  22.058 -26.622
  204    HB3  ALA  27           HB3      ALA  27  16.100  23.687 -26.004
  205    H    ILE  28           H        ILE  28  17.938  25.727 -25.952
  206    HA   ILE  28           HA       ILE  28  17.118  27.746 -27.848
  207    HB   ILE  28           HB       ILE  28  18.701  27.943 -25.256
  208   HG12  ILE  28          HG12      ILE  28  15.800  28.721 -25.766
  209   HG13  ILE  28          HG13      ILE  28  16.235  27.095 -25.265
  210   HG21  ILE  28          HG21      ILE  28  17.437  30.166 -26.932
  211   HG22  ILE  28          HG22      ILE  28  18.077  30.372 -25.288
  212   HG23  ILE  28          HG23      ILE  28  19.169  29.952 -26.598
  213   HD11  ILE  28          HD11      ILE  28  17.329  28.024 -23.223
  214   HD12  ILE  28          HD12      ILE  28  16.655  29.616 -23.656
  215   HD13  ILE  28          HD13      ILE  28  15.575  28.240 -23.336
  216    H    ASP  29           H        ASP  29  20.399  26.676 -26.801
  217    HA   ASP  29           HA       ASP  29  21.847  28.389 -28.576
  218    HB2  ASP  29           HB2      ASP  29  22.813  27.191 -26.635
  219    HB3  ASP  29           HB3      ASP  29  22.579  25.652 -27.464
  220    H    ARG  30           H        ARG  30  20.508  25.135 -29.069
  221    HA   ARG  30           HA       ARG  30  21.516  24.795 -31.745
  222    HB2  ARG  30           HB2      ARG  30  20.758  22.994 -30.144
  223    HB3  ARG  30           HB3      ARG  30  19.106  23.542 -30.338
  224    HG2  ARG  30           HG2      ARG  30  19.480  21.526 -31.601
  225    HG3  ARG  30           HG3      ARG  30  19.137  22.848 -32.703
  226    HD2  ARG  30           HD2      ARG  30  20.881  21.473 -33.614
  227    HD3  ARG  30           HD3      ARG  30  21.560  23.050 -33.216
  228    HE   ARG  30           HE       ARG  30  22.120  21.616 -30.951
  229   HH11  ARG  30          HH11      ARG  30  22.781  20.855 -34.343
  230   HH12  ARG  30          HH12      ARG  30  24.172  19.878 -33.857
  231   HH21  ARG  30          HH21      ARG  30  23.960  20.300 -30.571
  232   HH22  ARG  30          HH22      ARG  30  24.729  19.573 -31.982
  233    H    ALA  31           H        ALA  31  18.502  26.300 -30.544
  234    HA   ALA  31           HA       ALA  31  17.300  26.551 -33.133
  235    HB1  ALA  31           HB1      ALA  31  16.047  26.677 -30.997
  236    HB2  ALA  31           HB2      ALA  31  16.869  28.193 -30.593
  237    HB3  ALA  31           HB3      ALA  31  15.770  28.116 -31.990
  238    H    THR  32           H        THR  32  19.819  28.555 -31.682
  239    HA   THR  32           HA       THR  32  19.390  30.628 -33.759
  240    HB   THR  32           HB       THR  32  20.170  31.188 -31.433
  241    HG1  THR  32           HG1      THR  32  21.667  32.044 -33.668
  242   HG21  THR  32          HG21      THR  32  22.667  31.292 -31.156
  243   HG22  THR  32          HG22      THR  32  21.963  29.691 -30.973
  244   HG23  THR  32          HG23      THR  32  22.828  30.107 -32.473
  245    H    LEU  33           H        LEU  33  20.972  27.599 -33.630
  246    HA   LEU  33           HA       LEU  33  22.861  28.375 -35.733
  247    HB2  LEU  33           HB2      LEU  33  24.371  26.909 -34.912
  248    HB3  LEU  33           HB3      LEU  33  23.507  27.364 -33.456
  249    HG   LEU  33           HG       LEU  33  22.159  25.201 -33.760
  250   HD11  LEU  33          HD11      LEU  33  23.528  23.335 -34.780
  251   HD12  LEU  33          HD12      LEU  33  22.847  24.415 -35.978
  252   HD13  LEU  33          HD13      LEU  33  24.560  24.564 -35.534
  253   HD21  LEU  33          HD21      LEU  33  23.908  23.933 -32.558
  254   HD22  LEU  33          HD22      LEU  33  25.132  25.098 -33.108
  255   HD23  LEU  33          HD23      LEU  33  23.846  25.607 -31.997
  256    H    SER  34           H        SER  34  20.088  26.295 -35.214
  257    HA   SER  34           HA       SER  34  20.669  24.507 -37.423
  258    HB2  SER  34           HB2      SER  34  18.105  24.793 -35.817
  259    HB3  SER  34           HB3      SER  34  18.577  23.430 -36.853
  260    HG   SER  34           HG       SER  34  19.775  24.325 -34.455
  261    H    GLY  35           H        GLY  35  18.851  27.499 -37.314
  262    HA2  GLY  35           HA2      GLY  35  18.047  28.692 -39.161
  263    HA3  GLY  35           HA3      GLY  35  18.291  27.289 -40.197
  264    H    GLN  36           H        GLN  36  16.544  26.226 -37.589
  265    HA   GLN  36           HA       GLN  36  13.860  27.187 -38.300
  266    HB2  GLN  36           HB2      GLN  36  14.199  25.017 -39.602
  267    HB3  GLN  36           HB3      GLN  36  14.566  24.225 -38.071
  268    HG2  GLN  36           HG2      GLN  36  12.222  24.867 -37.283
  269    HG3  GLN  36           HG3      GLN  36  11.891  25.359 -38.946
  270   HE21  GLN  36          HE22      GLN  36  12.506  22.662 -36.704
  271   HE22  GLN  36          HE21      GLN  36  11.981  21.414 -37.848
  272    HA   PRO  37           HA       PRO  37  13.580  27.077 -33.743
  273    HB2  PRO  37           HB2      PRO  37  10.881  25.881 -34.468
  274    HB3  PRO  37           HB3      PRO  37  11.270  27.010 -33.135
  275    HG2  PRO  37           HG2      PRO  37  10.249  28.003 -35.422
  276    HG3  PRO  37           HG3      PRO  37  11.688  28.804 -34.706
  277    HD2  PRO  37           HD2      PRO  37  11.570  26.909 -37.028
  278    HD3  PRO  37           HD3      PRO  37  12.562  28.376 -36.812
  279    H    VAL  38           H        VAL  38  13.394  25.524 -32.023
  280    HA   VAL  38           HA       VAL  38  14.053  22.699 -32.837
  281    HB   VAL  38           HB       VAL  38  15.345  24.487 -30.756
  282   HG11  VAL  38          HG11      VAL  38  15.960  21.555 -31.309
  283   HG12  VAL  38          HG12      VAL  38  16.929  22.648 -30.319
  284   HG13  VAL  38          HG13      VAL  38  15.310  22.220 -29.793
  285   HG21  VAL  38          HG21      VAL  38  16.072  24.800 -33.135
  286   HG22  VAL  38          HG22      VAL  38  17.350  24.094 -32.145
  287   HG23  VAL  38          HG23      VAL  38  16.414  23.076 -33.257
  288    H    GLY  39           H        GLY  39  13.572  21.051 -31.107
  289    HA2  GLY  39           HA2      GLY  39  11.625  21.971 -29.075
  290    HA3  GLY  39           HA3      GLY  39  10.993  20.948 -30.346
  291    H    ILE  40           H        ILE  40  10.574  20.128 -27.978
  292    HA   ILE  40           HA       ILE  40  12.385  17.795 -27.595
  293    HB   ILE  40           HB       ILE  40  11.202  19.376 -25.286
  294   HG12  ILE  40          HG12      ILE  40  14.108  19.215 -26.223
  295   HG13  ILE  40          HG13      ILE  40  13.071  20.627 -26.376
  296   HG21  ILE  40          HG21      ILE  40  12.531  17.791 -23.908
  297   HG22  ILE  40          HG22      ILE  40  11.420  16.901 -24.932
  298   HG23  ILE  40          HG23      ILE  40  13.124  16.992 -25.379
  299   HD11  ILE  40          HD11      ILE  40  12.858  20.802 -23.943
  300   HD12  ILE  40          HD12      ILE  40  14.013  19.455 -23.745
  301   HD13  ILE  40          HD13      ILE  40  14.531  20.963 -24.513
  302    H    HIS  41           H        HIS  41  11.345  16.021 -27.773
  303    HA   HIS  41           HA       HIS  41   8.394  15.915 -27.838
  304    HB2  HIS  41           HB2      HIS  41   9.555  14.980 -29.754
  305    HB3  HIS  41           HB3      HIS  41  10.631  14.069 -28.714
  306    HD1  HIS  41           HD1      HIS  41   9.702  11.727 -27.796
  307    HD2  HIS  41           HD2      HIS  41   6.918  14.131 -29.834
  308    HE1  HIS  41           HE1      HIS  41   7.634  10.295 -28.138
  309    H    PHE  42           H        PHE  42   7.249  14.549 -26.516
  310    HA   PHE  42           HA       PHE  42   8.598  13.024 -24.337
  311    HB2  PHE  42           HB2      PHE  42   6.449  15.153 -24.066
  312    HB3  PHE  42           HB3      PHE  42   6.819  13.995 -22.807
  313    HD1  PHE  42           HD2      PHE  42   8.859  14.095 -21.501
  314    HD2  PHE  42           HD1      PHE  42   8.045  17.070 -24.527
  315    HE1  PHE  42           HE2      PHE  42  10.561  15.589 -20.492
  316    HE2  PHE  42           HE1      PHE  42   9.728  18.571 -23.485
  317    HZ   PHE  42           HZ       PHE  42  10.974  17.836 -21.467
  318    H    SER  43           H        SER  43   7.709  11.051 -24.098
  319    HA   SER  43           HA       SER  43   4.835  10.611 -24.533
  320    HB2  SER  43           HB2      SER  43   5.127   8.753 -26.034
  321    HB3  SER  43           HB3      SER  43   5.924  10.165 -26.730
  322    HG   SER  43           HG       SER  43   7.906   9.317 -25.746
  323    H    ASP  44           H        ASP  44   4.174   8.356 -23.865
  324    HA   ASP  44           HA       ASP  44   5.182   7.577 -21.314
  325    HB2  ASP  44           HB2      ASP  44   2.912   7.104 -22.165
  326    HB3  ASP  44           HB3      ASP  44   3.585   6.022 -23.385
  327    H    SER  45           H        SER  45   6.187   6.626 -24.584
  328    HA   SER  45           HA       SER  45   7.770   4.324 -23.769
  329    HB2  SER  45           HB2      SER  45   7.809   5.969 -26.333
  330    HB3  SER  45           HB3      SER  45   8.615   4.409 -26.081
  331    HG   SER  45           HG       SER  45   6.573   4.168 -27.089
  332    H    ALA  46           H        ALA  46   8.590   7.678 -24.768
  333    HA   ALA  46           HA       ALA  46  10.917   7.871 -23.066
  334    HB1  ALA  46           HB1      ALA  46  12.609   8.033 -24.894
  335    HB2  ALA  46           HB2      ALA  46  11.890   6.422 -24.848
  336    HB3  ALA  46           HB3      ALA  46  11.367   7.587 -26.083
  337    H    TRP  47           H        TRP  47  12.192   9.917 -23.636
  338    HA   TRP  47           HA       TRP  47  10.638  11.978 -25.105
  339    HB2  TRP  47           HB2      TRP  47  11.216  13.644 -23.445
  340    HB3  TRP  47           HB3      TRP  47  10.327  12.338 -22.676
  341    HD1  TRP  47           HD1      TRP  47  13.614  14.153 -22.651
  342    HE1  TRP  47           HE1      TRP  47  15.088  13.345 -20.732
  343    HE3  TRP  47           HE3      TRP  47  10.870  10.073 -21.192
  344    HZ2  TRP  47           HZ2      TRP  47  15.146  11.129 -18.877
  345    HZ3  TRP  47           HZ3      TRP  47  11.692   8.609 -19.362
  346    HH2  TRP  47           HH2      TRP  47  13.822   9.123 -18.199
  347    H    ARG  48           H        ARG  48  11.985  13.534 -26.181
  348    HA   ARG  48           HA       ARG  48  14.875  13.013 -26.440
  349    HB2  ARG  48           HB2      ARG  48  14.758  12.250 -28.788
  350    HB3  ARG  48           HB3      ARG  48  13.946  11.124 -27.702
  351    HG2  ARG  48           HG2      ARG  48  11.746  12.161 -28.339
  352    HG3  ARG  48           HG3      ARG  48  12.606  13.132 -29.551
  353    HD2  ARG  48           HD2      ARG  48  13.315  11.045 -30.677
  354    HD3  ARG  48           HD3      ARG  48  12.498  10.092 -29.444
  355    HE   ARG  48           HE       ARG  48  11.128  11.955 -31.375
  356   HH11  ARG  48          HH11      ARG  48  10.888   8.958 -29.488
  357   HH12  ARG  48          HH12      ARG  48   9.225   8.743 -30.054
  358   HH21  ARG  48          HH21      ARG  48   8.956  11.449 -31.934
  359   HH22  ARG  48          HH22      ARG  48   8.292   9.974 -31.259
  360    H    ILE  49           H        ILE  49  16.015  14.486 -27.611
  361    HA   ILE  49           HA       ILE  49  14.735  17.116 -28.035
  362    HB   ILE  49           HB       ILE  49  17.593  16.301 -28.678
  363   HG12  ILE  49          HG12      ILE  49  17.284  15.678 -26.355
  364   HG13  ILE  49          HG13      ILE  49  18.309  17.093 -26.483
  365   HG21  ILE  49          HG21      ILE  49  18.022  18.745 -28.224
  366   HG22  ILE  49          HG22      ILE  49  16.983  18.455 -29.621
  367   HG23  ILE  49          HG23      ILE  49  16.270  18.989 -28.087
  368   HD11  ILE  49          HD11      ILE  49  16.494  18.552 -25.727
  369   HD12  ILE  49          HD12      ILE  49  15.348  17.188 -25.761
  370   HD13  ILE  49          HD13      ILE  49  16.674  17.188 -24.603
  371    H    MET  50           H        MET  50  14.345  18.085 -30.058
  372    HA   MET  50           HA       MET  50  14.961  16.500 -32.503
  373    HB2  MET  50           HB2      MET  50  12.222  17.546 -31.695
  374    HB3  MET  50           HB3      MET  50  12.637  17.004 -33.325
  375    HG2  MET  50           HG2      MET  50  13.271  14.775 -32.395
  376    HG3  MET  50           HG3      MET  50  12.731  15.312 -30.807
  377    HE1  MET  50           HE1      MET  50  10.041  14.614 -34.507
  378    HE2  MET  50           HE2      MET  50  11.720  15.192 -34.496
  379    HE3  MET  50           HE3      MET  50  11.381  13.486 -34.173
  380    H    VAL  51           H        VAL  51  15.055  17.549 -34.393
  381    HA   VAL  51           HA       VAL  51  15.324  20.522 -34.489
  382    HB   VAL  51           HB       VAL  51  17.597  20.041 -35.608
  383   HG11  VAL  51          HG11      VAL  51  17.275  20.956 -33.302
  384   HG12  VAL  51          HG12      VAL  51  17.458  19.308 -32.671
  385   HG13  VAL  51          HG13      VAL  51  18.788  20.088 -33.566
  386   HG21  VAL  51          HG21      VAL  51  17.263  17.588 -35.961
  387   HG22  VAL  51          HG22      VAL  51  18.779  18.031 -35.167
  388   HG23  VAL  51          HG23      VAL  51  17.444  17.359 -34.210
  389    HA   PRO  52           HA       PRO  52  13.947  20.209 -38.733
  390    HB2  PRO  52           HB2      PRO  52  16.017  21.376 -40.247
  391    HB3  PRO  52           HB3      PRO  52  14.668  22.231 -39.454
  392    HG2  PRO  52           HG2      PRO  52  17.468  21.729 -38.408
  393    HG3  PRO  52           HG3      PRO  52  16.543  23.256 -38.369
  394    HD2  PRO  52           HD2      PRO  52  16.647  21.767 -36.171
  395    HD3  PRO  52           HD3      PRO  52  15.061  22.383 -36.674
  396    H    GLY  53           H        GLY  53  17.358  19.333 -38.380
  397    HA2  GLY  53           HA2      GLY  53  18.641  17.569 -39.023
  398    HA3  GLY  53           HA3      GLY  53  17.160  16.648 -39.216
  399    H    LYS  54           H        LYS  54  15.923  17.307 -41.351
  400    HA   LYS  54           HA       LYS  54  17.619  16.580 -43.606
  401    HB2  LYS  54           HB2      LYS  54  15.308  15.775 -43.402
  402    HB3  LYS  54           HB3      LYS  54  14.694  17.433 -43.422
  403    HG2  LYS  54           HG2      LYS  54  15.618  17.719 -45.739
  404    HG3  LYS  54           HG3      LYS  54  16.160  16.034 -45.709
  405    HD2  LYS  54           HD2      LYS  54  13.856  15.252 -45.586
  406    HD3  LYS  54           HD3      LYS  54  13.256  16.913 -45.352
  407    HE2  LYS  54           HE2      LYS  54  14.141  17.575 -47.558
  408    HE3  LYS  54           HE3      LYS  54  14.777  15.947 -47.813
  409    HZ1  LYS  54           HZ1      LYS  54  12.483  15.107 -47.750
  410    HZ2  LYS  54           HZ2      LYS  54  11.890  16.610 -47.517
  411    HZ3  LYS  54           HZ3      LYS  54  12.629  16.231 -48.916
  412    H    THR  55           H        THR  55  15.742  19.513 -42.864
  413    HA   THR  55           HA       THR  55  17.575  21.242 -44.359
  414    HB   THR  55           HB       THR  55  16.339  20.306 -46.205
  415    HG1  THR  55           HG1      THR  55  15.748  22.193 -47.076
  416   HG21  THR  55          HG21      THR  55  13.961  20.571 -46.551
  417   HG22  THR  55          HG22      THR  55  14.192  19.664 -45.050
  418   HG23  THR  55          HG23      THR  55  13.757  21.385 -44.991
  419    HA   PRO  56           HA       PRO  56  15.404  24.213 -41.673
  420    HB2  PRO  56           HB2      PRO  56  16.685  26.498 -42.365
  421    HB3  PRO  56           HB3      PRO  56  17.522  25.189 -41.476
  422    HG2  PRO  56           HG2      PRO  56  17.577  25.741 -44.461
  423    HG3  PRO  56           HG3      PRO  56  18.966  25.456 -43.364
  424    HD2  PRO  56           HD2      PRO  56  17.817  23.469 -44.893
  425    HD3  PRO  56           HD3      PRO  56  18.555  23.147 -43.297
  426    H    SER  57           H        SER  57  15.426  24.180 -45.178
  427    HA   SER  57           HA       SER  57  14.015  26.611 -45.669
  428    HB2  SER  57           HB2      SER  57  14.358  24.164 -47.438
  429    HB3  SER  57           HB3      SER  57  13.865  25.780 -47.975
  430    HG   SER  57           HG       SER  57  16.115  25.413 -48.251
  431    H    ALA  58           H        ALA  58  12.728  23.634 -44.559
  432    HA   ALA  58           HA       ALA  58   9.983  24.621 -44.886
  433    HB1  ALA  58           HB1      ALA  58  10.338  23.308 -46.961
  434    HB2  ALA  58           HB2      ALA  58  10.875  21.914 -45.996
  435    HB3  ALA  58           HB3      ALA  58   9.196  22.486 -45.882
  436    H    TRP  59           H        TRP  59   8.511  23.607 -43.442
  437    HA   TRP  59           HA       TRP  59   9.479  22.922 -40.866
  438    HB2  TRP  59           HB2      TRP  59   7.321  23.917 -41.186
  439    HB3  TRP  59           HB3      TRP  59   6.784  22.591 -42.204
  440    HD1  TRP  59           HD1      TRP  59   5.894  20.427 -41.080
  441    HE1  TRP  59           HE1      TRP  59   5.051  19.880 -38.721
  442    HE3  TRP  59           HE3      TRP  59   7.962  24.375 -38.540
  443    HZ2  TRP  59           HZ2      TRP  59   5.150  21.061 -36.094
  444    HZ3  TRP  59           HZ3      TRP  59   7.578  24.624 -36.098
  445    HH2  TRP  59           HH2      TRP  59   6.165  22.991 -34.870
  446    H    ARG  60           H        ARG  60  10.606  21.183 -40.358
  447    HA   ARG  60           HA       ARG  60   9.412  18.522 -40.664
  448    HB2  ARG  60           HB2      ARG  60  10.793  18.879 -42.751
  449    HB3  ARG  60           HB3      ARG  60  12.210  19.122 -41.747
  450    HG2  ARG  60           HG2      ARG  60  12.114  16.910 -42.810
  451    HG3  ARG  60           HG3      ARG  60  12.216  16.786 -41.071
  452    HD2  ARG  60           HD2      ARG  60   9.427  16.759 -42.148
  453    HD3  ARG  60           HD3      ARG  60  10.440  15.445 -42.737
  454    HE   ARG  60           HE       ARG  60  10.983  15.056 -40.213
  455   HH11  ARG  60          HH21      ARG  60   7.739  15.679 -41.474
  456   HH12  ARG  60          HH22      ARG  60   7.030  14.910 -40.063
  457   HH21  ARG  60          HH11      ARG  60   9.957  14.302 -38.470
  458   HH22  ARG  60          HH12      ARG  60   8.198  14.247 -38.424
  459    H    TRP  61           H        TRP  61  10.509  16.938 -39.346
  460    HA   TRP  61           HA       TRP  61  12.231  17.981 -37.167
  461    HB2  TRP  61           HB2      TRP  61   9.591  16.509 -36.826
  462    HB3  TRP  61           HB3      TRP  61  10.769  16.783 -35.545
  463    HD1  TRP  61           HD1      TRP  61   7.821  18.335 -36.994
  464    HE1  TRP  61           HE1      TRP  61   7.529  20.762 -36.135
  465    HE3  TRP  61           HE3      TRP  61  12.423  18.995 -34.910
  466    HZ2  TRP  61           HZ2      TRP  61   9.037  22.630 -34.513
  467    HZ3  TRP  61           HZ3      TRP  61  12.967  21.069 -33.679
  468    HH2  TRP  61           HH2      TRP  61  11.285  22.879 -33.448
  469    H    VAL  62           H        VAL  62  13.705  16.656 -36.460
  470    HA   VAL  62           HA       VAL  62  13.671  13.715 -36.936
  471    HB   VAL  62           HB       VAL  62  16.012  15.611 -37.479
  472   HG11  VAL  62          HG11      VAL  62  17.159  13.661 -38.425
  473   HG12  VAL  62          HG12      VAL  62  16.780  13.371 -36.735
  474   HG13  VAL  62          HG13      VAL  62  15.788  12.617 -38.007
  475   HG21  VAL  62          HG21      VAL  62  14.231  14.123 -39.451
  476   HG22  VAL  62          HG22      VAL  62  14.445  15.884 -39.304
  477   HG23  VAL  62          HG23      VAL  62  15.777  14.884 -39.878
  478    HA   PRO  63           HA       PRO  63  15.160  14.111 -32.628
  479    HB2  PRO  63           HB2      PRO  63  16.376  11.686 -32.259
  480    HB3  PRO  63           HB3      PRO  63  14.605  11.927 -32.236
  481    HG2  PRO  63           HG2      PRO  63  16.315  10.993 -34.559
  482    HG3  PRO  63           HG3      PRO  63  14.798  10.264 -33.938
  483    HD2  PRO  63           HD2      PRO  63  14.786  11.932 -36.067
  484    HD3  PRO  63           HD3      PRO  63  13.481  12.010 -34.850
  485    H    LEU  64           H        LEU  64  17.092  14.740 -31.655
  486    HA   LEU  64           HA       LEU  64  19.031  15.712 -33.448
  487    HB2  LEU  64           HB2      LEU  64  18.290  16.790 -31.367
  488    HB3  LEU  64           HB3      LEU  64  19.139  15.576 -30.413
  489    HG   LEU  64           HG       LEU  64  21.284  16.433 -31.051
  490   HD11  LEU  64          HD11      LEU  64  20.963  16.870 -33.439
  491   HD12  LEU  64          HD12      LEU  64  19.863  18.208 -33.057
  492   HD13  LEU  64          HD13      LEU  64  21.585  18.309 -32.633
  493   HD21  LEU  64          HD21      LEU  64  19.437  18.803 -30.620
  494   HD22  LEU  64          HD22      LEU  64  20.073  17.729 -29.349
  495   HD23  LEU  64          HD23      LEU  64  21.183  18.737 -30.291
  496    H    GLN  65           H        GLN  65  18.890  12.692 -33.186
  497    HA   GLN  65           HA       GLN  65  21.409  11.681 -32.145
  498    HB2  GLN  65           HB2      GLN  65  19.342  10.471 -34.030
  499    HB3  GLN  65           HB3      GLN  65  20.739   9.603 -33.380
  500    HG2  GLN  65           HG2      GLN  65  19.911   9.943 -31.075
  501    HG3  GLN  65           HG3      GLN  65  18.524  10.839 -31.680
  502   HE21  GLN  65          HE22      GLN  65  20.119   7.585 -32.041
  503   HE22  GLN  65          HE21      GLN  65  18.593   6.750 -32.235
  504    H    GLU  66           H        GLU  66  20.476  13.227 -35.091
  505    HA   GLU  66           HA       GLU  66  22.580  12.399 -36.837
  506    HB2  GLU  66           HB2      GLU  66  21.106  15.058 -36.622
  507    HB3  GLU  66           HB3      GLU  66  22.087  14.551 -37.996
  508    HG2  GLU  66           HG2      GLU  66  19.526  13.192 -37.049
  509    HG3  GLU  66           HG3      GLU  66  19.672  14.290 -38.410
  510    H    ASP  67           H        ASP  67  22.741  14.466 -33.999
  511    HA   ASP  67           HA       ASP  67  25.603  15.015 -34.607
  512    HB2  ASP  67           HB2      ASP  67  24.203  16.883 -35.529
  513    HB3  ASP  67           HB3      ASP  67  23.580  17.179 -33.907
  514    H    ALA  68           H        ALA  68  23.143  14.660 -32.091
  515    HA   ALA  68           HA       ALA  68  25.340  14.745 -30.059
  516    HB1  ALA  68           HB1      ALA  68  22.348  15.018 -29.641
  517    HB2  ALA  68           HB2      ALA  68  23.613  15.172 -28.411
  518    HB3  ALA  68           HB3      ALA  68  23.504  16.369 -29.715
  519    H    ALA  69           H        ALA  69  24.212  12.550 -31.996
  520    HA   ALA  69           HA       ALA  69  23.918  10.346 -32.096
  521    HB1  ALA  69           HB1      ALA  69  26.234  10.517 -31.241
  522    HB2  ALA  69           HB2      ALA  69  25.629  10.285 -29.586
  523    HB3  ALA  69           HB3      ALA  69  25.454   8.995 -30.795
  524    H    ASP  70           H        ASP  70  23.620   8.231 -30.304
  525    HA   ASP  70           HA       ASP  70  20.826   8.314 -29.810
  526    HB2  ASP  70           HB2      ASP  70  21.090   6.099 -28.937
  527    HB3  ASP  70           HB3      ASP  70  22.085   6.290 -30.372
  528    H    GLU  71           H        GLU  71  23.238   9.647 -27.847
  529    HA   GLU  71           HA       GLU  71  21.969   9.416 -25.239
  530    HB2  GLU  71           HB2      GLU  71  23.991  11.377 -26.395
  531    HB3  GLU  71           HB3      GLU  71  23.505  11.355 -24.706
  532    HG2  GLU  71           HG2      GLU  71  24.823   8.994 -26.118
  533    HG3  GLU  71           HG3      GLU  71  25.684  10.221 -25.206
  534    H    SER  72           H        SER  72  21.050  11.136 -28.031
  535    HA   SER  72           HA       SER  72  20.013  13.573 -27.046
  536    HB2  SER  72           HB2      SER  72  18.995  11.874 -29.360
  537    HB3  SER  72           HB3      SER  72  18.682  13.600 -29.114
  538    HG   SER  72           HG       SER  72  21.130  12.313 -29.715
  539    H    GLN  73           H        GLN  73  18.981  10.897 -25.603
  540    HA   GLN  73           HA       GLN  73  16.190  11.719 -25.231
  541    HB2  GLN  73           HB2      GLN  73  15.235   9.672 -26.157
  542    HB3  GLN  73           HB3      GLN  73  16.257  10.415 -27.384
  543    HG2  GLN  73           HG2      GLN  73  18.104   8.775 -26.365
  544    HG3  GLN  73           HG3      GLN  73  16.706   7.885 -25.787
  545   HE21  GLN  73          HE22      GLN  73  18.902   7.740 -28.095
  546   HE22  GLN  73          HE21      GLN  73  17.924   7.154 -29.452
  547    H    ASN  74           H        ASN  74  15.031  10.466 -23.704
  548    HA   ASN  74           HA       ASN  74  14.692   9.479 -21.678
  549    HB2  ASN  74           HB2      ASN  74  14.920   7.761 -23.601
  550    HB3  ASN  74           HB3      ASN  74  16.436   7.294 -22.851
  551   HD21  ASN  74          HD22      ASN  74  16.307   5.763 -21.209
  552   HD22  ASN  74          HD21      ASN  74  14.764   5.261 -20.504
  553    H    ASP  75           H        ASP  75  16.185   7.549 -20.268
  554    HA   ASP  75           HA       ASP  75  17.482   7.196 -18.528
  555    HB2  ASP  75           HB2      ASP  75  19.378   8.197 -20.645
  556    HB3  ASP  75           HB3      ASP  75  19.972   7.580 -19.114
  557    H    TRP  76           H        TRP  76  17.163  10.594 -18.887
  558    HA   TRP  76           HA       TRP  76  18.842  11.463 -16.789
  559    HB2  TRP  76           HB2      TRP  76  16.051  12.480 -17.388
  560    HB3  TRP  76           HB3      TRP  76  17.279  13.328 -16.485
  561    HD1  TRP  76           HD1      TRP  76  19.553  12.422 -18.869
  562    HE1  TRP  76           HE1      TRP  76  19.615  13.862 -20.980
  563    HE3  TRP  76           HE3      TRP  76  14.999  14.734 -18.409
  564    HZ2  TRP  76           HZ2      TRP  76  17.862  15.667 -22.379
  565    HZ3  TRP  76           HZ3      TRP  76  14.184  16.238 -20.207
  566    HH2  TRP  76           HH2      TRP  76  15.599  16.718 -22.191
  567    H    ASP  77           H        ASP  77  16.056   9.442 -16.457
  568    HA   ASP  77           HA       ASP  77  16.199   9.610 -13.494
  569    HB2  ASP  77           HB2      ASP  77  14.069  10.064 -13.222
  570    HB3  ASP  77           HB3      ASP  77  14.094  10.648 -14.875
  571    H    GLU  78           H        GLU  78  15.508   7.676 -12.354
  572    HA   GLU  78           HA       GLU  78  15.038   5.237 -13.915
  573    HB2  GLU  78           HB2      GLU  78  16.748   3.907 -12.892
  574    HB3  GLU  78           HB3      GLU  78  17.490   5.320 -13.626
  575    HG2  GLU  78           HG2      GLU  78  17.429   6.388 -11.273
  576    HG3  GLU  78           HG3      GLU  78  17.041   4.786 -10.664
  577    H    GLU  79           H        GLU  79  13.508   7.039 -12.031
  578    HA   GLU  79           HA       GLU  79  12.365   4.992 -10.258
  579    HB2  GLU  79           HB2      GLU  79  14.472   6.118  -9.140
  580    HB3  GLU  79           HB3      GLU  79  13.430   7.506  -8.923
  581    HG2  GLU  79           HG2      GLU  79  13.479   6.208  -6.903
  582    HG3  GLU  79           HG3      GLU  79  11.868   6.066  -7.570
  583    H    LEU  80           H        LEU  80  11.780   7.406 -12.359
  584    HA   LEU  80           HA       LEU  80   9.338   8.454 -11.010
  585    HB2  LEU  80           HB2      LEU  80  11.399   9.849 -12.776
  586    HB3  LEU  80           HB3      LEU  80   9.831  10.523 -12.456
  587    HG   LEU  80           HG       LEU  80  11.539  11.607 -11.170
  588   HD11  LEU  80          HD11      LEU  80   9.606   9.991  -9.448
  589   HD12  LEU  80          HD12      LEU  80  10.454  11.448  -8.934
  590   HD13  LEU  80          HD13      LEU  80   9.262  11.541 -10.249
  591   HD21  LEU  80          HD21      LEU  80  11.933   9.181  -9.448
  592   HD22  LEU  80          HD22      LEU  80  13.039   9.621 -10.782
  593   HD23  LEU  80          HD23      LEU  80  12.769  10.731  -9.421
  594    H    SER  81           H        SER  81   7.797   9.383 -12.567
  595    HA   SER  81           HA       SER  81   7.824   8.316 -15.348
  596    HB2  SER  81           HB2      SER  81   6.351   6.871 -13.910
  597    HB3  SER  81           HB3      SER  81   5.376   8.310 -13.536
  598    HG   SER  81           HG       SER  81   4.565   7.088 -15.331
  599    H    ILE  82           H        ILE  82   6.933   9.765 -16.842
  600    HA   ILE  82           HA       ILE  82   6.579  12.562 -15.843
  601    HB   ILE  82           HB       ILE  82   8.352  11.330 -17.894
  602   HG12  ILE  82          HG12      ILE  82   9.790  13.256 -17.363
  603   HG13  ILE  82          HG13      ILE  82   8.518  13.959 -16.368
  604   HG21  ILE  82          HG21      ILE  82   6.951  12.551 -19.467
  605   HG22  ILE  82          HG22      ILE  82   7.095  14.036 -18.491
  606   HG23  ILE  82          HG23      ILE  82   8.514  13.339 -19.291
  607   HD11  ILE  82          HD11      ILE  82   9.857  11.282 -15.787
  608   HD12  ILE  82          HD12      ILE  82  10.365  12.840 -15.099
  609   HD13  ILE  82          HD13      ILE  82   8.766  12.200 -14.714
  610    H    HIS  83           H        HIS  83   5.123  13.888 -16.738
  611    HA   HIS  83           HA       HIS  83   3.274  12.940 -18.876
  612    HB2  HIS  83           HB2      HIS  83   2.430  14.189 -16.224
  613    HB3  HIS  83           HB3      HIS  83   1.362  13.672 -17.523
  614    HD1  HIS  83           HD1      HIS  83   0.822  11.018 -17.619
  615    HD2  HIS  83           HD2      HIS  83   3.498  12.276 -14.625
  616    HE1  HIS  83           HE1      HIS  83   1.103   9.042 -16.035
  617    H    LEU  84           H        LEU  84   2.226  14.683 -20.002
  618    HA   LEU  84           HA       LEU  84   3.188  17.465 -19.415
  619    HB2  LEU  84           HB2      LEU  84   2.559  16.223 -22.129
  620    HB3  LEU  84           HB3      LEU  84   2.808  17.931 -21.820
  621    HG   LEU  84           HG       LEU  84   4.887  15.734 -21.756
  622   HD11  LEU  84          HD11      LEU  84   4.564  18.372 -23.271
  623   HD12  LEU  84          HD12      LEU  84   5.915  17.262 -23.445
  624   HD13  LEU  84          HD13      LEU  84   4.294  16.741 -23.937
  625   HD21  LEU  84          HD21      LEU  84   6.521  17.550 -21.170
  626   HD22  LEU  84          HD22      LEU  84   5.137  18.604 -20.781
  627   HD23  LEU  84          HD23      LEU  84   5.436  17.125 -19.846
  628    H    GLN  85           H        GLN  85   1.757  19.049 -19.449
  629    HA   GLN  85           HA       GLN  85  -0.711  19.107 -20.776
  630    HB2  GLN  85           HB2      GLN  85  -2.344  19.175 -19.070
  631    HB3  GLN  85           HB3      GLN  85  -1.612  17.602 -19.142
  632    HG2  GLN  85           HG2      GLN  85  -1.273  19.696 -16.973
  633    HG3  GLN  85           HG3      GLN  85  -2.051  18.143 -16.859
  634   HE21  GLN  85          HE22      GLN  85   1.091  19.797 -16.732
  635   HE22  GLN  85          HE21      GLN  85   1.953  18.364 -16.203
  636    HA   PRO  86           HA       PRO  86  -1.568  21.106 -21.975
  637    HB2  PRO  86           HB2      PRO  86   0.570  23.116 -22.737
  638    HB3  PRO  86           HB3      PRO  86  -1.088  22.937 -23.397
  639    HG2  PRO  86           HG2      PRO  86  -0.602  24.787 -21.494
  640    HG3  PRO  86           HG3      PRO  86  -2.063  23.748 -21.369
  641    HD2  PRO  86           HD2      PRO  86   0.578  23.449 -19.949
  642    HD3  PRO  86           HD3      PRO  86  -1.091  23.242 -19.320
  643    H    PHE  87           H        PHE  87  -1.096  20.347 -23.735
  644    HA   PHE  87           HA       PHE  87  -0.305  19.007 -25.454
  645    HB2  PHE  87           HB2      PHE  87   2.382  18.827 -24.083
  646    HB3  PHE  87           HB3      PHE  87   1.973  18.351 -25.719
  647    HD1  PHE  87           HD2      PHE  87   0.569  20.552 -26.926
  648    HD2  PHE  87           HD1      PHE  87   3.863  20.655 -24.141
  649    HE1  PHE  87           HE2      PHE  87   1.277  22.745 -27.842
  650    HE2  PHE  87           HE1      PHE  87   4.584  22.838 -25.084
  651    HZ   PHE  87           HZ       PHE  87   3.290  23.880 -26.935
  652    H    LYS  88           H        LYS  88   0.996  16.603 -25.346
  653    HA   LYS  88           HA       LYS  88   0.021  15.158 -22.979
  654    HB2  LYS  88           HB2      LYS  88  -1.426  13.682 -24.036
  655    HB3  LYS  88           HB3      LYS  88  -1.885  15.256 -24.638
  656    HG2  LYS  88           HG2      LYS  88  -0.309  13.116 -26.140
  657    HG3  LYS  88           HG3      LYS  88  -2.006  13.522 -26.336
  658    HD2  LYS  88           HD2      LYS  88  -1.249  15.865 -27.059
  659    HD3  LYS  88           HD3      LYS  88   0.398  15.188 -27.176
  660    HE2  LYS  88           HE2      LYS  88  -0.372  13.486 -28.760
  661    HE3  LYS  88           HE3      LYS  88  -2.044  14.021 -28.576
  662    HZ1  LYS  88           HZ1      LYS  88  -1.044  14.950 -30.581
  663    HZ2  LYS  88           HZ2      LYS  88  -1.421  16.156 -29.559
  664    HZ3  LYS  88           HZ3      LYS  88   0.134  15.688 -29.731
  665    HA   PRO  89           HA       PRO  89   3.623  12.691 -23.886
  666    HB2  PRO  89           HB2      PRO  89   3.363  10.641 -22.129
  667    HB3  PRO  89           HB3      PRO  89   3.626  12.327 -21.597
  668    HG2  PRO  89           HG2      PRO  89   0.989  10.831 -21.775
  669    HG3  PRO  89           HG3      PRO  89   1.621  11.800 -20.410
  670    HD2  PRO  89           HD2      PRO  89  -0.125  12.794 -22.293
  671    HD3  PRO  89           HD3      PRO  89   1.092  13.814 -21.475
  672    H    ASP  90           H        ASP  90   2.990  12.270 -26.091
  673    HA   ASP  90           HA       ASP  90   2.268   9.432 -26.609
  674    HB2  ASP  90           HB2      ASP  90   0.154  10.696 -26.780
  675    HB3  ASP  90           HB3      ASP  90   0.913  11.832 -27.901
  676    H    ASP  91           H        ASP  91   3.233   8.581 -28.449
  677    HA   ASP  91           HA       ASP  91   5.698   9.815 -29.203
  678    HB2  ASP  91           HB2      ASP  91   5.483   7.438 -28.739
  679    HB3  ASP  91           HB3      ASP  91   4.460   7.236 -30.166
  680    H    SER  92           H        SER  92   4.624  11.726 -30.110
  681    HA   SER  92           HA       SER  92   3.309  11.760 -32.663
  682    HB2  SER  92           HB2      SER  92   3.063  13.510 -30.967
  683    HB3  SER  92           HB3      SER  92   4.778  13.927 -31.120
  684    HG   SER  92           HG       SER  92   3.202  15.211 -32.380
  685    H    ASN  93           H        ASN  93   4.030  12.702 -34.613
  686    HA   ASN  93           HA       ASN  93   6.666  11.938 -35.589
  687    HB2  ASN  93           HB2      ASN  93   4.519  11.864 -36.915
  688    HB3  ASN  93           HB3      ASN  93   4.467  13.629 -36.874
  689   HD21  ASN  93          HD22      ASN  93   6.417  10.838 -38.008
  690   HD22  ASN  93          HD21      ASN  93   7.149  11.723 -39.329
  691    H    GLN  94           H        GLN  94   5.638  14.588 -33.766
  692    HA   GLN  94           HA       GLN  94   8.005  16.230 -34.519
  693    HB2  GLN  94           HB2      GLN  94   6.660  18.247 -34.417
  694    HB3  GLN  94           HB3      GLN  94   5.950  17.172 -35.604
  695    HG2  GLN  94           HG2      GLN  94   4.085  16.687 -34.197
  696    HG3  GLN  94           HG3      GLN  94   4.887  17.264 -32.738
  697   HE21  GLN  94          HE22      GLN  94   5.165  19.557 -32.371
  698   HE22  GLN  94          HE21      GLN  94   4.130  20.684 -33.245
  699    HA   PRO  95           HA       PRO  95   8.268  16.676 -30.015
  700    HB2  PRO  95           HB2      PRO  95   9.272  19.194 -29.682
  701    HB3  PRO  95           HB3      PRO  95  10.269  17.829 -30.285
  702    HG2  PRO  95           HG2      PRO  95   8.858  19.980 -31.898
  703    HG3  PRO  95           HG3      PRO  95  10.554  19.413 -32.056
  704    HD2  PRO  95           HD2      PRO  95   8.574  18.510 -33.657
  705    HD3  PRO  95           HD3      PRO  95   9.877  17.421 -33.116
  706    H    GLN  96           H        GLN  96   6.889  17.369 -28.389
  707    HA   GLN  96           HA       GLN  96   4.526  18.946 -29.058
  708    HB2  GLN  96           HB2      GLN  96   5.624  17.880 -26.408
  709    HB3  GLN  96           HB3      GLN  96   4.124  18.767 -26.591
  710    HG2  GLN  96           HG2      GLN  96   3.458  16.519 -26.534
  711    HG3  GLN  96           HG3      GLN  96   3.322  16.996 -28.222
  712   HE21  GLN  96          HE22      GLN  96   3.344  14.561 -28.543
  713   HE22  GLN  96          HE21      GLN  96   4.870  13.713 -28.454
  714    H    VAL  97           H        VAL  97   7.446  19.504 -27.036
  715    HA   VAL  97           HA       VAL  97   6.697  22.329 -26.525
  716    HB   VAL  97           HB       VAL  97   9.067  20.630 -25.623
  717   HG11  VAL  97          HG11      VAL  97   9.600  23.039 -25.479
  718   HG12  VAL  97          HG12      VAL  97   8.091  23.319 -24.580
  719   HG13  VAL  97          HG13      VAL  97   9.388  22.335 -23.875
  720   HG21  VAL  97          HG21      VAL  97   6.507  21.373 -24.134
  721   HG22  VAL  97          HG22      VAL  97   6.917  19.753 -24.729
  722   HG23  VAL  97          HG23      VAL  97   7.892  20.483 -23.465
  723    H    VAL  98           H        VAL  98   7.700  24.095 -27.480
  724    HA   VAL  98           HA       VAL  98   9.969  23.575 -29.367
  725    HB   VAL  98           HB       VAL  98   7.413  25.041 -30.067
  726   HG11  VAL  98          HG11      VAL  98   9.957  24.739 -31.717
  727   HG12  VAL  98          HG12      VAL  98   8.403  25.348 -32.317
  728   HG13  VAL  98          HG13      VAL  98   9.275  26.264 -31.096
  729   HG21  VAL  98          HG21      VAL  98   7.280  23.341 -31.876
  730   HG22  VAL  98          HG22      VAL  98   8.721  22.538 -31.214
  731   HG23  VAL  98          HG23      VAL  98   7.210  22.600 -30.280
  732    H    ILE  99           H        ILE  99  11.352  25.181 -29.754
  733    HA   ILE  99           HA       ILE  99  11.511  27.452 -27.813
  734    HB   ILE  99           HB       ILE  99  13.705  25.572 -28.837
  735   HG12  ILE  99          HG12      ILE  99  13.966  25.083 -26.295
  736   HG13  ILE  99          HG13      ILE  99  12.297  25.596 -26.151
  737   HG21  ILE  99          HG21      ILE  99  14.585  27.809 -28.421
  738   HG22  ILE  99          HG22      ILE  99  13.816  27.851 -26.818
  739   HG23  ILE  99          HG23      ILE  99  15.128  26.710 -27.182
  740   HD11  ILE  99          HD11      ILE  99  13.268  23.355 -27.977
  741   HD12  ILE  99          HD12      ILE  99  12.693  23.113 -26.316
  742   HD13  ILE  99          HD13      ILE  99  11.580  23.714 -27.539
  743    H    LEU 100           H        LEU 100  12.131  29.400 -28.687
  744    HA   LEU 100           HA       LEU 100  13.095  29.463 -31.522
  745    HB2  LEU 100           HB2      LEU 100  12.046  31.801 -29.936
  746    HB3  LEU 100           HB3      LEU 100  12.383  31.726 -31.656
  747    HG   LEU 100           HG       LEU 100  10.060  30.461 -30.162
  748   HD11  LEU 100          HD11      LEU 100  10.162  32.382 -32.532
  749   HD12  LEU 100          HD12      LEU 100   8.720  31.871 -31.626
  750   HD13  LEU 100          HD13      LEU 100   9.949  32.886 -30.855
  751   HD21  LEU 100          HD21      LEU 100   9.275  29.625 -32.374
  752   HD22  LEU 100          HD22      LEU 100  10.830  30.111 -33.088
  753   HD23  LEU 100          HD23      LEU 100  10.760  28.824 -31.861
  754    H    ALA 101           H        ALA 101  14.669  31.089 -32.041
  755    HA   ALA 101           HA       ALA 101  17.089  30.503 -30.830
  756    HB1  ALA 101           HB1      ALA 101  18.007  32.188 -32.381
  757    HB2  ALA 101           HB2      ALA 101  16.756  31.209 -33.172
  758    HB3  ALA 101           HB3      ALA 101  16.385  32.861 -32.625
  759    H    ASP 102           H        ASP 102  14.996  33.136 -29.817
  760    HA   ASP 102           HA       ASP 102  17.205  34.437 -28.316
  761    HB2  ASP 102           HB2      ASP 102  15.907  36.379 -28.295
  762    HB3  ASP 102           HB3      ASP 102  15.770  35.741 -29.928
  763    H    GLY 103           H        GLY 103  15.181  31.975 -27.617
  764    HA2  GLY 103           HA2      GLY 103  15.119  30.993 -25.493
  765    HA3  GLY 103           HA3      GLY 103  15.388  32.549 -24.718
  766    H    GLN 104           H        GLN 104  12.786  32.630 -27.014
  767    HA   GLN 104           HA       GLN 104  10.795  32.477 -24.818
  768    HB2  GLN 104           HB2      GLN 104   9.187  33.426 -26.261
  769    HB3  GLN 104           HB3      GLN 104  10.647  34.415 -26.301
  770    HG2  GLN 104           HG2      GLN 104  11.266  33.169 -28.443
  771    HG3  GLN 104           HG3      GLN 104   9.629  32.505 -28.438
  772   HE21  GLN 104          HE22      GLN 104  11.614  35.194 -29.239
  773   HE22  GLN 104          HE21      GLN 104  10.310  36.285 -29.743
  774    H    ILE 105           H        ILE 105   9.237  30.925 -24.790
  775    HA   ILE 105           HA       ILE 105   9.768  28.437 -26.374
  776    HB   ILE 105           HB       ILE 105   9.191  28.423 -23.409
  777   HG12  ILE 105          HG12      ILE 105  11.203  29.759 -23.446
  778   HG13  ILE 105          HG13      ILE 105  11.468  28.192 -22.731
  779   HG21  ILE 105          HG21      ILE 105  10.486  26.442 -25.297
  780   HG22  ILE 105          HG22      ILE 105  10.445  26.227 -23.536
  781   HG23  ILE 105          HG23      ILE 105   8.937  26.280 -24.451
  782   HD11  ILE 105          HD11      ILE 105  13.362  28.923 -24.076
  783   HD12  ILE 105          HD12      ILE 105  12.661  27.437 -24.737
  784   HD13  ILE 105          HD13      ILE 105  12.356  29.013 -25.517
  785    H    THR 106           H        THR 106   7.927  26.952 -26.448
  786    HA   THR 106           HA       THR 106   5.288  28.027 -26.477
  787    HB   THR 106           HB       THR 106   4.669  25.540 -26.223
  788    HG1  THR 106           HG1      THR 106   6.673  25.033 -25.180
  789   HG21  THR 106          HG21      THR 106   4.806  26.561 -28.423
  790   HG22  THR 106          HG22      THR 106   6.572  26.383 -28.427
  791   HG23  THR 106          HG23      THR 106   5.525  24.940 -28.465
  792    HA   PRO 107           HA       PRO 107   4.747  27.921 -21.951
  793    HB2  PRO 107           HB2      PRO 107   2.173  28.823 -21.749
  794    HB3  PRO 107           HB3      PRO 107   3.585  29.877 -22.051
  795    HG2  PRO 107           HG2      PRO 107   1.602  28.802 -24.048
  796    HG3  PRO 107           HG3      PRO 107   2.309  30.449 -23.931
  797    HD2  PRO 107           HD2      PRO 107   3.214  28.504 -25.674
  798    HD3  PRO 107           HD3      PRO 107   4.264  29.788 -25.001
  799    H    PHE 108           H        PHE 108   4.318  26.151 -20.778
  800    HA   PHE 108           HA       PHE 108   2.048  24.420 -21.112
  801    HB2  PHE 108           HB2      PHE 108   3.023  22.480 -21.950
  802    HB3  PHE 108           HB3      PHE 108   3.628  23.724 -23.013
  803    HD1  PHE 108           HD2      PHE 108   5.981  24.758 -22.285
  804    HD2  PHE 108           HD1      PHE 108   4.544  20.903 -21.050
  805    HE1  PHE 108           HE2      PHE 108   8.302  24.057 -21.860
  806    HE2  PHE 108           HE1      PHE 108   6.886  20.188 -20.637
  807    HZ   PHE 108           HZ       PHE 108   8.763  21.753 -21.007
  808    H    SER 109           H        SER 109   2.630  22.215 -19.792
  809    HA   SER 109           HA       SER 109   4.418  22.769 -17.567
  810    HB2  SER 109           HB2      SER 109   2.757  23.535 -16.269
  811    HB3  SER 109           HB3      SER 109   1.495  22.873 -17.285
  812    HG   SER 109           HG       SER 109   2.946  21.568 -15.234
  813    H    LEU 110           H        LEU 110   5.120  21.001 -16.495
  814    HA   LEU 110           HA       LEU 110   4.832  18.316 -17.783
  815    HB2  LEU 110           HB2      LEU 110   6.721  19.107 -18.817
  816    HB3  LEU 110           HB3      LEU 110   7.151  20.201 -17.518
  817    HG   LEU 110           HG       LEU 110   8.113  18.377 -16.217
  818   HD11  LEU 110          HD11      LEU 110   6.782  16.416 -17.017
  819   HD12  LEU 110          HD12      LEU 110   7.489  16.606 -18.632
  820   HD13  LEU 110          HD13      LEU 110   8.510  16.160 -17.251
  821   HD21  LEU 110          HD21      LEU 110  10.047  17.984 -17.663
  822   HD22  LEU 110          HD22      LEU 110   9.099  18.422 -19.099
  823   HD23  LEU 110          HD23      LEU 110   9.467  19.645 -17.869
  824    H    LEU 111           H        LEU 111   4.416  16.788 -16.271
  825    HA   LEU 111           HA       LEU 111   4.982  17.411 -13.400
  826    HB2  LEU 111           HB2      LEU 111   2.672  17.669 -13.975
  827    HB3  LEU 111           HB3      LEU 111   2.585  16.070 -14.707
  828    HG   LEU 111           HG       LEU 111   3.448  16.296 -11.829
  829   HD11  LEU 111          HD11      LEU 111   1.491  17.766 -11.959
  830   HD12  LEU 111          HD12      LEU 111   0.554  16.485 -12.764
  831   HD13  LEU 111          HD13      LEU 111   1.095  16.284 -11.078
  832   HD21  LEU 111          HD21      LEU 111   1.635  14.299 -13.263
  833   HD22  LEU 111          HD22      LEU 111   3.354  14.038 -12.927
  834   HD23  LEU 111          HD23      LEU 111   2.218  14.180 -11.589
  835    H    MET 112           H        MET 112   5.684  15.790 -12.069
  836    HA   MET 112           HA       MET 112   6.680  13.284 -13.351
  837    HB2  MET 112           HB2      MET 112   8.137  14.971 -11.278
  838    HB3  MET 112           HB3      MET 112   8.717  13.493 -12.052
  839    HG2  MET 112           HG2      MET 112   8.646  14.704 -14.258
  840    HG3  MET 112           HG3      MET 112   8.248  16.186 -13.385
  841    HE1  MET 112           HE1      MET 112  11.938  16.814 -14.532
  842    HE2  MET 112           HE2      MET 112  10.704  15.897 -15.424
  843    HE3  MET 112           HE3      MET 112  10.259  17.394 -14.573
  844    H    ALA 113           H        ALA 113   6.421  11.457 -12.134
  845    HA   ALA 113           HA       ALA 113   5.295  11.672  -9.368
  846    HB1  ALA 113           HB1      ALA 113   3.478  11.388 -10.998
  847    HB2  ALA 113           HB2      ALA 113   4.316  10.001 -11.729
  848    HB3  ALA 113           HB3      ALA 113   3.690   9.887 -10.074
  849    H    ASN 114           H        ASN 114   5.695   9.924  -7.986
  850    HA   ASN 114           HA       ASN 114   8.184   8.449  -8.304
  851    HB2  ASN 114           HB2      ASN 114   7.512   9.118  -6.135
  852    HB3  ASN 114           HB3      ASN 114   5.887   8.508  -6.333
  853   HD21  ASN 114          HD22      ASN 114   7.032   7.911  -4.035
  854   HD22  ASN 114          HD21      ASN 114   7.568   6.243  -3.989
  855    H    ALA 115           H        ALA 115   8.533   6.624  -9.430
  856    HA   ALA 115           HA       ALA 115   6.558   5.589 -11.140
  857    HB1  ALA 115           HB1      ALA 115   8.298   3.938 -11.747
  858    HB2  ALA 115           HB2      ALA 115   8.956   5.574 -11.618
  859    HB3  ALA 115           HB3      ALA 115   9.238   4.399 -10.311
  860    H    GLY 116           H        GLY 116   7.181   4.547  -7.843
  861    HA2  GLY 116           HA2      GLY 116   5.882   1.897  -8.290
  862    HA3  GLY 116           HA3      GLY 116   6.693   2.437  -6.835
  863    H    THR 117           H        THR 117   5.137   5.052  -6.723
  864    HA   THR 117           HA       THR 117   2.616   4.011  -5.573
  865    HB   THR 117           HB       THR 117   2.421   6.287  -4.689
  866    HG1  THR 117           HG1      THR 117   4.153   7.715  -5.066
  867   HG21  THR 117          HG21      THR 117   5.267   5.282  -4.286
  868   HG22  THR 117          HG22      THR 117   4.382   6.411  -3.240
  869   HG23  THR 117          HG23      THR 117   3.848   4.730  -3.377
  870    H    GLY 118           H        GLY 118   3.758   5.940  -8.306
  871    HA2  GLY 118           HA2      GLY 118   2.653   6.751 -10.166
  872    HA3  GLY 118           HA3      GLY 118   1.116   6.103  -9.575
  873    H    GLU 119           H        GLU 119   2.743   7.941  -7.154
  874    HA   GLU 119           HA       GLU 119   0.667  10.001  -7.301
  875    HB2  GLU 119           HB2      GLU 119   1.234   8.693  -5.242
  876    HB3  GLU 119           HB3      GLU 119   2.814   9.491  -5.205
  877    HG2  GLU 119           HG2      GLU 119   1.709  11.682  -4.991
  878    HG3  GLU 119           HG3      GLU 119   0.127  10.912  -5.129
  879    HA   PRO 120           HA       PRO 120   3.360  13.159  -9.123
  880    HB2  PRO 120           HB2      PRO 120   1.716  14.951  -7.333
  881    HB3  PRO 120           HB3      PRO 120   2.221  15.203  -9.037
  882    HG2  PRO 120           HG2      PRO 120  -0.288  14.335  -8.465
  883    HG3  PRO 120           HG3      PRO 120   0.628  13.594  -9.816
  884    HD2  PRO 120           HD2      PRO 120   0.211  12.528  -7.020
  885    HD3  PRO 120           HD3      PRO 120   0.154  11.665  -8.588
  886    H    LEU 121           H        LEU 121   5.197  14.117  -8.597
  887    HA   LEU 121           HA       LEU 121   6.163  14.132  -5.771
  888    HB2  LEU 121           HB2      LEU 121   6.638  12.166  -7.282
  889    HB3  LEU 121           HB3      LEU 121   7.433  13.244  -8.405
  890    HG   LEU 121           HG       LEU 121   9.014  12.008  -7.261
  891   HD11  LEU 121          HD11      LEU 121  10.524  13.620  -6.593
  892   HD12  LEU 121          HD12      LEU 121   9.419  14.508  -7.620
  893   HD13  LEU 121          HD13      LEU 121   9.293  14.661  -5.849
  894   HD21  LEU 121          HD21      LEU 121   9.356  11.968  -4.843
  895   HD22  LEU 121          HD22      LEU 121   7.966  13.048  -4.601
  896   HD23  LEU 121          HD23      LEU 121   7.720  11.410  -5.238
  897    H    LEU 122           H        LEU 122   6.679  15.449  -9.048
  898    HA   LEU 122           HA       LEU 122   7.380  18.113  -7.973
  899    HB2  LEU 122           HB2      LEU 122   9.539  16.709  -8.326
  900    HB3  LEU 122           HB3      LEU 122   9.127  16.714 -10.035
  901    HG   LEU 122           HG       LEU 122   9.175  19.327  -9.803
  902   HD11  LEU 122          HD11      LEU 122  10.905  18.547  -7.410
  903   HD12  LEU 122          HD12      LEU 122  10.625  20.185  -8.053
  904   HD13  LEU 122          HD13      LEU 122   9.312  19.293  -7.271
  905   HD21  LEU 122          HD21      LEU 122  11.546  19.335 -10.254
  906   HD22  LEU 122          HD22      LEU 122  11.743  17.729  -9.514
  907   HD23  LEU 122          HD23      LEU 122  10.827  17.923 -11.023
  908    H    THR 123           H        THR 123   7.058  19.782  -9.612
  909    HA   THR 123           HA       THR 123   6.084  18.958 -12.280
  910    HB   THR 123           HB       THR 123   4.399  20.679 -10.419
  911    HG1  THR 123           HG1      THR 123   4.569  18.068 -10.769
  912   HG21  THR 123          HG21      THR 123   4.067  21.463 -12.716
  913   HG22  THR 123          HG22      THR 123   3.829  19.782 -13.264
  914   HG23  THR 123          HG23      THR 123   2.667  20.540 -12.157
  915    H    LEU 124           H        LEU 124   6.301  20.486 -13.812
  916    HA   LEU 124           HA       LEU 124   7.934  22.886 -13.191
  917    HB2  LEU 124           HB2      LEU 124   8.171  20.757 -15.360
  918    HB3  LEU 124           HB3      LEU 124   8.841  22.363 -15.571
  919    HG   LEU 124           HG       LEU 124  10.359  22.073 -13.696
  920   HD11  LEU 124          HD11      LEU 124  10.747  19.693 -12.859
  921   HD12  LEU 124          HD12      LEU 124   9.342  20.505 -12.199
  922   HD13  LEU 124          HD13      LEU 124   9.137  19.290 -13.489
  923   HD21  LEU 124          HD21      LEU 124  11.845  20.509 -14.808
  924   HD22  LEU 124          HD22      LEU 124  10.483  19.764 -15.669
  925   HD23  LEU 124          HD23      LEU 124  10.963  21.441 -16.020
  926    H    VAL 125           H        VAL 125   7.577  24.680 -14.484
  927    HA   VAL 125           HA       VAL 125   5.144  24.675 -16.213
  928    HB   VAL 125           HB       VAL 125   5.515  26.688 -13.969
  929   HG11  VAL 125          HG11      VAL 125   3.117  27.167 -14.419
  930   HG12  VAL 125          HG12      VAL 125   4.117  27.491 -15.832
  931   HG13  VAL 125          HG13      VAL 125   3.138  26.005 -15.761
  932   HG21  VAL 125          HG21      VAL 125   3.617  25.537 -12.821
  933   HG22  VAL 125          HG22      VAL 125   3.756  24.195 -13.984
  934   HG23  VAL 125          HG23      VAL 125   5.078  24.562 -12.854
  935    H    CYS 126           H        CYS 126   5.163  26.018 -17.920
  936    HA   CYS 126           HA       CYS 126   7.424  27.966 -18.227
  937    HB2  CYS 126           HB2      CYS 126   7.494  25.970 -19.776
  938    HB3  CYS 126           HB3      CYS 126   5.904  26.409 -20.355
  939    HG   CYS 126           HG       CYS 126   7.376  27.242 -22.201
  940    H    SER 127           H        SER 127   6.722  30.010 -18.028
  941    HA   SER 127           HA       SER 127   3.990  30.877 -18.548
  942    HB2  SER 127           HB2      SER 127   4.964  33.111 -17.995
  943    HB3  SER 127           HB3      SER 127   5.287  31.877 -16.763
  944    HG   SER 127           HG       SER 127   7.165  33.095 -17.307
  945    H    GLY 128           H        GLY 128   6.666  30.354 -20.604
  946    HA2  GLY 128           HA2      GLY 128   6.044  30.739 -23.037
  947    HA3  GLY 128           HA3      GLY 128   5.819  32.431 -22.600
  948    H    SER 129           H        SER 129   8.435  31.384 -20.779
  949    HA   SER 129           HA       SER 129  10.504  31.754 -22.839
  950    HB2  SER 129           HB2      SER 129  11.478  33.723 -21.776
  951    HB3  SER 129           HB3      SER 129   9.840  34.050 -22.359
  952    HG   SER 129           HG       SER 129  10.177  34.866 -20.247
  953    H    TRP 130           H        TRP 130  12.626  31.449 -22.169
  954    HA   TRP 130           HA       TRP 130  13.210  29.367 -20.445
  955    HB2  TRP 130           HB2      TRP 130  14.641  29.980 -22.227
  956    HB3  TRP 130           HB3      TRP 130  14.777  31.639 -21.681
  957    HD1  TRP 130           HD1      TRP 130  16.751  32.295 -20.248
  958    HE1  TRP 130           HE1      TRP 130  18.667  31.089 -19.041
  959    HE3  TRP 130           HE3      TRP 130  15.233  27.464 -20.971
  960    HZ2  TRP 130           HZ2      TRP 130  19.468  28.358 -18.494
  961    HZ3  TRP 130           HZ3      TRP 130  16.570  25.591 -20.034
  962    HH2  TRP 130           HH2      TRP 130  18.675  26.027 -18.817
  963    HA   PRO 131           HA       PRO 131  13.806  28.209 -18.929
  964    HB2  PRO 131           HB2      PRO 131  14.597  27.261 -16.564
  965    HB3  PRO 131           HB3      PRO 131  15.755  28.123 -17.613
  966    HG2  PRO 131           HG2      PRO 131  14.245  29.204 -15.229
  967    HG3  PRO 131           HG3      PRO 131  15.983  29.379 -15.641
  968    HD2  PRO 131           HD2      PRO 131  14.006  31.273 -16.248
  969    HD3  PRO 131           HD3      PRO 131  15.545  31.100 -17.137
  970    H    LEU 132           H        LEU 132  12.574  26.374 -17.616
  971    HA   LEU 132           HA       LEU 132   9.929  27.293 -16.829
  972    HB2  LEU 132           HB2      LEU 132  11.283  24.571 -16.993
  973    HB3  LEU 132           HB3      LEU 132   9.808  24.789 -16.063
  974    HG   LEU 132           HG       LEU 132   8.829  25.932 -18.145
  975   HD11  LEU 132          HD11      LEU 132  11.042  24.349 -19.480
  976   HD12  LEU 132          HD12      LEU 132   9.655  25.081 -20.306
  977   HD13  LEU 132          HD13      LEU 132  10.840  26.116 -19.520
  978   HD21  LEU 132          HD21      LEU 132   9.310  22.935 -18.211
  979   HD22  LEU 132          HD22      LEU 132   8.049  23.774 -17.282
  980   HD23  LEU 132          HD23      LEU 132   8.007  23.822 -19.032
  981    H    ASP 133           H        ASP 133   8.959  26.933 -14.879
  982    HA   ASP 133           HA       ASP 133  10.585  27.454 -12.454
  983    HB2  ASP 133           HB2      ASP 133   8.459  28.716 -13.033
  984    HB3  ASP 133           HB3      ASP 133   7.571  27.206 -12.817
  985    H    GLN 134           H        GLN 134   9.828  26.152 -10.485
  986    HA   GLN 134           HA       GLN 134   9.157  23.301 -11.017
  987    HB2  GLN 134           HB2      GLN 134  11.614  24.295  -9.514
  988    HB3  GLN 134           HB3      GLN 134  10.935  22.682  -9.284
  989    HG2  GLN 134           HG2      GLN 134  11.307  22.114 -11.620
  990    HG3  GLN 134           HG3      GLN 134  11.928  23.736 -11.959
  991   HE21  GLN 134          HE22      GLN 134  12.596  20.755  -9.995
  992   HE22  GLN 134          HE21      GLN 134  14.329  21.044  -9.984
  993    H    THR 135           H        THR 135   8.021  22.312  -9.395
  994    HA   THR 135           HA       THR 135   7.828  23.479  -6.683
  995    HB   THR 135           HB       THR 135   5.991  24.502  -8.052
  996    HG1  THR 135           HG1      THR 135   5.695  24.260  -5.868
  997   HG21  THR 135          HG21      THR 135   5.410  22.617  -9.545
  998   HG22  THR 135          HG22      THR 135   4.838  21.677  -8.141
  999   HG23  THR 135          HG23      THR 135   4.015  23.172  -8.619
 1000    H    LEU 136           H        LEU 136   7.108  21.937  -5.101
 1001    HA   LEU 136           HA       LEU 136   7.442  19.092  -5.826
 1002    HB2  LEU 136           HB2      LEU 136   6.960  20.613  -3.246
 1003    HB3  LEU 136           HB3      LEU 136   6.612  18.891  -3.351
 1004    HG   LEU 136           HG       LEU 136   8.930  18.405  -4.036
 1005   HD11  LEU 136          HD11      LEU 136   9.438  21.362  -3.495
 1006   HD12  LEU 136          HD12      LEU 136  10.698  20.121  -3.672
 1007   HD13  LEU 136          HD13      LEU 136   9.661  20.511  -5.042
 1008   HD21  LEU 136          HD21      LEU 136   8.243  18.302  -1.670
 1009   HD22  LEU 136          HD22      LEU 136   9.935  18.797  -1.827
 1010   HD23  LEU 136          HD23      LEU 136   8.689  20.010  -1.459
 1011    H    ALA 137           H        ALA 137   5.860  17.660  -6.068
 1012    HA   ALA 137           HA       ALA 137   3.862  17.094  -7.114
 1013    HB1  ALA 137           HB1      ALA 137   4.099  16.128  -4.858
 1014    HB2  ALA 137           HB2      ALA 137   3.203  17.498  -4.169
 1015    HB3  ALA 137           HB3      ALA 137   2.392  16.368  -5.274
 1016    H    ARG 138           H        ARG 138   3.790  19.240  -8.281
 1017    HA   ARG 138           HA       ARG 138   2.784  21.105  -9.059
 1018    HB2  ARG 138           HB2      ARG 138   0.713  20.703 -10.020
 1019    HB3  ARG 138           HB3      ARG 138   1.587  19.204 -10.010
 1020    HG2  ARG 138           HG2      ARG 138   0.263  18.298  -8.219
 1021    HG3  ARG 138           HG3      ARG 138  -0.598  19.834  -7.986
 1022    HD2  ARG 138           HD2      ARG 138  -1.659  19.670 -10.130
 1023    HD3  ARG 138           HD3      ARG 138  -0.577  18.374 -10.642
 1024    HE   ARG 138           HE       ARG 138  -1.637  16.861  -9.063
 1025   HH11  ARG 138          HH11      ARG 138  -3.694  19.687  -9.797
 1026   HH12  ARG 138          HH12      ARG 138  -5.008  18.953  -8.941
 1027   HH21  ARG 138          HH21      ARG 138  -3.438  16.051  -8.135
 1028   HH22  ARG 138          HH22      ARG 138  -4.905  16.974  -8.122
 1029    H    ASP 139           H        ASP 139   3.054  21.452  -6.124
 1030    HA   ASP 139           HA       ASP 139   0.727  22.564  -5.044
 1031    HB2  ASP 139           HB2      ASP 139   2.759  21.967  -3.790
 1032    HB3  ASP 139           HB3      ASP 139   3.595  23.358  -4.475
 1033    H    THR 140           H        THR 140   3.021  24.245  -7.188
 1034    HA   THR 140           HA       THR 140   1.500  26.782  -7.027
 1035    HB   THR 140           HB       THR 140   3.097  27.604  -8.704
 1036    HG1  THR 140           HG1      THR 140   4.701  26.283  -9.437
 1037   HG21  THR 140          HG21      THR 140   3.764  27.759  -6.350
 1038   HG22  THR 140          HG22      THR 140   4.504  26.148  -6.437
 1039   HG23  THR 140          HG23      THR 140   5.161  27.481  -7.408
 1040    H    ARG 141           H        ARG 141   0.820  23.944  -8.631
 1041    HA   ARG 141           HA       ARG 141  -0.423  25.287 -10.996
 1042    HB2  ARG 141           HB2      ARG 141   1.862  24.453 -11.493
 1043    HB3  ARG 141           HB3      ARG 141   1.357  22.817 -11.125
 1044    HG2  ARG 141           HG2      ARG 141   0.024  24.531 -13.277
 1045    HG3  ARG 141           HG3      ARG 141   1.472  23.574 -13.574
 1046    HD2  ARG 141           HD2      ARG 141   0.242  21.508 -12.899
 1047    HD3  ARG 141           HD3      ARG 141  -1.236  22.465 -12.773
 1048    HE   ARG 141           HE       ARG 141   0.327  21.948 -15.263
 1049   HH11  ARG 141          HH21      ARG 141  -2.827  22.866 -13.851
 1050   HH12  ARG 141          HH22      ARG 141  -3.493  23.108 -15.436
 1051   HH21  ARG 141          HH11      ARG 141  -0.761  22.086 -17.192
 1052   HH22  ARG 141          HH12      ARG 141  -2.409  22.662 -17.221
 1053    HA   PRO 142           HA       PRO 142  -3.726  22.674  -9.036
 1054    HB2  PRO 142           HB2      PRO 142  -5.146  24.622 -10.862
 1055    HB3  PRO 142           HB3      PRO 142  -5.676  23.964  -9.282
 1056    HG2  PRO 142           HG2      PRO 142  -4.608  26.449  -9.426
 1057    HG3  PRO 142           HG3      PRO 142  -4.109  25.341  -8.105
 1058    HD2  PRO 142           HD2      PRO 142  -2.651  25.978 -10.679
 1059    HD3  PRO 142           HD3      PRO 142  -2.000  25.832  -9.017
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1   6.787  -5.644  -8.219
    2    H2   MET   1           H2       MET   1   6.239  -5.228  -9.702
    3    H3   MET   1           H3       MET   1   7.738  -5.861  -9.528
    4    HA   MET   1           HA       MET   1   8.479  -3.949  -8.279
    5    HB2  MET   1           HB2      MET   1   8.694  -4.049 -10.789
    6    HB3  MET   1           HB3      MET   1   7.231  -3.078 -10.928
    7    HG2  MET   1           HG2      MET   1   9.737  -2.217  -9.417
    8    HG3  MET   1           HG3      MET   1   9.452  -1.882 -11.119
    9    HE1  MET   1           HE1      MET   1  10.239   0.349  -9.026
   10    HE2  MET   1           HE2      MET   1   9.964   0.645 -10.758
   11    HE3  MET   1           HE3      MET   1   9.160   1.662  -9.544
   12    H    ALA   2           H        ALA   2   7.885  -2.514  -6.764
   13    HA   ALA   2           HA       ALA   2   5.402  -0.963  -6.947
   14    HB1  ALA   2           HB1      ALA   2   4.652  -3.117  -5.943
   15    HB2  ALA   2           HB2      ALA   2   5.884  -2.949  -4.673
   16    HB3  ALA   2           HB3      ALA   2   4.541  -1.791  -4.779
   17    H    TYR   3           H        TYR   3   5.188   0.407  -4.891
   18    HA   TYR   3           HA       TYR   3   7.447   2.058  -4.500
   19    HB2  TYR   3           HB2      TYR   3   6.037   3.169  -2.816
   20    HB3  TYR   3           HB3      TYR   3   5.193   2.863  -4.313
   21    HD1  TYR   3           HD1      TYR   3   5.487   1.810  -0.757
   22    HD2  TYR   3           HD2      TYR   3   3.239   1.457  -4.428
   23    HE1  TYR   3           HE1      TYR   3   3.639   0.684   0.477
   24    HE2  TYR   3           HE2      TYR   3   1.399   0.330  -3.193
   25    HH   TYR   3           HH       TYR   3   0.653  -0.427  -1.164
   26    H    GLY   4           H        GLY   4   8.325   2.707  -2.378
   27    HA2  GLY   4           HA2      GLY   4   8.542   1.283  -0.043
   28    HA3  GLY   4           HA3      GLY   4   9.677   0.445  -1.108
   29    H    ARG   5           H        ARG   5  10.255   3.132  -2.483
   30    HA   ARG   5           HA       ARG   5  11.687   4.668  -0.393
   31    HB2  ARG   5           HB2      ARG   5  13.193   2.839  -1.261
   32    HB3  ARG   5           HB3      ARG   5  13.064   3.540  -2.881
   33    HG2  ARG   5           HG2      ARG   5  14.124   5.601  -2.114
   34    HG3  ARG   5           HG3      ARG   5  14.065   5.047  -0.427
   35    HD2  ARG   5           HD2      ARG   5  15.641   3.224  -0.966
   36    HD3  ARG   5           HD3      ARG   5  15.701   3.779  -2.659
   37    HE   ARG   5           HE       ARG   5  16.239   5.981  -0.924
   38   HH11  ARG   5          HH11      ARG   5  17.940   3.071  -1.914
   39   HH12  ARG   5          HH12      ARG   5  19.495   3.835  -1.753
   40   HH21  ARG   5          HH21      ARG   5  18.179   6.903  -0.844
   41   HH22  ARG   5          HH22      ARG   5  19.635   5.960  -1.116
   42    H    GLU   6           H        GLU   6  12.135   6.797  -0.960
   43    HA   GLU   6           HA       GLU   6  10.998   7.846  -3.512
   44    HB2  GLU   6           HB2      GLU   6   9.570   9.407  -2.346
   45    HB3  GLU   6           HB3      GLU   6   9.169   7.754  -1.891
   46    HG2  GLU   6           HG2      GLU   6  10.445   8.033   0.237
   47    HG3  GLU   6           HG3      GLU   6  10.833   9.692  -0.218
   48    H    ASP   7           H        ASP   7  13.472   8.284  -1.054
   49    HA   ASP   7           HA       ASP   7  14.015  11.053  -1.618
   50    HB2  ASP   7           HB2      ASP   7  16.135  10.663  -0.514
   51    HB3  ASP   7           HB3      ASP   7  14.819   9.944   0.410
   52    H    VAL   8           H        VAL   8  14.995   8.042  -3.194
   53    HA   VAL   8           HA       VAL   8  16.832   9.236  -5.093
   54    HB   VAL   8           HB       VAL   8  15.113   6.744  -5.434
   55   HG11  VAL   8          HG11      VAL   8  15.922   7.550  -7.629
   56   HG12  VAL   8          HG12      VAL   8  17.567   7.711  -6.986
   57   HG13  VAL   8          HG13      VAL   8  16.817   6.110  -7.148
   58   HG21  VAL   8          HG21      VAL   8  17.170   5.517  -4.837
   59   HG22  VAL   8          HG22      VAL   8  18.016   7.055  -4.548
   60   HG23  VAL   8          HG23      VAL   8  16.658   6.569  -3.514
   61    H    ALA   9           H        ALA   9  13.271   8.613  -5.226
   62    HA   ALA   9           HA       ALA   9  12.944   9.682  -7.855
   63    HB1  ALA   9           HB1      ALA   9  10.553   9.718  -7.309
   64    HB2  ALA   9           HB2      ALA   9  11.293   8.201  -6.769
   65    HB3  ALA   9           HB3      ALA   9  10.913   9.479  -5.588
   66    H    ASN  10           H        ASN  10  12.663  11.284  -4.640
   67    HA   ASN  10           HA       ASN  10  12.078  13.925  -5.634
   68    HB2  ASN  10           HB2      ASN  10  11.796  13.153  -3.271
   69    HB3  ASN  10           HB3      ASN  10  13.548  13.039  -3.111
   70   HD21  ASN  10          HD22      ASN  10  10.807  15.272  -3.392
   71   HD22  ASN  10          HD21      ASN  10  11.740  16.680  -2.930
   72    H    THR  11           H        THR  11  15.265  12.429  -4.884
   73    HA   THR  11           HA       THR  11  16.821  14.701  -5.675
   74    HB   THR  11           HB       THR  11  17.607  11.760  -5.818
   75    HG1  THR  11           HG1      THR  11  17.008  12.190  -3.780
   76   HG21  THR  11          HG21      THR  11  19.241  13.195  -6.974
   77   HG22  THR  11          HG22      THR  11  19.275  14.309  -5.588
   78   HG23  THR  11          HG23      THR  11  19.899  12.652  -5.425
   79    H    ARG  12           H        ARG  12  15.923  11.780  -7.564
   80    HA   ARG  12           HA       ARG  12  17.054  12.679 -10.039
   81    HB2  ARG  12           HB2      ARG  12  14.984  10.593  -9.282
   82    HB3  ARG  12           HB3      ARG  12  15.362  10.919 -10.965
   83    HG2  ARG  12           HG2      ARG  12  17.470  10.099  -8.910
   84    HG3  ARG  12           HG3      ARG  12  16.585   8.990  -9.966
   85    HD2  ARG  12           HD2      ARG  12  17.362  10.517 -11.905
   86    HD3  ARG  12           HD3      ARG  12  18.545  11.168 -10.768
   87    HE   ARG  12           HE       ARG  12  18.923   8.408 -10.606
   88   HH11  ARG  12          HH11      ARG  12  18.949  10.599 -13.329
   89   HH12  ARG  12          HH12      ARG  12  20.020   9.568 -14.253
   90   HH21  ARG  12          HH21      ARG  12  20.236   7.226 -11.718
   91   HH22  ARG  12          HH22      ARG  12  20.844   7.708 -13.305
   92    H    ALA  13           H        ALA  13  13.742  13.257  -8.733
   93    HA   ALA  13           HA       ALA  13  12.689  14.392 -11.115
   94    HB1  ALA  13           HB1      ALA  13  11.111  15.513  -9.611
   95    HB2  ALA  13           HB2      ALA  13  11.323  13.817  -9.165
   96    HB3  ALA  13           HB3      ALA  13  12.116  15.087  -8.205
   97    H    ARG  14           H        ARG  14  14.350  15.978  -8.352
   98    HA   ARG  14           HA       ARG  14  14.339  18.648  -9.472
   99    HB2  ARG  14           HB2      ARG  14  16.026  17.332  -7.293
  100    HB3  ARG  14           HB3      ARG  14  16.024  19.071  -7.649
  101    HG2  ARG  14           HG2      ARG  14  13.606  19.194  -7.185
  102    HG3  ARG  14           HG3      ARG  14  13.550  17.469  -6.811
  103    HD2  ARG  14           HD2      ARG  14  15.249  19.508  -5.331
  104    HD3  ARG  14           HD3      ARG  14  13.637  18.952  -4.831
  105    HE   ARG  14           HE       ARG  14  14.454  16.845  -4.256
  106   HH11  ARG  14          HH11      ARG  14  17.197  18.811  -5.247
  107   HH12  ARG  14          HH12      ARG  14  18.305  17.785  -4.388
  108   HH21  ARG  14          HH21      ARG  14  15.828  15.725  -3.163
  109   HH22  ARG  14          HH22      ARG  14  17.551  16.031  -3.232
  110    H    GLU  15           H        GLU  15  16.836  16.140  -9.364
  111    HA   GLU  15           HA       GLU  15  18.794  17.520 -10.951
  112    HB2  GLU  15           HB2      GLU  15  18.180  14.572 -10.552
  113    HB3  GLU  15           HB3      GLU  15  19.529  15.122 -11.540
  114    HG2  GLU  15           HG2      GLU  15  19.213  15.987  -8.631
  115    HG3  GLU  15           HG3      GLU  15  20.041  14.506  -9.106
  116    H    THR  16           H        THR  16  16.103  15.366 -12.061
  117    HA   THR  16           HA       THR  16  16.631  15.600 -14.840
  118    HB   THR  16           HB       THR  16  13.940  15.287 -13.447
  119    HG1  THR  16           HG1      THR  16  15.295  13.621 -13.011
  120   HG21  THR  16          HG21      THR  16  13.143  14.278 -15.523
  121   HG22  THR  16          HG22      THR  16  13.628  15.947 -15.844
  122   HG23  THR  16          HG23      THR  16  14.697  14.603 -16.312
  123    H    ALA  17           H        ALA  17  14.663  17.718 -12.753
  124    HA   ALA  17           HA       ALA  17  13.943  19.555 -14.808
  125    HB1  ALA  17           HB1      ALA  17  14.322  19.958 -11.808
  126    HB2  ALA  17           HB2      ALA  17  13.474  21.072 -12.891
  127    HB3  ALA  17           HB3      ALA  17  12.837  19.427 -12.618
  128    H    ALA  18           H        ALA  18  16.793  19.617 -12.604
  129    HA   ALA  18           HA       ALA  18  17.900  22.037 -13.647
  130    HB1  ALA  18           HB1      ALA  18  19.961  21.258 -12.539
  131    HB2  ALA  18           HB2      ALA  18  18.544  21.028 -11.497
  132    HB3  ALA  18           HB3      ALA  18  19.253  19.636 -12.340
  133    H    ARG  19           H        ARG  19  18.410  18.616 -14.636
  134    HA   ARG  19           HA       ARG  19  20.357  19.241 -16.726
  135    HB2  ARG  19           HB2      ARG  19  18.496  16.829 -16.485
  136    HB3  ARG  19           HB3      ARG  19  19.798  17.023 -17.648
  137    HG2  ARG  19           HG2      ARG  19  20.017  16.452 -14.709
  138    HG3  ARG  19           HG3      ARG  19  20.633  15.564 -16.076
  139    HD2  ARG  19           HD2      ARG  19  22.610  16.465 -15.439
  140    HD3  ARG  19           HD3      ARG  19  22.087  17.800 -16.449
  141    HE   ARG  19           HE       ARG  19  21.858  19.122 -14.527
  142   HH11  ARG  19          HH11      ARG  19  22.172  15.792 -13.485
  143   HH12  ARG  19          HH12      ARG  19  22.195  16.227 -11.787
  144   HH21  ARG  19          HH21      ARG  19  21.882  19.580 -12.307
  145   HH22  ARG  19          HH22      ARG  19  21.780  18.251 -11.171
  146    H    PHE  20           H        PHE  20  16.816  18.723 -16.827
  147    HA   PHE  20           HA       PHE  20  16.500  19.208 -19.588
  148    HB2  PHE  20           HB2      PHE  20  14.731  18.255 -18.205
  149    HB3  PHE  20           HB3      PHE  20  14.638  19.731 -17.253
  150    HD1  PHE  20           HD2      PHE  20  14.804  19.336 -21.026
  151    HD2  PHE  20           HD1      PHE  20  12.481  20.543 -17.595
  152    HE1  PHE  20           HE2      PHE  20  13.073  20.268 -22.510
  153    HE2  PHE  20           HE1      PHE  20  10.740  21.467 -19.102
  154    HZ   PHE  20           HZ       PHE  20  11.039  21.334 -21.571
  155    H    THR  21           H        THR  21  16.524  21.594 -16.876
  156    HA   THR  21           HA       THR  21  16.044  23.890 -18.496
  157    HB   THR  21           HB       THR  21  17.721  23.763 -15.960
  158    HG1  THR  21           HG1      THR  21  15.692  22.927 -15.596
  159   HG21  THR  21          HG21      THR  21  17.959  25.950 -17.013
  160   HG22  THR  21          HG22      THR  21  16.208  26.054 -17.309
  161   HG23  THR  21          HG23      THR  21  16.843  26.109 -15.655
  162    H    ALA  22           H        ALA  22  19.214  22.312 -17.698
  163    HA   ALA  22           HA       ALA  22  20.749  24.144 -19.293
  164    HB1  ALA  22           HB1      ALA  22  22.512  22.431 -19.105
  165    HB2  ALA  22           HB2      ALA  22  21.713  22.687 -17.542
  166    HB3  ALA  22           HB3      ALA  22  21.327  21.249 -18.512
  167    H    ALA  23           H        ALA  23  19.213  21.027 -20.139
  168    HA   ALA  23           HA       ALA  23  20.111  20.922 -22.854
  169    HB1  ALA  23           HB1      ALA  23  19.201  19.010 -21.592
  170    HB2  ALA  23           HB2      ALA  23  17.590  19.764 -21.607
  171    HB3  ALA  23           HB3      ALA  23  18.347  19.255 -23.130
  172    H    LEU  24           H        LEU  24  17.322  22.563 -21.376
  173    HA   LEU  24           HA       LEU  24  16.126  23.456 -23.824
  174    HB2  LEU  24           HB2      LEU  24  15.069  23.239 -21.522
  175    HB3  LEU  24           HB3      LEU  24  15.985  24.643 -21.029
  176    HG   LEU  24           HG       LEU  24  14.780  25.891 -22.977
  177   HD11  LEU  24          HD11      LEU  24  12.634  24.879 -23.662
  178   HD12  LEU  24          HD12      LEU  24  13.975  23.800 -24.097
  179   HD13  LEU  24          HD13      LEU  24  12.970  23.435 -22.687
  180   HD21  LEU  24          HD21      LEU  24  12.746  26.227 -21.603
  181   HD22  LEU  24          HD22      LEU  24  13.158  24.786 -20.641
  182   HD23  LEU  24          HD23      LEU  24  14.199  26.220 -20.588
  183    H    GLU  25           H        GLU  25  18.624  24.910 -21.674
  184    HA   GLU  25           HA       GLU  25  18.969  27.333 -23.182
  185    HB2  GLU  25           HB2      GLU  25  19.939  26.777 -20.883
  186    HB3  GLU  25           HB3      GLU  25  21.163  25.825 -21.714
  187    HG2  GLU  25           HG2      GLU  25  21.853  27.855 -22.992
  188    HG3  GLU  25           HG3      GLU  25  20.619  28.791 -22.147
  189    H    LEU  26           H        LEU  26  20.596  24.146 -23.461
  190    HA   LEU  26           HA       LEU  26  22.161  24.602 -25.782
  191    HB2  LEU  26           HB2      LEU  26  22.517  22.623 -24.552
  192    HB3  LEU  26           HB3      LEU  26  20.816  22.240 -24.497
  193    HG   LEU  26           HG       LEU  26  20.877  21.703 -26.971
  194   HD11  LEU  26          HD11      LEU  26  23.886  21.855 -26.506
  195   HD12  LEU  26          HD12      LEU  26  23.076  21.213 -27.954
  196   HD13  LEU  26          HD13      LEU  26  22.941  22.934 -27.559
  197   HD21  LEU  26          HD21      LEU  26  21.896  19.511 -26.594
  198   HD22  LEU  26          HD22      LEU  26  22.635  20.104 -25.086
  199   HD23  LEU  26          HD23      LEU  26  20.863  20.007 -25.242
  200    H    ALA  27           H        ALA  27  18.764  23.498 -25.592
  201    HA   ALA  27           HA       ALA  27  18.243  23.463 -28.360
  202    HB1  ALA  27           HB1      ALA  27  15.884  23.615 -27.747
  203    HB2  ALA  27           HB2      ALA  27  16.743  22.506 -26.659
  204    HB3  ALA  27           HB3      ALA  27  16.301  24.133 -26.107
  205    H    ILE  28           H        ILE  28  17.981  26.317 -26.149
  206    HA   ILE  28           HA       ILE  28  17.133  28.174 -28.188
  207    HB   ILE  28           HB       ILE  28  18.719  28.672 -25.632
  208   HG12  ILE  28          HG12      ILE  28  15.761  29.147 -26.181
  209   HG13  ILE  28          HG13      ILE  28  16.369  27.675 -25.440
  210   HG21  ILE  28          HG21      ILE  28  19.032  30.568 -27.174
  211   HG22  ILE  28          HG22      ILE  28  17.282  30.642 -27.475
  212   HG23  ILE  28          HG23      ILE  28  17.948  31.042 -25.877
  213   HD11  ILE  28          HD11      ILE  28  15.571  28.991 -23.708
  214   HD12  ILE  28          HD12      ILE  28  17.340  29.006 -23.579
  215   HD13  ILE  28          HD13      ILE  28  16.483  30.427 -24.232
  216    H    ASP  29           H        ASP  29  20.412  27.304 -27.011
  217    HA   ASP  29           HA       ASP  29  21.873  28.978 -28.770
  218    HB2  ASP  29           HB2      ASP  29  22.721  27.839 -26.707
  219    HB3  ASP  29           HB3      ASP  29  22.710  26.307 -27.583
  220    H    ARG  30           H        ARG  30  20.390  25.853 -29.423
  221    HA   ARG  30           HA       ARG  30  21.738  25.684 -32.063
  222    HB2  ARG  30           HB2      ARG  30  21.657  23.673 -30.668
  223    HB3  ARG  30           HB3      ARG  30  19.887  23.725 -30.630
  224    HG2  ARG  30           HG2      ARG  30  19.790  23.412 -33.055
  225    HG3  ARG  30           HG3      ARG  30  21.553  23.525 -33.179
  226    HD2  ARG  30           HD2      ARG  30  21.778  21.404 -31.980
  227    HD3  ARG  30           HD3      ARG  30  20.006  21.297 -31.810
  228    HE   ARG  30           HE       ARG  30  20.315  21.693 -34.504
  229   HH11  ARG  30          HH11      ARG  30  21.865  19.298 -32.463
  230   HH12  ARG  30          HH12      ARG  30  22.107  18.210 -33.799
  231   HH21  ARG  30          HH21      ARG  30  20.624  20.272 -36.114
  232   HH22  ARG  30          HH22      ARG  30  21.381  18.737 -35.817
  233    H    ALA  31           H        ALA  31  18.440  26.411 -30.879
  234    HA   ALA  31           HA       ALA  31  17.132  26.205 -33.386
  235    HB1  ALA  31           HB1      ALA  31  16.614  28.083 -31.035
  236    HB2  ALA  31           HB2      ALA  31  15.469  27.742 -32.351
  237    HB3  ALA  31           HB3      ALA  31  15.961  26.445 -31.246
  238    H    THR  32           H        THR  32  19.294  28.759 -32.286
  239    HA   THR  32           HA       THR  32  18.649  30.569 -34.495
  240    HB   THR  32           HB       THR  32  19.573  31.356 -32.336
  241    HG1  THR  32           HG1      THR  32  19.795  32.694 -34.074
  242   HG21  THR  32          HG21      THR  32  22.210  30.161 -33.299
  243   HG22  THR  32          HG22      THR  32  21.980  31.240 -31.907
  244   HG23  THR  32          HG23      THR  32  21.259  29.628 -31.891
  245    H    LEU  33           H        LEU  33  20.762  27.770 -34.203
  246    HA   LEU  33           HA       LEU  33  22.235  28.569 -36.604
  247    HB2  LEU  33           HB2      LEU  33  24.019  27.327 -35.903
  248    HB3  LEU  33           HB3      LEU  33  23.336  27.964 -34.419
  249    HG   LEU  33           HG       LEU  33  22.184  25.652 -34.184
  250   HD11  LEU  33          HD11      LEU  33  23.539  23.765 -35.077
  251   HD12  LEU  33          HD12      LEU  33  22.727  24.626 -36.372
  252   HD13  LEU  33          HD13      LEU  33  24.453  24.909 -36.079
  253   HD21  LEU  33          HD21      LEU  33  25.200  25.923 -33.907
  254   HD22  LEU  33          HD22      LEU  33  23.997  26.503 -32.738
  255   HD23  LEU  33          HD23      LEU  33  24.166  24.770 -33.031
  256    H    SER  34           H        SER  34  19.893  26.162 -35.600
  257    HA   SER  34           HA       SER  34  20.340  24.443 -37.947
  258    HB2  SER  34           HB2      SER  34  18.229  24.324 -35.767
  259    HB3  SER  34           HB3      SER  34  18.502  23.096 -37.025
  260    HG   SER  34           HG       SER  34  20.469  23.999 -35.200
  261    H    GLY  35           H        GLY  35  18.551  27.313 -37.552
  262    HA2  GLY  35           HA2      GLY  35  17.425  28.466 -39.216
  263    HA3  GLY  35           HA3      GLY  35  17.479  27.039 -40.246
  264    H    GLN  36           H        GLN  36  16.138  25.953 -37.470
  265    HA   GLN  36           HA       GLN  36  13.408  26.984 -37.662
  266    HB2  GLN  36           HB2      GLN  36  13.292  25.127 -39.248
  267    HB3  GLN  36           HB3      GLN  36  14.181  24.084 -38.166
  268    HG2  GLN  36           HG2      GLN  36  12.136  24.325 -36.545
  269    HG3  GLN  36           HG3      GLN  36  11.294  24.988 -37.941
  270   HE21  GLN  36          HE22      GLN  36  12.062  22.155 -36.187
  271   HE22  GLN  36          HE21      GLN  36  11.648  21.007 -37.468
  272    HA   PRO  37           HA       PRO  37  13.657  26.514 -33.158
  273    HB2  PRO  37           HB2      PRO  37  10.990  25.163 -33.732
  274    HB3  PRO  37           HB3      PRO  37  11.413  26.186 -32.326
  275    HG2  PRO  37           HG2      PRO  37  10.142  27.324 -34.382
  276    HG3  PRO  37           HG3      PRO  37  11.601  28.141 -33.723
  277    HD2  PRO  37           HD2      PRO  37  11.342  26.471 -36.205
  278    HD3  PRO  37           HD3      PRO  37  12.291  27.959 -35.938
  279    H    VAL  38           H        VAL  38  13.942  24.975 -31.540
  280    HA   VAL  38           HA       VAL  38  14.457  22.126 -32.373
  281    HB   VAL  38           HB       VAL  38  15.855  23.905 -30.339
  282   HG11  VAL  38          HG11      VAL  38  17.456  21.976 -30.043
  283   HG12  VAL  38          HG12      VAL  38  15.874  21.706 -29.324
  284   HG13  VAL  38          HG13      VAL  38  16.284  20.937 -30.873
  285   HG21  VAL  38          HG21      VAL  38  17.813  23.573 -31.750
  286   HG22  VAL  38          HG22      VAL  38  16.932  22.449 -32.807
  287   HG23  VAL  38          HG23      VAL  38  16.507  24.166 -32.775
  288    H    GLY  39           H        GLY  39  14.082  20.496 -30.496
  289    HA2  GLY  39           HA2      GLY  39  12.207  21.449 -28.444
  290    HA3  GLY  39           HA3      GLY  39  11.481  20.489 -29.722
  291    H    ILE  40           H        ILE  40  11.055  19.640 -27.376
  292    HA   ILE  40           HA       ILE  40  12.693  17.164 -27.074
  293    HB   ILE  40           HB       ILE  40  11.618  18.741 -24.710
  294   HG12  ILE  40          HG12      ILE  40  14.210  18.874 -24.194
  295   HG13  ILE  40          HG13      ILE  40  14.379  18.762 -25.943
  296   HG21  ILE  40          HG21      ILE  40  13.463  16.318 -24.877
  297   HG22  ILE  40          HG22      ILE  40  12.979  17.150 -23.388
  298   HG23  ILE  40          HG23      ILE  40  11.772  16.303 -24.339
  299   HD11  ILE  40          HD11      ILE  40  14.334  21.098 -24.867
  300   HD12  ILE  40          HD12      ILE  40  13.258  20.870 -26.242
  301   HD13  ILE  40          HD13      ILE  40  12.594  20.839 -24.600
  302    H    HIS  41           H        HIS  41  11.545  15.376 -26.968
  303    HA   HIS  41           HA       HIS  41   8.590  15.493 -26.870
  304    HB2  HIS  41           HB2      HIS  41   9.610  14.396 -28.814
  305    HB3  HIS  41           HB3      HIS  41  10.465  13.270 -27.757
  306    HD1  HIS  41           HD1      HIS  41   8.942  11.253 -26.740
  307    HD2  HIS  41           HD2      HIS  41   6.922  14.116 -29.054
  308    HE1  HIS  41           HE1      HIS  41   6.582  10.369 -27.071
  309    H    PHE  42           H        PHE  42   7.460  14.187 -25.444
  310    HA   PHE  42           HA       PHE  42   8.886  13.003 -23.097
  311    HB2  PHE  42           HB2      PHE  42   6.732  15.144 -23.178
  312    HB3  PHE  42           HB3      PHE  42   7.100  14.215 -21.738
  313    HD1  PHE  42           HD1      PHE  42   9.283  14.406 -20.592
  314    HD2  PHE  42           HD2      PHE  42   8.259  17.006 -23.896
  315    HE1  PHE  42           HE1      PHE  42  11.049  15.994 -19.893
  316    HE2  PHE  42           HE2      PHE  42  10.029  18.581 -23.171
  317    HZ   PHE  42           HZ       PHE  42  11.414  18.086 -21.174
  318    H    SER  43           H        SER  43   7.851  11.344 -22.085
  319    HA   SER  43           HA       SER  43   5.273  10.293 -23.139
  320    HB2  SER  43           HB2      SER  43   6.270   8.147 -23.622
  321    HB3  SER  43           HB3      SER  43   7.208   9.376 -24.475
  322    HG   SER  43           HG       SER  43   8.656   9.320 -22.632
  323    H    ASP  44           H        ASP  44   4.777   8.121 -21.863
  324    HA   ASP  44           HA       ASP  44   4.252   8.811 -19.201
  325    HB2  ASP  44           HB2      ASP  44   3.095   7.081 -20.519
  326    HB3  ASP  44           HB3      ASP  44   4.526   6.051 -20.442
  327    H    SER  45           H        SER  45   7.168   7.179 -20.413
  328    HA   SER  45           HA       SER  45   8.310   7.127 -17.648
  329    HB2  SER  45           HB2      SER  45   9.126   4.857 -18.086
  330    HB3  SER  45           HB3      SER  45   7.361   4.945 -18.191
  331    HG   SER  45           HG       SER  45   8.277   3.770 -19.938
  332    H    ALA  46           H        ALA  46   8.881   8.399 -20.656
  333    HA   ALA  46           HA       ALA  46  11.731   8.795 -20.079
  334    HB1  ALA  46           HB1      ALA  46  12.466   7.966 -22.323
  335    HB2  ALA  46           HB2      ALA  46  11.758   6.669 -21.354
  336    HB3  ALA  46           HB3      ALA  46  10.810   7.422 -22.653
  337    H    TRP  47           H        TRP  47  12.729  10.146 -21.881
  338    HA   TRP  47           HA       TRP  47  10.947  11.977 -23.347
  339    HB2  TRP  47           HB2      TRP  47  12.237  13.937 -22.497
  340    HB3  TRP  47           HB3      TRP  47  11.336  13.137 -21.214
  341    HD1  TRP  47           HD1      TRP  47  12.659  12.033 -19.270
  342    HE1  TRP  47           HE1      TRP  47  15.080  11.695 -18.633
  343    HE3  TRP  47           HE3      TRP  47  14.813  14.062 -23.449
  344    HZ2  TRP  47           HZ2      TRP  47  17.709  12.130 -19.906
  345    HZ3  TRP  47           HZ3      TRP  47  17.276  13.986 -23.748
  346    HH2  TRP  47           HH2      TRP  47  18.724  12.990 -22.000
  347    H    ARG  48           H        ARG  48  12.205  13.115 -25.048
  348    HA   ARG  48           HA       ARG  48  15.032  12.506 -25.332
  349    HB2  ARG  48           HB2      ARG  48  15.019  11.464 -27.492
  350    HB3  ARG  48           HB3      ARG  48  14.078  10.482 -26.372
  351    HG2  ARG  48           HG2      ARG  48  11.984  11.211 -27.358
  352    HG3  ARG  48           HG3      ARG  48  12.826  12.376 -28.412
  353    HD2  ARG  48           HD2      ARG  48  14.037  10.600 -29.523
  354    HD3  ARG  48           HD3      ARG  48  13.351   9.380 -28.432
  355    HE   ARG  48           HE       ARG  48  11.198  10.721 -29.710
  356   HH11  ARG  48          HH11      ARG  48  13.829   8.586 -30.647
  357   HH12  ARG  48          HH12      ARG  48  12.852   7.786 -31.855
  358   HH21  ARG  48          HH21      ARG  48  10.055   9.706 -31.336
  359   HH22  ARG  48          HH22      ARG  48  10.804   8.449 -32.268
  360    H    ILE  49           H        ILE  49  16.166  13.747 -26.788
  361    HA   ILE  49           HA       ILE  49  14.974  16.367 -27.370
  362    HB   ILE  49           HB       ILE  49  17.712  15.313 -28.154
  363   HG12  ILE  49          HG12      ILE  49  17.559  15.031 -25.768
  364   HG13  ILE  49          HG13      ILE  49  18.636  16.352 -26.159
  365   HG21  ILE  49          HG21      ILE  49  17.198  17.349 -29.354
  366   HG22  ILE  49          HG22      ILE  49  16.577  18.133 -27.889
  367   HG23  ILE  49          HG23      ILE  49  18.306  17.775 -28.052
  368   HD11  ILE  49          HD11      ILE  49  16.872  17.996 -25.530
  369   HD12  ILE  49          HD12      ILE  49  15.779  16.646 -25.134
  370   HD13  ILE  49          HD13      ILE  49  17.265  16.887 -24.206
  371    H    MET  50           H        MET  50  14.536  17.271 -29.381
  372    HA   MET  50           HA       MET  50  14.810  15.623 -31.840
  373    HB2  MET  50           HB2      MET  50  12.253  16.852 -30.747
  374    HB3  MET  50           HB3      MET  50  12.480  16.563 -32.478
  375    HG2  MET  50           HG2      MET  50  12.856  14.204 -32.113
  376    HG3  MET  50           HG3      MET  50  12.767  14.407 -30.366
  377    HE1  MET  50           HE1      MET  50   9.217  14.318 -33.354
  378    HE2  MET  50           HE2      MET  50  10.516  15.516 -33.518
  379    HE3  MET  50           HE3      MET  50  10.880  13.784 -33.691
  380    H    VAL  51           H        VAL  51  14.957  16.771 -33.734
  381    HA   VAL  51           HA       VAL  51  15.514  19.692 -33.550
  382    HB   VAL  51           HB       VAL  51  17.685  19.264 -34.769
  383   HG11  VAL  51          HG11      VAL  51  17.630  19.852 -32.402
  384   HG12  VAL  51          HG12      VAL  51  17.502  18.137 -31.956
  385   HG13  VAL  51          HG13      VAL  51  18.960  18.739 -32.760
  386   HG21  VAL  51          HG21      VAL  51  17.239  16.944 -35.517
  387   HG22  VAL  51          HG22      VAL  51  18.766  17.119 -34.651
  388   HG23  VAL  51          HG23      VAL  51  17.369  16.388 -33.833
  389    HA   PRO  52           HA       PRO  52  13.784  20.151 -37.532
  390    HB2  PRO  52           HB2      PRO  52  16.442  21.287 -38.435
  391    HB3  PRO  52           HB3      PRO  52  14.787  21.883 -38.784
  392    HG2  PRO  52           HG2      PRO  52  16.208  23.049 -36.809
  393    HG3  PRO  52           HG3      PRO  52  14.505  22.597 -36.493
  394    HD2  PRO  52           HD2      PRO  52  16.995  21.114 -35.693
  395    HD3  PRO  52           HD3      PRO  52  15.523  21.474 -34.735
  396    H    GLY  53           H        GLY  53  13.495  19.129 -39.428
  397    HA2  GLY  53           HA2      GLY  53  14.990  16.692 -40.014
  398    HA3  GLY  53           HA3      GLY  53  13.576  17.302 -40.861
  399    H    LYS  54           H        LYS  54  14.583  16.632 -42.812
  400    HA   LYS  54           HA       LYS  54  17.123  17.165 -43.750
  401    HB2  LYS  54           HB2      LYS  54  16.348  16.530 -45.906
  402    HB3  LYS  54           HB3      LYS  54  15.424  15.599 -44.729
  403    HG2  LYS  54           HG2      LYS  54  13.512  17.209 -44.997
  404    HG3  LYS  54           HG3      LYS  54  14.465  18.107 -46.192
  405    HD2  LYS  54           HD2      LYS  54  14.585  16.044 -47.606
  406    HD3  LYS  54           HD3      LYS  54  13.474  15.248 -46.464
  407    HE2  LYS  54           HE2      LYS  54  11.810  17.066 -46.845
  408    HE3  LYS  54           HE3      LYS  54  12.929  17.864 -47.954
  409    HZ1  LYS  54           HZ1      LYS  54  11.298  16.517 -49.162
  410    HZ2  LYS  54           HZ2      LYS  54  12.784  15.902 -49.408
  411    HZ3  LYS  54           HZ3      LYS  54  11.752  15.161 -48.384
  412    H    THR  55           H        THR  55  14.668  19.601 -43.557
  413    HA   THR  55           HA       THR  55  16.442  21.550 -44.877
  414    HB   THR  55           HB       THR  55  15.076  20.797 -46.715
  415    HG1  THR  55           HG1      THR  55  14.518  22.765 -47.337
  416   HG21  THR  55          HG21      THR  55  13.011  20.029 -45.486
  417   HG22  THR  55          HG22      THR  55  12.597  21.732 -45.195
  418   HG23  THR  55          HG23      THR  55  12.675  21.106 -46.849
  419    HA   PRO  56           HA       PRO  56  14.455  24.145 -41.706
  420    HB2  PRO  56           HB2      PRO  56  15.691  26.504 -42.193
  421    HB3  PRO  56           HB3      PRO  56  16.590  25.100 -41.540
  422    HG2  PRO  56           HG2      PRO  56  16.418  26.016 -44.432
  423    HG3  PRO  56           HG3      PRO  56  17.888  25.620 -43.485
  424    HD2  PRO  56           HD2      PRO  56  16.643  23.814 -45.149
  425    HD3  PRO  56           HD3      PRO  56  17.488  23.313 -43.657
  426    H    SER  57           H        SER  57  14.115  24.350 -45.140
  427    HA   SER  57           HA       SER  57  12.763  26.819 -45.481
  428    HB2  SER  57           HB2      SER  57  13.862  25.379 -47.230
  429    HB3  SER  57           HB3      SER  57  12.458  24.297 -47.151
  430    HG   SER  57           HG       SER  57  12.304  25.883 -48.823
  431    H    ALA  58           H        ALA  58  11.522  23.759 -44.317
  432    HA   ALA  58           HA       ALA  58   8.888  24.955 -43.797
  433    HB1  ALA  58           HB1      ALA  58   8.617  23.897 -46.027
  434    HB2  ALA  58           HB2      ALA  58   9.234  22.361 -45.379
  435    HB3  ALA  58           HB3      ALA  58   7.693  23.022 -44.793
  436    H    TRP  59           H        TRP  59   7.674  23.750 -42.239
  437    HA   TRP  59           HA       TRP  59   9.032  22.804 -39.967
  438    HB2  TRP  59           HB2      TRP  59   6.817  23.697 -39.864
  439    HB3  TRP  59           HB3      TRP  59   6.196  22.489 -40.976
  440    HD1  TRP  59           HD1      TRP  59   5.542  20.152 -40.068
  441    HE1  TRP  59           HE1      TRP  59   4.931  19.298 -37.729
  442    HE3  TRP  59           HE3      TRP  59   7.679  23.873 -37.259
  443    HZ2  TRP  59           HZ2      TRP  59   5.190  20.192 -35.005
  444    HZ3  TRP  59           HZ3      TRP  59   7.472  23.841 -34.784
  445    HH2  TRP  59           HH2      TRP  59   6.214  22.024 -33.646
  446    H    ARG  60           H        ARG  60  10.280  21.057 -39.777
  447    HA   ARG  60           HA       ARG  60   9.178  18.383 -40.298
  448    HB2  ARG  60           HB2      ARG  60  10.523  19.418 -42.403
  449    HB3  ARG  60           HB3      ARG  60  11.928  19.009 -41.460
  450    HG2  ARG  60           HG2      ARG  60  11.340  17.302 -43.139
  451    HG3  ARG  60           HG3      ARG  60  11.319  16.624 -41.515
  452    HD2  ARG  60           HD2      ARG  60   9.431  15.930 -43.119
  453    HD3  ARG  60           HD3      ARG  60   8.972  16.415 -41.494
  454    HE   ARG  60           HE       ARG  60   8.257  18.586 -42.325
  455   HH11  ARG  60          HH11      ARG  60   8.676  16.284 -44.943
  456   HH12  ARG  60          HH12      ARG  60   7.740  17.273 -46.027
  457   HH21  ARG  60          HH21      ARG  60   7.155  19.724 -43.666
  458   HH22  ARG  60          HH22      ARG  60   6.869  19.200 -45.311
  459    H    TRP  61           H        TRP  61  10.326  16.696 -39.158
  460    HA   TRP  61           HA       TRP  61  12.286  17.629 -37.098
  461    HB2  TRP  61           HB2      TRP  61   9.578  16.316 -36.633
  462    HB3  TRP  61           HB3      TRP  61  10.851  16.408 -35.429
  463    HD1  TRP  61           HD1      TRP  61   8.015  18.384 -36.788
  464    HE1  TRP  61           HE1      TRP  61   7.864  20.657 -35.589
  465    HE3  TRP  61           HE3      TRP  61  12.492  18.292 -34.333
  466    HZ2  TRP  61           HZ2      TRP  61   9.475  22.217 -33.774
  467    HZ3  TRP  61           HZ3      TRP  61  13.167  20.188 -32.877
  468    HH2  TRP  61           HH2      TRP  61  11.676  22.150 -32.606
  469    H    VAL  62           H        VAL  62  13.547  16.116 -36.153
  470    HA   VAL  62           HA       VAL  62  13.059  13.229 -36.531
  471    HB   VAL  62           HB       VAL  62  15.427  12.769 -37.016
  472   HG11  VAL  62          HG11      VAL  62  15.465  13.302 -39.362
  473   HG12  VAL  62          HG12      VAL  62  13.811  12.892 -38.882
  474   HG13  VAL  62          HG13      VAL  62  14.265  14.590 -39.144
  475   HG21  VAL  62          HG21      VAL  62  16.944  14.517 -37.862
  476   HG22  VAL  62          HG22      VAL  62  15.772  15.764 -37.389
  477   HG23  VAL  62          HG23      VAL  62  16.549  14.737 -36.158
  478    HA   PRO  63           HA       PRO  63  14.605  13.312 -32.257
  479    HB2  PRO  63           HB2      PRO  63  15.483  10.771 -31.914
  480    HB3  PRO  63           HB3      PRO  63  13.744  11.186 -32.009
  481    HG2  PRO  63           HG2      PRO  63  15.529  10.136 -34.226
  482    HG3  PRO  63           HG3      PRO  63  13.905   9.550 -33.746
  483    HD2  PRO  63           HD2      PRO  63  14.262  11.284 -35.812
  484    HD3  PRO  63           HD3      PRO  63  12.840  11.405 -34.737
  485    H    LEU  64           H        LEU  64  16.560  13.660 -31.234
  486    HA   LEU  64           HA       LEU  64  18.840  14.013 -32.986
  487    HB2  LEU  64           HB2      LEU  64  18.182  15.661 -31.260
  488    HB3  LEU  64           HB3      LEU  64  18.585  14.492 -30.001
  489    HG   LEU  64           HG       LEU  64  20.954  14.615 -30.536
  490   HD11  LEU  64          HD11      LEU  64  20.167  16.395 -32.871
  491   HD12  LEU  64          HD12      LEU  64  21.828  16.100 -32.301
  492   HD13  LEU  64          HD13      LEU  64  20.889  14.768 -32.976
  493   HD21  LEU  64          HD21      LEU  64  21.402  16.975 -30.091
  494   HD22  LEU  64          HD22      LEU  64  19.734  17.398 -30.540
  495   HD23  LEU  64          HD23      LEU  64  20.054  16.384 -29.112
  496    H    GLN  65           H        GLN  65  18.481  11.515 -33.268
  497    HA   GLN  65           HA       GLN  65  20.289   9.962 -31.438
  498    HB2  GLN  65           HB2      GLN  65  17.523   9.204 -32.465
  499    HB3  GLN  65           HB3      GLN  65  18.628   8.068 -31.686
  500    HG2  GLN  65           HG2      GLN  65  18.708   9.561 -29.668
  501    HG3  GLN  65           HG3      GLN  65  17.475  10.580 -30.405
  502   HE21  GLN  65          HE22      GLN  65  18.030   7.655 -28.554
  503   HE22  GLN  65          HE21      GLN  65  16.320   7.296 -28.403
  504    H    GLU  66           H        GLU  66  20.563  11.139 -34.291
  505    HA   GLU  66           HA       GLU  66  21.057   8.925 -36.061
  506    HB2  GLU  66           HB2      GLU  66  22.334  11.689 -35.955
  507    HB3  GLU  66           HB3      GLU  66  22.476  10.539 -37.291
  508    HG2  GLU  66           HG2      GLU  66  19.981  10.586 -37.556
  509    HG3  GLU  66           HG3      GLU  66  19.897  11.843 -36.319
  510    H    ASP  67           H        ASP  67  22.911  10.203 -33.384
  511    HA   ASP  67           HA       ASP  67  24.680   7.862 -33.513
  512    HB2  ASP  67           HB2      ASP  67  25.915   9.579 -34.833
  513    HB3  ASP  67           HB3      ASP  67  25.824  10.691 -33.468
  514    H    ALA  68           H        ALA  68  23.775  10.815 -31.684
  515    HA   ALA  68           HA       ALA  68  24.589   9.818 -29.107
  516    HB1  ALA  68           HB1      ALA  68  23.326  11.791 -28.307
  517    HB2  ALA  68           HB2      ALA  68  24.383  12.209 -29.665
  518    HB3  ALA  68           HB3      ALA  68  22.636  12.012 -29.927
  519    H    ALA  69           H        ALA  69  22.991   7.853 -30.536
  520    HA   ALA  69           HA       ALA  69  20.273   7.817 -30.116
  521    HB1  ALA  69           HB1      ALA  69  22.177   5.451 -30.238
  522    HB2  ALA  69           HB2      ALA  69  20.432   5.407 -30.570
  523    HB3  ALA  69           HB3      ALA  69  21.509   6.334 -31.630
  524    H    ASP  70           H        ASP  70  22.711   6.686 -27.823
  525    HA   ASP  70           HA       ASP  70  20.628   5.822 -25.885
  526    HB2  ASP  70           HB2      ASP  70  22.461   4.283 -26.681
  527    HB3  ASP  70           HB3      ASP  70  23.631   5.341 -25.895
  528    H    GLU  71           H        GLU  71  21.802   8.700 -26.466
  529    HA   GLU  71           HA       GLU  71  22.368   9.463 -23.611
  530    HB2  GLU  71           HB2      GLU  71  23.749  10.463 -26.132
  531    HB3  GLU  71           HB3      GLU  71  23.981  11.115 -24.505
  532    HG2  GLU  71           HG2      GLU  71  24.794   8.878 -23.744
  533    HG3  GLU  71           HG3      GLU  71  24.654   8.278 -25.399
  534    H    SER  72           H        SER  72  21.052  10.531 -26.737
  535    HA   SER  72           HA       SER  72  19.926  13.005 -25.735
  536    HB2  SER  72           HB2      SER  72  19.352  11.343 -28.211
  537    HB3  SER  72           HB3      SER  72  18.668  12.951 -27.910
  538    HG   SER  72           HG       SER  72  20.637  12.754 -29.183
  539    H    GLN  73           H        GLN  73  19.056  10.121 -24.571
  540    HA   GLN  73           HA       GLN  73  16.322  11.014 -24.041
  541    HB2  GLN  73           HB2      GLN  73  15.248   8.943 -24.600
  542    HB3  GLN  73           HB3      GLN  73  16.110   9.509 -26.031
  543    HG2  GLN  73           HG2      GLN  73  17.802   7.810 -25.772
  544    HG3  GLN  73           HG3      GLN  73  17.238   7.415 -24.148
  545   HE21  GLN  73          HE22      GLN  73  16.034   5.627 -23.958
  546   HE22  GLN  73          HE21      GLN  73  15.059   4.941 -25.263
  547    H    ASN  74           H        ASN  74  15.374  10.081 -22.267
  548    HA   ASN  74           HA       ASN  74  15.237   9.604 -20.084
  549    HB2  ASN  74           HB2      ASN  74  14.882   7.327 -19.810
  550    HB3  ASN  74           HB3      ASN  74  14.635   7.633 -21.521
  551   HD21  ASN  74          HD22      ASN  74  17.126   6.498 -19.196
  552   HD22  ASN  74          HD21      ASN  74  17.815   5.322 -20.317
  553    H    ASP  75           H        ASP  75  18.526   9.824 -20.712
  554    HA   ASP  75           HA       ASP  75  19.709   8.374 -18.650
  555    HB2  ASP  75           HB2      ASP  75  20.851   9.471 -20.551
  556    HB3  ASP  75           HB3      ASP  75  20.557  11.050 -19.823
  557    H    TRP  76           H        TRP  76  18.039  11.430 -18.315
  558    HA   TRP  76           HA       TRP  76  19.273  12.365 -15.911
  559    HB2  TRP  76           HB2      TRP  76  16.535  13.035 -17.048
  560    HB3  TRP  76           HB3      TRP  76  17.463  13.980 -15.897
  561    HD1  TRP  76           HD1      TRP  76  20.230  13.472 -17.807
  562    HE1  TRP  76           HE1      TRP  76  20.539  14.989 -19.839
  563    HE3  TRP  76           HE3      TRP  76  15.413  15.186 -18.305
  564    HZ2  TRP  76           HZ2      TRP  76  18.913  16.658 -21.520
  565    HZ3  TRP  76           HZ3      TRP  76  14.821  16.697 -20.171
  566    HH2  TRP  76           HH2      TRP  76  16.552  17.433 -21.792
  567    H    ASP  77           H        ASP  77  16.879   9.923 -16.348
  568    HA   ASP  77           HA       ASP  77  16.081   9.996 -13.473
  569    HB2  ASP  77           HB2      ASP  77  13.801   9.479 -14.267
  570    HB3  ASP  77           HB3      ASP  77  14.378  11.064 -14.750
  571    H    GLU  78           H        GLU  78  15.478   8.075 -12.481
  572    HA   GLU  78           HA       GLU  78  15.633   5.519 -13.997
  573    HB2  GLU  78           HB2      GLU  78  17.162   4.496 -12.519
  574    HB3  GLU  78           HB3      GLU  78  17.878   6.042 -12.960
  575    HG2  GLU  78           HG2      GLU  78  17.000   6.986 -10.785
  576    HG3  GLU  78           HG3      GLU  78  16.459   5.373 -10.336
  577    H    GLU  79           H        GLU  79  13.894   7.371 -11.805
  578    HA   GLU  79           HA       GLU  79  12.378   5.047 -10.727
  579    HB2  GLU  79           HB2      GLU  79  14.327   5.973  -9.230
  580    HB3  GLU  79           HB3      GLU  79  13.293   7.367  -8.987
  581    HG2  GLU  79           HG2      GLU  79  13.046   5.897  -7.124
  582    HG3  GLU  79           HG3      GLU  79  11.542   5.809  -8.015
  583    H    LEU  80           H        LEU  80  11.867   7.268 -12.772
  584    HA   LEU  80           HA       LEU  80   9.522   8.596 -11.488
  585    HB2  LEU  80           HB2      LEU  80  11.670   9.773 -13.286
  586    HB3  LEU  80           HB3      LEU  80  10.103  10.515 -13.117
  587    HG   LEU  80           HG       LEU  80  11.674  11.691 -11.795
  588   HD11  LEU  80          HD11      LEU  80   9.869  10.106  -9.913
  589   HD12  LEU  80          HD12      LEU  80  10.541  11.716  -9.635
  590   HD13  LEU  80          HD13      LEU  80   9.339  11.472 -10.917
  591   HD21  LEU  80          HD21      LEU  80  12.874  10.901  -9.968
  592   HD22  LEU  80          HD22      LEU  80  12.142   9.299 -10.025
  593   HD23  LEU  80          HD23      LEU  80  13.251   9.818 -11.326
  594    H    SER  81           H        SER  81   7.832   9.156 -12.712
  595    HA   SER  81           HA       SER  81   7.586   8.257 -15.554
  596    HB2  SER  81           HB2      SER  81   5.474   8.181 -13.355
  597    HB3  SER  81           HB3      SER  81   5.182   7.849 -15.071
  598    HG   SER  81           HG       SER  81   5.497   5.914 -13.955
  599    H    ILE  82           H        ILE  82   6.397   9.733 -16.879
  600    HA   ILE  82           HA       ILE  82   6.253  12.504 -15.754
  601    HB   ILE  82           HB       ILE  82   7.689  11.357 -18.097
  602   HG12  ILE  82          HG12      ILE  82   9.172  13.329 -17.716
  603   HG13  ILE  82          HG13      ILE  82   8.112  13.868 -16.417
  604   HG21  ILE  82          HG21      ILE  82   6.042  12.684 -19.337
  605   HG22  ILE  82          HG22      ILE  82   6.436  14.121 -18.354
  606   HG23  ILE  82          HG23      ILE  82   7.641  13.390 -19.428
  607   HD11  ILE  82          HD11      ILE  82   8.750  11.966 -15.049
  608   HD12  ILE  82          HD12      ILE  82   9.598  11.203 -16.422
  609   HD13  ILE  82          HD13      ILE  82  10.222  12.698 -15.700
  610    H    HIS  83           H        HIS  83   4.734  13.897 -16.471
  611    HA   HIS  83           HA       HIS  83   2.679  13.053 -18.447
  612    HB2  HIS  83           HB2      HIS  83   2.056  14.275 -15.723
  613    HB3  HIS  83           HB3      HIS  83   0.889  13.913 -16.989
  614    HD1  HIS  83           HD1      HIS  83   0.230  11.277 -17.278
  615    HD2  HIS  83           HD2      HIS  83   2.964  12.223 -14.223
  616    HE1  HIS  83           HE1      HIS  83   0.417   9.198 -15.817
  617    H    LEU  84           H        LEU  84   1.706  14.907 -19.543
  618    HA   LEU  84           HA       LEU  84   2.871  17.566 -19.021
  619    HB2  LEU  84           HB2      LEU  84   4.241  15.905 -20.607
  620    HB3  LEU  84           HB3      LEU  84   3.080  16.416 -21.819
  621    HG   LEU  84           HG       LEU  84   4.681  18.376 -20.140
  622   HD11  LEU  84          HD11      LEU  84   6.274  16.858 -21.193
  623   HD12  LEU  84          HD12      LEU  84   5.515  17.131 -22.780
  624   HD13  LEU  84          HD13      LEU  84   6.364  18.452 -21.942
  625   HD21  LEU  84          HD21      LEU  84   4.506  19.748 -22.334
  626   HD22  LEU  84          HD22      LEU  84   3.286  18.569 -22.849
  627   HD23  LEU  84          HD23      LEU  84   3.033  19.581 -21.405
  628    H    GLN  85           H        GLN  85   1.704  19.263 -19.842
  629    HA   GLN  85           HA       GLN  85  -0.616  18.844 -21.610
  630    HB2  GLN  85           HB2      GLN  85  -2.199  19.939 -20.080
  631    HB3  GLN  85           HB3      GLN  85  -1.553  18.463 -19.403
  632    HG2  GLN  85           HG2      GLN  85  -1.349  19.695 -17.533
  633    HG3  GLN  85           HG3      GLN  85   0.175  20.212 -18.228
  634   HE21  GLN  85          HE22      GLN  85   0.084  22.388 -19.487
  635   HE22  GLN  85          HE21      GLN  85  -1.109  23.554 -18.932
  636    HA   PRO  86           HA       PRO  86  -2.436  20.424 -22.210
  637    HB2  PRO  86           HB2      PRO  86  -3.082  21.965 -24.328
  638    HB3  PRO  86           HB3      PRO  86  -3.046  22.624 -22.666
  639    HG2  PRO  86           HG2      PRO  86  -0.858  22.795 -24.773
  640    HG3  PRO  86           HG3      PRO  86  -1.575  24.133 -23.816
  641    HD2  PRO  86           HD2      PRO  86   0.739  22.879 -23.065
  642    HD3  PRO  86           HD3      PRO  86  -0.444  23.473 -21.866
  643    H    PHE  87           H        PHE  87   0.471  20.395 -24.098
  644    HA   PHE  87           HA       PHE  87  -0.405  19.277 -26.537
  645    HB2  PHE  87           HB2      PHE  87   2.249  19.048 -25.070
  646    HB3  PHE  87           HB3      PHE  87   1.981  18.530 -26.727
  647    HD1  PHE  87           HD2      PHE  87   1.548  20.131 -28.544
  648    HD2  PHE  87           HD1      PHE  87   2.512  21.432 -24.541
  649    HE1  PHE  87           HE2      PHE  87   2.174  22.373 -29.416
  650    HE2  PHE  87           HE1      PHE  87   3.119  23.668 -25.414
  651    HZ   PHE  87           HZ       PHE  87   2.980  24.130 -27.858
  652    H    LYS  88           H        LYS  88  -0.614  17.298 -27.305
  653    HA   LYS  88           HA       LYS  88  -1.243  15.006 -25.744
  654    HB2  LYS  88           HB2      LYS  88  -1.345  13.818 -27.862
  655    HB3  LYS  88           HB3      LYS  88  -2.156  15.377 -27.931
  656    HG2  LYS  88           HG2      LYS  88   0.010  16.283 -29.045
  657    HG3  LYS  88           HG3      LYS  88   0.478  14.581 -29.212
  658    HD2  LYS  88           HD2      LYS  88  -1.599  14.138 -30.491
  659    HD3  LYS  88           HD3      LYS  88  -2.031  15.861 -30.352
  660    HE2  LYS  88           HE2      LYS  88   0.076  16.482 -31.510
  661    HE3  LYS  88           HE3      LYS  88   0.518  14.781 -31.645
  662    HZ1  LYS  88           HZ1      LYS  88  -1.882  16.021 -32.899
  663    HZ2  LYS  88           HZ2      LYS  88  -0.527  15.596 -33.692
  664    HZ3  LYS  88           HZ3      LYS  88  -1.476  14.447 -33.031
  665    HA   PRO  89           HA       PRO  89   3.117  13.816 -25.091
  666    HB2  PRO  89           HB2      PRO  89   2.862  12.326 -22.873
  667    HB3  PRO  89           HB3      PRO  89   2.498  14.074 -22.836
  668    HG2  PRO  89           HG2      PRO  89   0.528  11.778 -23.152
  669    HG3  PRO  89           HG3      PRO  89   0.460  13.134 -21.981
  670    HD2  PRO  89           HD2      PRO  89  -0.855  13.154 -24.410
  671    HD3  PRO  89           HD3      PRO  89  -0.250  14.635 -23.614
  672    H    ASP  90           H        ASP  90   4.222  11.650 -24.706
  673    HA   ASP  90           HA       ASP  90   4.702   9.489 -24.941
  674    HB2  ASP  90           HB2      ASP  90   2.339   9.352 -23.859
  675    HB3  ASP  90           HB3      ASP  90   1.833   8.783 -25.454
  676    H    ASP  91           H        ASP  91   2.359  10.255 -27.539
  677    HA   ASP  91           HA       ASP  91   4.114   8.685 -29.372
  678    HB2  ASP  91           HB2      ASP  91   2.391   7.360 -30.139
  679    HB3  ASP  91           HB3      ASP  91   2.114   7.398 -28.407
  680    H    SER  92           H        SER  92   3.314  11.659 -28.989
  681    HA   SER  92           HA       SER  92   2.024  12.607 -31.333
  682    HB2  SER  92           HB2      SER  92   2.612  13.970 -29.324
  683    HB3  SER  92           HB3      SER  92   4.293  14.006 -29.894
  684    HG   SER  92           HG       SER  92   3.026  15.821 -30.595
  685    H    ASN  93           H        ASN  93   2.733  13.501 -33.260
  686    HA   ASN  93           HA       ASN  93   5.064  12.324 -34.588
  687    HB2  ASN  93           HB2      ASN  93   2.844  12.703 -35.690
  688    HB3  ASN  93           HB3      ASN  93   3.060  14.446 -35.490
  689   HD21  ASN  93          HD22      ASN  93   4.658  11.559 -36.963
  690   HD22  ASN  93          HD21      ASN  93   5.291  12.460 -38.325
  691    H    GLN  94           H        GLN  94   4.656  15.033 -32.553
  692    HA   GLN  94           HA       GLN  94   7.187  16.288 -33.523
  693    HB2  GLN  94           HB2      GLN  94   6.238  18.493 -33.170
  694    HB3  GLN  94           HB3      GLN  94   5.228  17.623 -34.309
  695    HG2  GLN  94           HG2      GLN  94   3.470  17.362 -32.724
  696    HG3  GLN  94           HG3      GLN  94   4.513  17.682 -31.342
  697   HE21  GLN  94          HE22      GLN  94   5.235  19.864 -30.875
  698   HE22  GLN  94          HE21      GLN  94   4.303  21.207 -31.532
  699    HA   PRO  95           HA       PRO  95   8.180  16.408 -29.116
  700    HB2  PRO  95           HB2      PRO  95   9.477  18.827 -28.862
  701    HB3  PRO  95           HB3      PRO  95  10.228  17.360 -29.563
  702    HG2  PRO  95           HG2      PRO  95   8.936  19.686 -31.006
  703    HG3  PRO  95           HG3      PRO  95  10.515  18.906 -31.356
  704    HD2  PRO  95           HD2      PRO  95   8.296  18.297 -32.755
  705    HD3  PRO  95           HD3      PRO  95   9.453  17.025 -32.298
  706    H    GLN  96           H        GLN  96   7.014  17.061 -27.310
  707    HA   GLN  96           HA       GLN  96   4.744  18.867 -27.578
  708    HB2  GLN  96           HB2      GLN  96   6.029  17.580 -25.119
  709    HB3  GLN  96           HB3      GLN  96   4.544  18.512 -25.111
  710    HG2  GLN  96           HG2      GLN  96   3.809  16.283 -25.129
  711    HG3  GLN  96           HG3      GLN  96   3.564  16.856 -26.777
  712   HE21  GLN  96          HE22      GLN  96   3.518  14.526 -27.352
  713   HE22  GLN  96          HE21      GLN  96   5.082  13.681 -27.527
  714    H    VAL  97           H        VAL  97   8.091  19.329 -26.599
  715    HA   VAL  97           HA       VAL  97   7.440  22.173 -25.864
  716    HB   VAL  97           HB       VAL  97   9.854  20.485 -25.086
  717   HG11  VAL  97          HG11      VAL  97  10.304  22.407 -23.531
  718   HG12  VAL  97          HG12      VAL  97  10.464  22.842 -25.231
  719   HG13  VAL  97          HG13      VAL  97   9.008  23.316 -24.338
  720   HG21  VAL  97          HG21      VAL  97   7.881  19.694 -23.887
  721   HG22  VAL  97          HG22      VAL  97   8.869  20.651 -22.785
  722   HG23  VAL  97          HG23      VAL  97   7.401  21.355 -23.504
  723    H    VAL  98           H        VAL  98   8.131  23.738 -27.171
  724    HA   VAL  98           HA       VAL  98  10.338  23.168 -29.107
  725    HB   VAL  98           HB       VAL  98   7.661  24.402 -29.805
  726   HG11  VAL  98          HG11      VAL  98   9.390  25.651 -31.002
  727   HG12  VAL  98          HG12      VAL  98  10.180  24.127 -31.492
  728   HG13  VAL  98          HG13      VAL  98   8.574  24.561 -32.118
  729   HG21  VAL  98          HG21      VAL  98   7.656  21.927 -29.795
  730   HG22  VAL  98          HG22      VAL  98   7.554  22.551 -31.441
  731   HG23  VAL  98          HG23      VAL  98   9.102  21.931 -30.830
  732    H    ILE  99           H        ILE  99  11.703  24.731 -29.502
  733    HA   ILE  99           HA       ILE  99  11.619  27.217 -27.833
  734    HB   ILE  99           HB       ILE  99  13.959  25.395 -28.582
  735   HG12  ILE  99          HG12      ILE  99  14.034  25.197 -25.961
  736   HG13  ILE  99          HG13      ILE  99  12.326  25.592 -26.038
  737   HG21  ILE  99          HG21      ILE  99  14.664  27.739 -28.324
  738   HG22  ILE  99          HG22      ILE  99  13.840  27.824 -26.745
  739   HG23  ILE  99          HG23      ILE  99  15.227  26.742 -27.005
  740   HD11  ILE  99          HD11      ILE  99  12.829  23.154 -25.913
  741   HD12  ILE  99          HD12      ILE  99  11.913  23.535 -27.349
  742   HD13  ILE  99          HD13      ILE  99  13.658  23.248 -27.478
  743    H    LEU 100           H        LEU 100  11.837  29.080 -28.894
  744    HA   LEU 100           HA       LEU 100  12.622  29.158 -31.734
  745    HB2  LEU 100           HB2      LEU 100  12.011  31.534 -29.944
  746    HB3  LEU 100           HB3      LEU 100  12.034  31.467 -31.696
  747    HG   LEU 100           HG       LEU 100   9.905  30.582 -29.770
  748   HD11  LEU 100          HD11      LEU 100   8.494  31.895 -31.256
  749   HD12  LEU 100          HD12      LEU 100   9.934  32.853 -30.868
  750   HD13  LEU 100          HD13      LEU 100   9.810  32.057 -32.440
  751   HD21  LEU 100          HD21      LEU 100  10.127  28.591 -31.264
  752   HD22  LEU 100          HD22      LEU 100   8.676  29.503 -31.679
  753   HD23  LEU 100          HD23      LEU 100  10.134  29.659 -32.685
  754    H    ALA 101           H        ALA 101  14.181  30.610 -32.514
  755    HA   ALA 101           HA       ALA 101  16.787  30.534 -31.379
  756    HB1  ALA 101           HB1      ALA 101  15.594  32.412 -33.471
  757    HB2  ALA 101           HB2      ALA 101  17.322  32.126 -33.203
  758    HB3  ALA 101           HB3      ALA 101  16.285  30.805 -33.787
  759    H    ASP 102           H        ASP 102  14.217  32.860 -30.843
  760    HA   ASP 102           HA       ASP 102  15.953  34.933 -29.687
  761    HB2  ASP 102           HB2      ASP 102  12.930  34.679 -29.985
  762    HB3  ASP 102           HB3      ASP 102  13.758  36.105 -29.368
  763    H    GLY 103           H        GLY 103  14.929  32.039 -28.405
  764    HA2  GLY 103           HA2      GLY 103  14.972  31.303 -26.213
  765    HA3  GLY 103           HA3      GLY 103  15.109  32.960 -25.619
  766    H    GLN 104           H        GLN 104  12.499  32.479 -27.818
  767    HA   GLN 104           HA       GLN 104  10.457  32.505 -25.666
  768    HB2  GLN 104           HB2      GLN 104  10.157  32.498 -28.684
  769    HB3  GLN 104           HB3      GLN 104   8.841  32.659 -27.528
  770    HG2  GLN 104           HG2      GLN 104  11.084  34.658 -28.028
  771    HG3  GLN 104           HG3      GLN 104   9.406  34.799 -28.552
  772   HE21  GLN 104          HE22      GLN 104  11.370  34.402 -25.615
  773   HE22  GLN 104          HE21      GLN 104  10.235  35.224 -24.538
  774    H    ILE 105           H        ILE 105   9.084  30.903 -25.299
  775    HA   ILE 105           HA       ILE 105   9.788  28.179 -26.326
  776    HB   ILE 105           HB       ILE 105   9.152  28.674 -23.415
  777   HG12  ILE 105          HG12      ILE 105  11.103  30.134 -23.778
  778   HG13  ILE 105          HG13      ILE 105  11.414  28.794 -22.695
  779   HG21  ILE 105          HG21      ILE 105  10.656  26.532 -24.955
  780   HG22  ILE 105          HG22      ILE 105  10.562  26.579 -23.183
  781   HG23  ILE 105          HG23      ILE 105   9.087  26.368 -24.141
  782   HD11  ILE 105          HD11      ILE 105  12.252  28.833 -25.597
  783   HD12  ILE 105          HD12      ILE 105  13.278  29.325 -24.244
  784   HD13  ILE 105          HD13      ILE 105  12.728  27.642 -24.365
  785    H    THR 106           H        THR 106   8.064  26.693 -26.390
  786    HA   THR 106           HA       THR 106   5.376  27.500 -26.617
  787    HB   THR 106           HB       THR 106   4.984  24.987 -26.020
  788    HG1  THR 106           HG1      THR 106   7.021  24.790 -24.962
  789   HG21  THR 106          HG21      THR 106   4.980  25.794 -28.310
  790   HG22  THR 106          HG22      THR 106   6.754  25.827 -28.331
  791   HG23  THR 106          HG23      THR 106   5.884  24.272 -28.204
  792    HA   PRO 107           HA       PRO 107   4.236  27.763 -22.199
  793    HB2  PRO 107           HB2      PRO 107   1.422  27.772 -23.231
  794    HB3  PRO 107           HB3      PRO 107   2.229  28.924 -22.131
  795    HG2  PRO 107           HG2      PRO 107   1.694  29.575 -24.726
  796    HG3  PRO 107           HG3      PRO 107   3.220  30.089 -23.936
  797    HD2  PRO 107           HD2      PRO 107   2.774  27.719 -25.777
  798    HD3  PRO 107           HD3      PRO 107   4.067  28.962 -25.810
  799    H    PHE 108           H        PHE 108   4.194  25.909 -20.963
  800    HA   PHE 108           HA       PHE 108   2.141  23.898 -21.238
  801    HB2  PHE 108           HB2      PHE 108   3.476  21.978 -21.674
  802    HB3  PHE 108           HB3      PHE 108   3.832  23.114 -22.945
  803    HD1  PHE 108           HD2      PHE 108   5.947  24.430 -22.852
  804    HD2  PHE 108           HD1      PHE 108   5.248  21.105 -20.240
  805    HE1  PHE 108           HE2      PHE 108   8.368  24.380 -22.312
  806    HE2  PHE 108           HE1      PHE 108   7.687  20.987 -19.752
  807    HZ   PHE 108           HZ       PHE 108   9.242  22.629 -20.773
  808    H    SER 109           H        SER 109   2.588  22.051 -19.674
  809    HA   SER 109           HA       SER 109   4.256  22.771 -17.370
  810    HB2  SER 109           HB2      SER 109   1.344  21.959 -17.030
  811    HB3  SER 109           HB3      SER 109   2.529  22.142 -15.727
  812    HG   SER 109           HG       SER 109   2.334  24.331 -17.391
  813    H    LEU 110           H        LEU 110   5.046  20.987 -16.317
  814    HA   LEU 110           HA       LEU 110   4.735  18.294 -17.597
  815    HB2  LEU 110           HB2      LEU 110   6.525  19.187 -18.778
  816    HB3  LEU 110           HB3      LEU 110   7.051  20.210 -17.448
  817    HG   LEU 110           HG       LEU 110   8.079  18.344 -16.298
  818   HD11  LEU 110          HD11      LEU 110   7.272  16.682 -18.742
  819   HD12  LEU 110          HD12      LEU 110   8.371  16.153 -17.451
  820   HD13  LEU 110          HD13      LEU 110   6.666  16.434 -17.092
  821   HD21  LEU 110          HD21      LEU 110   9.371  19.653 -17.906
  822   HD22  LEU 110          HD22      LEU 110   9.913  17.970 -17.880
  823   HD23  LEU 110          HD23      LEU 110   8.897  18.548 -19.217
  824    H    LEU 111           H        LEU 111   4.305  16.848 -16.016
  825    HA   LEU 111           HA       LEU 111   5.185  17.420 -13.218
  826    HB2  LEU 111           HB2      LEU 111   2.811  17.621 -13.595
  827    HB3  LEU 111           HB3      LEU 111   2.712  16.022 -14.314
  828    HG   LEU 111           HG       LEU 111   3.810  16.277 -11.519
  829   HD11  LEU 111          HD11      LEU 111   0.845  16.387 -12.204
  830   HD12  LEU 111          HD12      LEU 111   1.530  16.187 -10.572
  831   HD13  LEU 111          HD13      LEU 111   1.813  17.685 -11.468
  832   HD21  LEU 111          HD21      LEU 111   1.910  14.231 -12.761
  833   HD22  LEU 111          HD22      LEU 111   3.664  14.015 -12.657
  834   HD23  LEU 111          HD23      LEU 111   2.714  14.121 -11.181
  835    H    MET 112           H        MET 112   6.038  15.819 -11.982
  836    HA   MET 112           HA       MET 112   6.937  13.301 -13.332
  837    HB2  MET 112           HB2      MET 112   8.477  15.026 -11.345
  838    HB3  MET 112           HB3      MET 112   9.047  13.542 -12.117
  839    HG2  MET 112           HG2      MET 112   8.963  14.663 -14.326
  840    HG3  MET 112           HG3      MET 112   8.400  16.148 -13.548
  841    HE1  MET 112           HE1      MET 112  11.932  17.315 -14.534
  842    HE2  MET 112           HE2      MET 112  10.833  16.290 -15.487
  843    HE3  MET 112           HE3      MET 112  10.189  17.657 -14.547
  844    H    ALA 113           H        ALA 113   6.675  11.460 -12.139
  845    HA   ALA 113           HA       ALA 113   5.758  11.618  -9.295
  846    HB1  ALA 113           HB1      ALA 113   4.468  10.164 -11.658
  847    HB2  ALA 113           HB2      ALA 113   3.956  10.000  -9.972
  848    HB3  ALA 113           HB3      ALA 113   3.795  11.564 -10.795
  849    H    ASN 114           H        ASN 114   6.095   9.701  -8.046
  850    HA   ASN 114           HA       ASN 114   8.524   8.256  -8.652
  851    HB2  ASN 114           HB2      ASN 114   7.723   8.810  -6.373
  852    HB3  ASN 114           HB3      ASN 114   6.370   7.701  -6.557
  853   HD21  ASN 114          HD22      ASN 114   8.522   7.700  -4.562
  854   HD22  ASN 114          HD21      ASN 114   9.347   6.159  -4.732
  855    H    ALA 115           H        ALA 115   8.779   6.600 -10.024
  856    HA   ALA 115           HA       ALA 115   6.694   5.418 -11.504
  857    HB1  ALA 115           HB1      ALA 115   8.474   3.923 -12.345
  858    HB2  ALA 115           HB2      ALA 115   9.012   5.606 -12.271
  859    HB3  ALA 115           HB3      ALA 115   9.543   4.447 -11.026
  860    H    GLY 116           H        GLY 116   7.903   4.406  -8.351
  861    HA2  GLY 116           HA2      GLY 116   6.709   1.706  -8.506
  862    HA3  GLY 116           HA3      GLY 116   7.522   2.452  -7.129
  863    H    THR 117           H        THR 117   5.638   4.890  -7.589
  864    HA   THR 117           HA       THR 117   3.416   3.781  -5.916
  865    HB   THR 117           HB       THR 117   4.285   6.657  -5.819
  866    HG1  THR 117           HG1      THR 117   5.765   6.056  -4.182
  867   HG21  THR 117          HG21      THR 117   2.336   5.933  -4.455
  868   HG22  THR 117          HG22      THR 117   3.345   4.693  -3.680
  869   HG23  THR 117          HG23      THR 117   3.692   6.419  -3.433
  870    H    GLY 118           H        GLY 118   4.056   5.747  -8.769
  871    HA2  GLY 118           HA2      GLY 118   2.655   6.795 -10.260
  872    HA3  GLY 118           HA3      GLY 118   1.276   5.944  -9.547
  873    H    GLU 119           H        GLU 119   3.526   8.126  -7.821
  874    HA   GLU 119           HA       GLU 119   1.261   9.932  -7.152
  875    HB2  GLU 119           HB2      GLU 119   1.758   8.317  -5.395
  876    HB3  GLU 119           HB3      GLU 119   3.457   8.822  -5.373
  877    HG2  GLU 119           HG2      GLU 119   2.822  11.069  -4.682
  878    HG3  GLU 119           HG3      GLU 119   1.108  10.672  -4.837
  879    HA   PRO 120           HA       PRO 120   3.956  13.067  -8.902
  880    HB2  PRO 120           HB2      PRO 120   2.417  14.823  -6.993
  881    HB3  PRO 120           HB3      PRO 120   2.859  15.136  -8.701
  882    HG2  PRO 120           HG2      PRO 120   0.366  14.291  -8.061
  883    HG3  PRO 120           HG3      PRO 120   1.210  13.570  -9.469
  884    HD2  PRO 120           HD2      PRO 120   0.879  12.433  -6.694
  885    HD3  PRO 120           HD3      PRO 120   0.766  11.624  -8.288
  886    H    LEU 121           H        LEU 121   5.770  14.133  -8.482
  887    HA   LEU 121           HA       LEU 121   6.870  14.368  -5.711
  888    HB2  LEU 121           HB2      LEU 121   7.803  13.122  -8.234
  889    HB3  LEU 121           HB3      LEU 121   8.914  14.363  -7.730
  890    HG   LEU 121           HG       LEU 121   9.629  12.270  -6.959
  891   HD11  LEU 121          HD11      LEU 121   9.949  14.326  -5.521
  892   HD12  LEU 121          HD12      LEU 121   8.583  13.793  -4.524
  893   HD13  LEU 121          HD13      LEU 121  10.018  12.770  -4.634
  894   HD21  LEU 121          HD21      LEU 121   7.436  11.122  -6.781
  895   HD22  LEU 121          HD22      LEU 121   8.429  10.906  -5.320
  896   HD23  LEU 121          HD23      LEU 121   7.067  12.045  -5.316
  897    H    LEU 122           H        LEU 122   6.995  15.741  -8.977
  898    HA   LEU 122           HA       LEU 122   7.506  18.497  -7.992
  899    HB2  LEU 122           HB2      LEU 122   9.694  17.080  -8.232
  900    HB3  LEU 122           HB3      LEU 122   9.317  17.029  -9.951
  901    HG   LEU 122           HG       LEU 122   9.352  19.645  -9.823
  902   HD11  LEU 122          HD11      LEU 122  10.745  20.573  -8.044
  903   HD12  LEU 122          HD12      LEU 122   9.388  19.728  -7.296
  904   HD13  LEU 122          HD13      LEU 122  10.977  18.956  -7.324
  905   HD21  LEU 122          HD21      LEU 122  11.056  18.216 -10.927
  906   HD22  LEU 122          HD22      LEU 122  11.761  19.638 -10.166
  907   HD23  LEU 122          HD23      LEU 122  11.898  18.050  -9.370
  908    H    THR 123           H        THR 123   7.140  20.057  -9.651
  909    HA   THR 123           HA       THR 123   6.202  19.115 -12.295
  910    HB   THR 123           HB       THR 123   4.498  20.960 -10.570
  911    HG1  THR 123           HG1      THR 123   4.628  18.232 -10.802
  912   HG21  THR 123          HG21      THR 123   4.154  21.364 -12.952
  913   HG22  THR 123          HG22      THR 123   3.983  19.618 -13.245
  914   HG23  THR 123          HG23      THR 123   2.776  20.472 -12.273
  915    H    LEU 124           H        LEU 124   6.634  20.452 -13.874
  916    HA   LEU 124           HA       LEU 124   8.022  23.021 -13.339
  917    HB2  LEU 124           HB2      LEU 124   8.495  20.735 -15.247
  918    HB3  LEU 124           HB3      LEU 124   8.778  22.360 -15.850
  919    HG   LEU 124           HG       LEU 124  10.332  22.835 -14.015
  920   HD11  LEU 124          HD11      LEU 124  10.119  19.871 -13.306
  921   HD12  LEU 124          HD12      LEU 124  11.203  21.088 -12.575
  922   HD13  LEU 124          HD13      LEU 124   9.485  21.197 -12.313
  923   HD21  LEU 124          HD21      LEU 124  12.165  21.465 -14.855
  924   HD22  LEU 124          HD22      LEU 124  11.009  20.316 -15.575
  925   HD23  LEU 124          HD23      LEU 124  11.123  21.988 -16.181
  926    H    VAL 125           H        VAL 125   7.609  24.740 -14.688
  927    HA   VAL 125           HA       VAL 125   5.094  24.720 -16.284
  928    HB   VAL 125           HB       VAL 125   5.581  26.608 -13.945
  929   HG11  VAL 125          HG11      VAL 125   3.192  27.231 -14.297
  930   HG12  VAL 125          HG12      VAL 125   4.190  27.647 -15.684
  931   HG13  VAL 125          HG13      VAL 125   3.148  26.205 -15.745
  932   HG21  VAL 125          HG21      VAL 125   5.043  24.405 -13.017
  933   HG22  VAL 125          HG22      VAL 125   3.656  25.467 -12.852
  934   HG23  VAL 125          HG23      VAL 125   3.676  24.235 -14.141
  935    H    CYS 126           H        CYS 126   4.989  26.141 -17.933
  936    HA   CYS 126           HA       CYS 126   7.217  28.117 -18.278
  937    HB2  CYS 126           HB2      CYS 126   7.106  26.066 -19.832
  938    HB3  CYS 126           HB3      CYS 126   5.599  26.732 -20.445
  939    HG   CYS 126           HG       CYS 126   7.269  27.343 -22.211
  940    H    SER 127           H        SER 127   6.734  30.062 -19.377
  941    HA   SER 127           HA       SER 127   3.889  30.991 -19.377
  942    HB2  SER 127           HB2      SER 127   4.703  33.102 -18.407
  943    HB3  SER 127           HB3      SER 127   5.053  31.722 -17.352
  944    HG   SER 127           HG       SER 127   6.869  33.109 -17.599
  945    H    GLY 128           H        GLY 128   6.483  30.501 -21.402
  946    HA2  GLY 128           HA2      GLY 128   5.989  31.165 -23.743
  947    HA3  GLY 128           HA3      GLY 128   5.782  32.817 -23.183
  948    H    SER 129           H        SER 129   8.301  32.077 -21.339
  949    HA   SER 129           HA       SER 129  10.430  32.566 -23.377
  950    HB2  SER 129           HB2      SER 129   9.895  34.305 -20.932
  951    HB3  SER 129           HB3      SER 129  11.269  34.449 -22.039
  952    HG   SER 129           HG       SER 129   8.532  34.950 -22.549
  953    H    TRP 130           H        TRP 130  12.506  32.082 -22.753
  954    HA   TRP 130           HA       TRP 130  13.167  30.103 -20.953
  955    HB2  TRP 130           HB2      TRP 130  14.621  30.765 -22.696
  956    HB3  TRP 130           HB3      TRP 130  14.656  32.435 -22.171
  957    HD1  TRP 130           HD1      TRP 130  16.562  33.207 -20.714
  958    HE1  TRP 130           HE1      TRP 130  18.473  32.121 -19.392
  959    HE3  TRP 130           HE3      TRP 130  15.276  28.291 -21.338
  960    HZ2  TRP 130           HZ2      TRP 130  19.330  29.448 -18.672
  961    HZ3  TRP 130           HZ3      TRP 130  16.629  26.513 -20.249
  962    HH2  TRP 130           HH2      TRP 130  18.636  27.077 -18.930
  963    HA   PRO 131           HA       PRO 131  13.640  29.002 -19.359
  964    HB2  PRO 131           HB2      PRO 131  14.485  28.150 -16.983
  965    HB3  PRO 131           HB3      PRO 131  15.601  29.060 -18.035
  966    HG2  PRO 131           HG2      PRO 131  14.007  30.097 -15.687
  967    HG3  PRO 131           HG3      PRO 131  15.741  30.348 -16.074
  968    HD2  PRO 131           HD2      PRO 131  13.675  32.129 -16.753
  969    HD3  PRO 131           HD3      PRO 131  15.244  32.026 -17.601
  970    H    LEU 132           H        LEU 132  12.538  27.168 -17.955
  971    HA   LEU 132           HA       LEU 132   9.829  27.903 -17.154
  972    HB2  LEU 132           HB2      LEU 132  11.448  25.336 -17.341
  973    HB3  LEU 132           HB3      LEU 132  10.054  25.389 -16.285
  974    HG   LEU 132           HG       LEU 132   8.792  26.404 -18.344
  975   HD11  LEU 132          HD11      LEU 132   9.496  25.518 -20.493
  976   HD12  LEU 132          HD12      LEU 132  10.736  26.596 -19.849
  977   HD13  LEU 132          HD13      LEU 132  10.962  24.830 -19.762
  978   HD21  LEU 132          HD21      LEU 132   8.004  24.222 -18.933
  979   HD22  LEU 132          HD22      LEU 132   9.491  23.453 -18.309
  980   HD23  LEU 132          HD23      LEU 132   8.334  24.235 -17.216
  981    H    ASP 133           H        ASP 133   8.981  27.061 -15.112
  982    HA   ASP 133           HA       ASP 133  10.752  27.660 -12.759
  983    HB2  ASP 133           HB2      ASP 133   8.933  29.370 -13.192
  984    HB3  ASP 133           HB3      ASP 133   7.745  28.077 -12.971
  985    H    GLN 134           H        GLN 134   9.993  26.433 -10.768
  986    HA   GLN 134           HA       GLN 134   8.564  23.931 -11.350
  987    HB2  GLN 134           HB2      GLN 134  10.283  22.450 -10.584
  988    HB3  GLN 134           HB3      GLN 134  10.903  23.444 -11.908
  989    HG2  GLN 134           HG2      GLN 134  12.009  24.903 -10.150
  990    HG3  GLN 134           HG3      GLN 134  11.556  23.666  -8.962
  991   HE21  GLN 134          HE22      GLN 134  12.541  21.441  -9.247
  992   HE22  GLN 134          HE21      GLN 134  14.043  21.341 -10.155
  993    H    THR 135           H        THR 135   7.918  22.686  -9.586
  994    HA   THR 135           HA       THR 135   7.938  23.852  -6.853
  995    HB   THR 135           HB       THR 135   6.082  24.925  -8.108
  996    HG1  THR 135           HG1      THR 135   5.764  24.599  -5.947
  997   HG21  THR 135          HG21      THR 135   4.062  23.617  -8.686
  998   HG22  THR 135          HG22      THR 135   5.433  23.242  -9.730
  999   HG23  THR 135          HG23      THR 135   4.956  22.114  -8.430
 1000    H    LEU 136           H        LEU 136   7.088  22.336  -5.245
 1001    HA   LEU 136           HA       LEU 136   7.455  19.483  -5.895
 1002    HB2  LEU 136           HB2      LEU 136   6.480  20.939  -3.403
 1003    HB3  LEU 136           HB3      LEU 136   6.639  19.190  -3.523
 1004    HG   LEU 136           HG       LEU 136   8.963  21.143  -3.830
 1005   HD11  LEU 136          HD11      LEU 136   8.163  19.375  -1.481
 1006   HD12  LEU 136          HD12      LEU 136   9.627  20.379  -1.591
 1007   HD13  LEU 136          HD13      LEU 136   8.034  21.147  -1.546
 1008   HD21  LEU 136          HD21      LEU 136  10.366  19.117  -3.513
 1009   HD22  LEU 136          HD22      LEU 136   8.905  18.103  -3.542
 1010   HD23  LEU 136          HD23      LEU 136   9.403  19.005  -4.986
 1011    H    ALA 137           H        ALA 137   5.888  18.078  -6.365
 1012    HA   ALA 137           HA       ALA 137   3.911  17.552  -7.527
 1013    HB1  ALA 137           HB1      ALA 137   4.086  16.448  -5.358
 1014    HB2  ALA 137           HB2      ALA 137   3.261  17.809  -4.565
 1015    HB3  ALA 137           HB3      ALA 137   2.382  16.791  -5.721
 1016    H    ARG 138           H        ARG 138   3.738  19.695  -8.671
 1017    HA   ARG 138           HA       ARG 138   2.711  21.635  -9.344
 1018    HB2  ARG 138           HB2      ARG 138   0.515  21.214 -10.164
 1019    HB3  ARG 138           HB3      ARG 138   1.565  19.835 -10.403
 1020    HG2  ARG 138           HG2      ARG 138   0.486  18.612  -8.581
 1021    HG3  ARG 138           HG3      ARG 138  -0.536  20.022  -8.207
 1022    HD2  ARG 138           HD2      ARG 138  -1.519  19.887 -10.484
 1023    HD3  ARG 138           HD3      ARG 138  -0.434  18.555 -10.876
 1024    HE   ARG 138           HE       ARG 138  -1.765  17.075  -9.685
 1025   HH11  ARG 138          HH11      ARG 138  -2.914  20.297  -8.901
 1026   HH12  ARG 138          HH12      ARG 138  -4.320  19.682  -8.085
 1027   HH21  ARG 138          HH21      ARG 138  -3.578  16.381  -8.624
 1028   HH22  ARG 138          HH22      ARG 138  -4.679  17.533  -7.937
 1029    H    ASP 139           H        ASP 139   2.994  21.804  -6.373
 1030    HA   ASP 139           HA       ASP 139   0.678  22.849  -5.226
 1031    HB2  ASP 139           HB2      ASP 139   2.698  22.144  -4.025
 1032    HB3  ASP 139           HB3      ASP 139   3.565  23.554  -4.632
 1033    H    THR 140           H        THR 140   3.010  24.683  -7.213
 1034    HA   THR 140           HA       THR 140   1.744  27.270  -6.720
 1035    HB   THR 140           HB       THR 140   3.069  27.999  -8.721
 1036    HG1  THR 140           HG1      THR 140   4.474  26.563  -9.620
 1037   HG21  THR 140          HG21      THR 140   5.298  27.723  -7.685
 1038   HG22  THR 140          HG22      THR 140   4.068  28.191  -6.497
 1039   HG23  THR 140          HG23      THR 140   4.630  26.511  -6.571
 1040    H    ARG 141           H        ARG 141   0.890  24.644  -8.836
 1041    HA   ARG 141           HA       ARG 141  -0.022  26.252 -11.078
 1042    HB2  ARG 141           HB2      ARG 141  -0.366  23.321 -10.365
 1043    HB3  ARG 141           HB3      ARG 141  -0.974  24.061 -11.850
 1044    HG2  ARG 141           HG2      ARG 141   1.477  24.915 -12.179
 1045    HG3  ARG 141           HG3      ARG 141   1.900  23.722 -10.945
 1046    HD2  ARG 141           HD2      ARG 141   2.236  22.629 -12.990
 1047    HD3  ARG 141           HD3      ARG 141   0.694  21.983 -12.433
 1048    HE   ARG 141           HE       ARG 141   1.214  23.896 -14.669
 1049   HH11  ARG 141          HH11      ARG 141  -1.273  21.939 -13.106
 1050   HH12  ARG 141          HH12      ARG 141  -2.339  22.146 -14.463
 1051   HH21  ARG 141          HH21      ARG 141  -0.096  23.993 -16.283
 1052   HH22  ARG 141          HH22      ARG 141  -1.659  23.200 -16.271
 1053    HA   PRO 142           HA       PRO 142  -4.180  27.206  -9.848
 1054    HB2  PRO 142           HB2      PRO 142  -5.550  27.191 -12.234
 1055    HB3  PRO 142           HB3      PRO 142  -4.390  28.463 -11.748
 1056    HG2  PRO 142           HG2      PRO 142  -3.879  26.055 -13.517
 1057    HG3  PRO 142           HG3      PRO 142  -3.423  27.763 -13.809
 1058    HD2  PRO 142           HD2      PRO 142  -1.655  25.973 -12.803
 1059    HD3  PRO 142           HD3      PRO 142  -1.674  27.663 -12.226
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1   0.593   6.354   2.114
    2    H2   MET   1           H2       MET   1   0.378   7.168   0.713
    3    H3   MET   1           H3       MET   1  -0.529   5.845   1.042
    4    HA   MET   1           HA       MET   1   1.411   4.416   0.966
    5    HB2  MET   1           HB2      MET   1   0.089   4.702  -1.098
    6    HB3  MET   1           HB3      MET   1   1.049   6.113  -1.544
    7    HG2  MET   1           HG2      MET   1   1.739   4.090  -2.763
    8    HG3  MET   1           HG3      MET   1   3.041   4.765  -1.801
    9    HE1  MET   1           HE1      MET   1  -0.010   2.301  -0.857
   10    HE2  MET   1           HE2      MET   1   0.642   1.777  -2.428
   11    HE3  MET   1           HE3      MET   1   0.854   0.756  -0.990
   12    H    ALA   2           H        ALA   2   3.522   4.253   1.412
   13    HA   ALA   2           HA       ALA   2   5.457   6.270   0.522
   14    HB1  ALA   2           HB1      ALA   2   5.053   5.610   3.480
   15    HB2  ALA   2           HB2      ALA   2   6.383   6.574   2.803
   16    HB3  ALA   2           HB3      ALA   2   4.720   7.177   2.706
   17    H    TYR   3           H        TYR   3   7.593   5.510   0.553
   18    HA   TYR   3           HA       TYR   3   8.357   2.856   1.480
   19    HB2  TYR   3           HB2      TYR   3   7.148   2.140  -0.508
   20    HB3  TYR   3           HB3      TYR   3   7.884   3.397  -1.470
   21    HD1  TYR   3           HD2      TYR   3  10.023   1.320   0.808
   22    HD2  TYR   3           HD1      TYR   3   8.441   1.824  -3.180
   23    HE1  TYR   3           HE2      TYR   3  11.740  -0.232  -0.068
   24    HE2  TYR   3           HE1      TYR   3  10.144   0.220  -4.048
   25    HH   TYR   3           HH       TYR   3  12.588  -1.295  -1.914
   26    H    GLY   4           H        GLY   4  10.186   3.599   2.398
   27    HA2  GLY   4           HA2      GLY   4  11.520   5.879   2.248
   28    HA3  GLY   4           HA3      GLY   4  12.332   4.376   2.662
   29    H    ARG   5           H        ARG   5  12.206   3.343  -0.111
   30    HA   ARG   5           HA       ARG   5  14.578   4.272  -1.373
   31    HB2  ARG   5           HB2      ARG   5  13.238   2.118  -1.711
   32    HB3  ARG   5           HB3      ARG   5  12.098   3.069  -2.639
   33    HG2  ARG   5           HG2      ARG   5  14.444   3.666  -3.981
   34    HG3  ARG   5           HG3      ARG   5  14.852   2.100  -3.298
   35    HD2  ARG   5           HD2      ARG   5  13.949   1.464  -5.316
   36    HD3  ARG   5           HD3      ARG   5  12.510   1.348  -4.311
   37    HE   ARG   5           HE       ARG   5  13.153   3.342  -6.420
   38   HH11  ARG   5          HH11      ARG   5  10.708   2.618  -3.968
   39   HH12  ARG   5          HH12      ARG   5   9.640   3.830  -4.610
   40   HH21  ARG   5          HH21      ARG   5  11.863   4.663  -7.154
   41   HH22  ARG   5          HH22      ARG   5  10.276   5.004  -6.449
   42    H    GLU   6           H        GLU   6  11.383   5.667  -1.390
   43    HA   GLU   6           HA       GLU   6  11.389   7.332  -3.622
   44    HB2  GLU   6           HB2      GLU   6   9.768   8.666  -2.451
   45    HB3  GLU   6           HB3      GLU   6   9.487   6.964  -2.108
   46    HG2  GLU   6           HG2      GLU   6  10.704   7.299   0.110
   47    HG3  GLU   6           HG3      GLU   6  10.790   9.013  -0.265
   48    H    ASP   7           H        ASP   7  13.523   7.739  -0.837
   49    HA   ASP   7           HA       ASP   7  14.195  10.496  -1.281
   50    HB2  ASP   7           HB2      ASP   7  14.851   9.176   0.706
   51    HB3  ASP   7           HB3      ASP   7  15.901   8.176  -0.299
   52    H    VAL   8           H        VAL   8  15.242   7.528  -2.912
   53    HA   VAL   8           HA       VAL   8  17.250   8.823  -4.600
   54    HB   VAL   8           HB       VAL   8  15.821   6.198  -5.176
   55   HG11  VAL   8          HG11      VAL   8  18.583   7.257  -5.946
   56   HG12  VAL   8          HG12      VAL   8  17.903   5.678  -6.393
   57   HG13  VAL   8          HG13      VAL   8  17.187   7.158  -7.034
   58   HG21  VAL   8          HG21      VAL   8  18.322   6.663  -3.488
   59   HG22  VAL   8          HG22      VAL   8  16.778   5.983  -2.925
   60   HG23  VAL   8          HG23      VAL   8  17.761   5.082  -4.077
   61    H    ALA   9           H        ALA   9  13.785   7.917  -4.954
   62    HA   ALA   9           HA       ALA   9  13.525   8.866  -7.647
   63    HB1  ALA   9           HB1      ALA   9  11.139   8.763  -7.249
   64    HB2  ALA   9           HB2      ALA   9  11.900   7.354  -6.487
   65    HB3  ALA   9           HB3      ALA   9  11.378   8.736  -5.492
   66    H    ASN  10           H        ASN  10  13.080  10.585  -4.512
   67    HA   ASN  10           HA       ASN  10  12.402  13.120  -5.647
   68    HB2  ASN  10           HB2      ASN  10  12.145  12.481  -3.225
   69    HB3  ASN  10           HB3      ASN  10  13.897  12.490  -3.054
   70   HD21  ASN  10          HD22      ASN  10  11.059  14.587  -3.731
   71   HD22  ASN  10          HD21      ASN  10  11.890  16.051  -3.251
   72    H    THR  11           H        THR  11  15.617  11.781  -4.775
   73    HA   THR  11           HA       THR  11  17.200  13.961  -5.672
   74    HB   THR  11           HB       THR  11  17.876  10.994  -5.870
   75    HG1  THR  11           HG1      THR  11  17.395  11.535  -3.775
   76   HG21  THR  11          HG21      THR  11  19.462  12.366  -7.171
   77   HG22  THR  11          HG22      THR  11  19.654  13.473  -5.795
   78   HG23  THR  11          HG23      THR  11  20.221  11.792  -5.680
   79    H    ARG  12           H        ARG  12  16.194  11.055  -7.551
   80    HA   ARG  12           HA       ARG  12  17.213  11.972 -10.074
   81    HB2  ARG  12           HB2      ARG  12  15.024   9.969  -9.375
   82    HB3  ARG  12           HB3      ARG  12  15.629  10.219 -11.010
   83    HG2  ARG  12           HG2      ARG  12  17.405   9.370  -8.679
   84    HG3  ARG  12           HG3      ARG  12  16.617   8.248  -9.783
   85    HD2  ARG  12           HD2      ARG  12  17.853   9.165 -11.685
   86    HD3  ARG  12           HD3      ARG  12  18.598  10.382 -10.657
   87    HE   ARG  12           HE       ARG  12  19.220   7.468 -10.716
   88   HH11  ARG  12          HH11      ARG  12  20.229  10.578  -9.391
   89   HH12  ARG  12          HH12      ARG  12  21.371   9.791  -8.337
   90   HH21  ARG  12          HH22      ARG  12  20.799   6.678  -9.671
   91   HH22  ARG  12          HH21      ARG  12  21.790   7.630  -8.562
   92    H    ALA  13           H        ALA  13  13.946  12.546  -8.626
   93    HA   ALA  13           HA       ALA  13  12.801  13.783 -10.909
   94    HB1  ALA  13           HB1      ALA  13  12.334  14.415  -7.972
   95    HB2  ALA  13           HB2      ALA  13  11.272  14.819  -9.338
   96    HB3  ALA  13           HB3      ALA  13  11.540  13.125  -8.902
   97    H    ARG  14           H        ARG  14  14.572  15.294  -8.196
   98    HA   ARG  14           HA       ARG  14  14.580  17.991  -9.219
   99    HB2  ARG  14           HB2      ARG  14  16.379  16.517  -7.231
  100    HB3  ARG  14           HB3      ARG  14  16.390  18.271  -7.460
  101    HG2  ARG  14           HG2      ARG  14  14.209  18.537  -6.560
  102    HG3  ARG  14           HG3      ARG  14  13.798  16.835  -6.795
  103    HD2  ARG  14           HD2      ARG  14  14.056  17.249  -4.469
  104    HD3  ARG  14           HD3      ARG  14  15.299  16.130  -5.047
  105    HE   ARG  14           HE       ARG  14  16.337  18.807  -5.032
  106   HH11  ARG  14          HH11      ARG  14  15.433  16.260  -2.783
  107   HH12  ARG  14          HH12      ARG  14  16.608  16.779  -1.599
  108   HH21  ARG  14          HH21      ARG  14  17.808  19.402  -3.456
  109   HH22  ARG  14          HH22      ARG  14  17.898  18.509  -1.970
  110    H    GLU  15           H        GLU  15  16.974  15.402  -9.422
  111    HA   GLU  15           HA       GLU  15  18.942  16.773 -10.982
  112    HB2  GLU  15           HB2      GLU  15  19.404  14.817  -9.663
  113    HB3  GLU  15           HB3      GLU  15  18.176  13.874 -10.516
  114    HG2  GLU  15           HG2      GLU  15  19.463  13.657 -12.445
  115    HG3  GLU  15           HG3      GLU  15  20.620  14.915 -11.928
  116    H    THR  16           H        THR  16  16.222  14.668 -12.053
  117    HA   THR  16           HA       THR  16  16.736  14.880 -14.858
  118    HB   THR  16           HB       THR  16  14.090  14.429 -13.418
  119    HG1  THR  16           HG1      THR  16  15.516  12.889 -12.888
  120   HG21  THR  16          HG21      THR  16  14.912  13.715 -16.266
  121   HG22  THR  16          HG22      THR  16  13.430  13.184 -15.436
  122   HG23  THR  16          HG23      THR  16  13.671  14.903 -15.811
  123    H    ALA  17           H        ALA  17  14.798  16.911 -12.663
  124    HA   ALA  17           HA       ALA  17  13.853  18.712 -14.654
  125    HB1  ALA  17           HB1      ALA  17  13.383  20.184 -12.733
  126    HB2  ALA  17           HB2      ALA  17  12.887  18.505 -12.397
  127    HB3  ALA  17           HB3      ALA  17  14.375  19.156 -11.684
  128    H    ALA  18           H        ALA  18  16.785  18.966 -12.561
  129    HA   ALA  18           HA       ALA  18  17.759  21.391 -13.706
  130    HB1  ALA  18           HB1      ALA  18  19.279  19.046 -12.472
  131    HB2  ALA  18           HB2      ALA  18  19.911  20.688 -12.722
  132    HB3  ALA  18           HB3      ALA  18  18.572  20.418 -11.589
  133    H    ARG  19           H        ARG  19  18.341  17.984 -14.641
  134    HA   ARG  19           HA       ARG  19  20.147  18.463 -16.810
  135    HB2  ARG  19           HB2      ARG  19  19.747  16.280 -15.661
  136    HB3  ARG  19           HB3      ARG  19  18.157  16.184 -16.426
  137    HG2  ARG  19           HG2      ARG  19  19.292  16.169 -18.675
  138    HG3  ARG  19           HG3      ARG  19  20.860  16.205 -17.856
  139    HD2  ARG  19           HD2      ARG  19  20.447  14.081 -16.793
  140    HD3  ARG  19           HD3      ARG  19  18.760  14.063 -17.322
  141    HE   ARG  19           HE       ARG  19  19.925  14.117 -19.719
  142   HH11  ARG  19          HH11      ARG  19  20.826  12.054 -16.982
  143   HH12  ARG  19          HH12      ARG  19  21.382  10.804 -18.095
  144   HH21  ARG  19          HH21      ARG  19  20.672  12.336 -20.965
  145   HH22  ARG  19          HH22      ARG  19  21.405  11.006 -20.055
  146    H    PHE  20           H        PHE  20  16.553  17.993 -16.935
  147    HA   PHE  20           HA       PHE  20  16.299  18.622 -19.679
  148    HB2  PHE  20           HB2      PHE  20  14.481  17.602 -18.476
  149    HB3  PHE  20           HB3      PHE  20  14.370  18.967 -17.366
  150    HD1  PHE  20           HD2      PHE  20  14.469  18.570 -21.144
  151    HD2  PHE  20           HD1      PHE  20  12.512  20.333 -17.729
  152    HE1  PHE  20           HE2      PHE  20  12.902  19.754 -22.646
  153    HE2  PHE  20           HE1      PHE  20  10.931  21.503 -19.244
  154    HZ   PHE  20           HZ       PHE  20  11.122  21.211 -21.709
  155    H    THR  21           H        THR  21  16.243  20.897 -16.864
  156    HA   THR  21           HA       THR  21  15.713  23.224 -18.417
  157    HB   THR  21           HB       THR  21  17.401  23.115 -15.889
  158    HG1  THR  21           HG1      THR  21  15.428  22.154 -15.522
  159   HG21  THR  21          HG21      THR  21  16.383  25.404 -15.527
  160   HG22  THR  21          HG22      THR  21  17.497  25.337 -16.893
  161   HG23  THR  21          HG23      THR  21  15.740  25.342 -17.175
  162    H    ALA  22           H        ALA  22  18.925  21.740 -17.619
  163    HA   ALA  22           HA       ALA  22  20.452  23.595 -19.171
  164    HB1  ALA  22           HB1      ALA  22  21.405  22.090 -17.464
  165    HB2  ALA  22           HB2      ALA  22  21.016  20.680 -18.474
  166    HB3  ALA  22           HB3      ALA  22  22.208  21.873 -19.031
  167    H    ALA  23           H        ALA  23  18.958  20.488 -20.123
  168    HA   ALA  23           HA       ALA  23  19.930  20.488 -22.811
  169    HB1  ALA  23           HB1      ALA  23  17.398  19.185 -21.744
  170    HB2  ALA  23           HB2      ALA  23  18.378  18.686 -23.144
  171    HB3  ALA  23           HB3      ALA  23  19.038  18.529 -21.516
  172    H    LEU  24           H        LEU  24  16.993  21.951 -21.401
  173    HA   LEU  24           HA       LEU  24  15.881  22.860 -23.889
  174    HB2  LEU  24           HB2      LEU  24  14.714  22.481 -21.656
  175    HB3  LEU  24           HB3      LEU  24  15.481  23.952 -21.083
  176    HG   LEU  24           HG       LEU  24  14.284  25.192 -22.976
  177   HD11  LEU  24          HD11      LEU  24  12.278  24.024 -23.927
  178   HD12  LEU  24          HD12      LEU  24  13.782  23.266 -24.467
  179   HD13  LEU  24          HD13      LEU  24  12.818  22.512 -23.181
  180   HD21  LEU  24          HD21      LEU  24  13.435  25.152 -20.643
  181   HD22  LEU  24          HD22      LEU  24  12.108  25.165 -21.820
  182   HD23  LEU  24          HD23      LEU  24  12.551  23.652 -21.000
  183    H    GLU  25           H        GLU  25  18.245  24.283 -21.620
  184    HA   GLU  25           HA       GLU  25  18.476  26.844 -22.916
  185    HB2  GLU  25           HB2      GLU  25  19.506  26.123 -20.665
  186    HB3  GLU  25           HB3      GLU  25  20.772  25.343 -21.605
  187    HG2  GLU  25           HG2      GLU  25  21.271  27.532 -22.709
  188    HG3  GLU  25           HG3      GLU  25  20.027  28.293 -21.718
  189    H    LEU  26           H        LEU  26  20.190  23.740 -23.435
  190    HA   LEU  26           HA       LEU  26  21.708  24.412 -25.739
  191    HB2  LEU  26           HB2      LEU  26  22.285  22.383 -24.836
  192    HB3  LEU  26           HB3      LEU  26  20.651  21.955 -24.435
  193    HG   LEU  26           HG       LEU  26  20.224  21.458 -26.902
  194   HD11  LEU  26          HD11      LEU  26  22.188  20.982 -28.282
  195   HD12  LEU  26          HD12      LEU  26  22.165  22.698 -27.846
  196   HD13  LEU  26          HD13      LEU  26  23.269  21.587 -27.007
  197   HD21  LEU  26          HD21      LEU  26  20.553  19.718 -25.242
  198   HD22  LEU  26          HD22      LEU  26  21.317  19.273 -26.774
  199   HD23  LEU  26          HD23      LEU  26  22.321  19.843 -25.418
  200    H    ALA  27           H        ALA  27  18.336  23.211 -25.587
  201    HA   ALA  27           HA       ALA  27  17.811  23.306 -28.363
  202    HB1  ALA  27           HB1      ALA  27  15.428  23.463 -27.691
  203    HB2  ALA  27           HB2      ALA  27  16.315  22.228 -26.764
  204    HB3  ALA  27           HB3      ALA  27  15.918  23.792 -26.027
  205    H    ILE  28           H        ILE  28  17.357  25.966 -25.971
  206    HA   ILE  28           HA       ILE  28  16.418  27.936 -27.839
  207    HB   ILE  28           HB       ILE  28  17.877  28.190 -25.180
  208   HG12  ILE  28          HG12      ILE  28  14.948  28.754 -25.767
  209   HG13  ILE  28          HG13      ILE  28  15.489  27.125 -25.371
  210   HG21  ILE  28          HG21      ILE  28  16.495  30.362 -26.828
  211   HG22  ILE  28          HG22      ILE  28  17.021  30.551 -25.142
  212   HG23  ILE  28          HG23      ILE  28  18.219  30.293 -26.400
  213   HD11  ILE  28          HD11      ILE  28  16.413  27.942 -23.227
  214   HD12  ILE  28          HD12      ILE  28  15.712  29.541 -23.575
  215   HD13  ILE  28          HD13      ILE  28  14.656  28.118 -23.400
  216    H    ASP  29           H        ASP  29  19.751  27.208 -26.691
  217    HA   ASP  29           HA       ASP  29  21.077  29.151 -28.297
  218    HB2  ASP  29           HB2      ASP  29  22.052  27.980 -26.343
  219    HB3  ASP  29           HB3      ASP  29  22.068  26.470 -27.254
  220    H    ARG  30           H        ARG  30  20.045  25.848 -29.080
  221    HA   ARG  30           HA       ARG  30  21.361  25.867 -31.692
  222    HB2  ARG  30           HB2      ARG  30  21.030  23.864 -30.228
  223    HB3  ARG  30           HB3      ARG  30  19.306  23.894 -30.603
  224    HG2  ARG  30           HG2      ARG  30  19.686  23.373 -32.897
  225    HG3  ARG  30           HG3      ARG  30  21.395  23.821 -32.826
  226    HD2  ARG  30           HD2      ARG  30  20.173  21.432 -31.391
  227    HD3  ARG  30           HD3      ARG  30  21.006  21.372 -32.956
  228    HE   ARG  30           HE       ARG  30  22.612  22.622 -30.872
  229   HH11  ARG  30          HH11      ARG  30  21.878  19.480 -32.270
  230   HH12  ARG  30          HH12      ARG  30  23.293  18.756 -31.512
  231   HH21  ARG  30          HH21      ARG  30  24.410  21.612 -30.057
  232   HH22  ARG  30          HH22      ARG  30  24.685  19.918 -30.394
  233    H    ALA  31           H        ALA  31  18.083  26.702 -30.615
  234    HA   ALA  31           HA       ALA  31  16.822  26.589 -33.140
  235    HB1  ALA  31           HB1      ALA  31  15.172  28.140 -32.139
  236    HB2  ALA  31           HB2      ALA  31  15.637  26.875 -30.988
  237    HB3  ALA  31           HB3      ALA  31  16.309  28.507 -30.820
  238    H    THR  32           H        THR  32  18.831  29.285 -31.899
  239    HA   THR  32           HA       THR  32  18.189  30.998 -34.165
  240    HB   THR  32           HB       THR  32  19.035  31.851 -31.993
  241    HG1  THR  32           HG1      THR  32  20.232  33.451 -32.986
  242   HG21  THR  32          HG21      THR  32  21.793  31.006 -32.986
  243   HG22  THR  32          HG22      THR  32  21.419  31.987 -31.556
  244   HG23  THR  32          HG23      THR  32  20.929  30.293 -31.603
  245    H    LEU  33           H        LEU  33  20.621  28.512 -33.607
  246    HA   LEU  33           HA       LEU  33  22.133  28.978 -36.020
  247    HB2  LEU  33           HB2      LEU  33  21.935  26.572 -34.165
  248    HB3  LEU  33           HB3      LEU  33  23.169  26.800 -35.404
  249    HG   LEU  33           HG       LEU  33  22.785  28.511 -32.908
  250   HD11  LEU  33          HD11      LEU  33  23.690  26.258 -32.470
  251   HD12  LEU  33          HD12      LEU  33  24.970  26.531 -33.673
  252   HD13  LEU  33          HD13      LEU  33  24.906  27.511 -32.190
  253   HD21  LEU  33          HD21      LEU  33  23.710  29.906 -34.702
  254   HD22  LEU  33          HD22      LEU  33  24.971  29.527 -33.527
  255   HD23  LEU  33          HD23      LEU  33  24.924  28.660 -35.078
  256    H    SER  34           H        SER  34  19.408  26.942 -35.134
  257    HA   SER  34           HA       SER  34  19.449  25.143 -37.348
  258    HB2  SER  34           HB2      SER  34  17.202  25.964 -35.465
  259    HB3  SER  34           HB3      SER  34  17.119  24.605 -36.596
  260    HG   SER  34           HG       SER  34  18.949  24.959 -34.457
  261    H    GLY  35           H        GLY  35  18.085  28.375 -37.127
  262    HA2  GLY  35           HA2      GLY  35  17.000  29.690 -38.704
  263    HA3  GLY  35           HA3      GLY  35  17.329  28.462 -39.932
  264    H    GLN  36           H        GLN  36  15.718  27.312 -37.158
  265    HA   GLN  36           HA       GLN  36  12.938  27.599 -38.019
  266    HB2  GLN  36           HB2      GLN  36  13.805  25.637 -39.347
  267    HB3  GLN  36           HB3      GLN  36  14.391  24.914 -37.848
  268    HG2  GLN  36           HG2      GLN  36  11.991  24.804 -37.038
  269    HG3  GLN  36           HG3      GLN  36  11.488  25.357 -38.631
  270   HE21  GLN  36          HE22      GLN  36  12.128  22.614 -36.679
  271   HE22  GLN  36          HE21      GLN  36  12.269  21.442 -37.979
  272    HA   PRO  37           HA       PRO  37  12.575  27.283 -33.472
  273    HB2  PRO  37           HB2      PRO  37  10.148  25.627 -34.218
  274    HB3  PRO  37           HB3      PRO  37  10.305  26.867 -32.936
  275    HG2  PRO  37           HG2      PRO  37   9.129  27.525 -35.270
  276    HG3  PRO  37           HG3      PRO  37  10.347  28.637 -34.561
  277    HD2  PRO  37           HD2      PRO  37  10.705  26.656 -36.795
  278    HD3  PRO  37           HD3      PRO  37  11.311  28.333 -36.660
  279    H    VAL  38           H        VAL  38  12.563  25.625 -31.804
  280    HA   VAL  38           HA       VAL  38  13.402  22.863 -32.672
  281    HB   VAL  38           HB       VAL  38  14.661  24.647 -30.556
  282   HG11  VAL  38          HG11      VAL  38  16.249  22.767 -30.149
  283   HG12  VAL  38          HG12      VAL  38  14.618  22.401 -29.591
  284   HG13  VAL  38          HG13      VAL  38  15.211  21.702 -31.109
  285   HG21  VAL  38          HG21      VAL  38  16.708  24.268 -31.914
  286   HG22  VAL  38          HG22      VAL  38  15.766  23.286 -33.061
  287   HG23  VAL  38          HG23      VAL  38  15.425  25.003 -32.890
  288    H    GLY  39           H        GLY  39  12.899  21.172 -30.953
  289    HA2  GLY  39           HA2      GLY  39  10.936  22.033 -28.915
  290    HA3  GLY  39           HA3      GLY  39  10.270  21.150 -30.271
  291    H    ILE  40           H        ILE  40   9.661  19.952 -28.184
  292    HA   ILE  40           HA       ILE  40  11.569  17.666 -27.883
  293    HB   ILE  40           HB       ILE  40   9.716  18.586 -25.670
  294   HG12  ILE  40          HG12      ILE  40  12.209  18.956 -24.615
  295   HG13  ILE  40          HG13      ILE  40  12.542  19.412 -26.276
  296   HG21  ILE  40          HG21      ILE  40  12.042  16.616 -25.652
  297   HG22  ILE  40          HG22      ILE  40  10.988  17.011 -24.292
  298   HG23  ILE  40          HG23      ILE  40  10.322  16.157 -25.680
  299   HD11  ILE  40          HD11      ILE  40  10.648  21.082 -26.131
  300   HD12  ILE  40          HD12      ILE  40  10.408  20.590 -24.437
  301   HD13  ILE  40          HD13      ILE  40  11.927  21.351 -24.936
  302    H    HIS  41           H        HIS  41  10.797  15.815 -28.429
  303    HA   HIS  41           HA       HIS  41   7.890  15.432 -28.999
  304    HB2  HIS  41           HB2      HIS  41   9.328  15.064 -30.910
  305    HB3  HIS  41           HB3      HIS  41  10.403  14.037 -29.983
  306    HD1  HIS  41           HD1      HIS  41  10.032  11.880 -31.488
  307    HD2  HIS  41           HD2      HIS  41   6.514  13.612 -29.976
  308    HE1  HIS  41           HE1      HIS  41   8.166  10.208 -31.926
  309    H    PHE  42           H        PHE  42   7.060  14.946 -27.053
  310    HA   PHE  42           HA       PHE  42   8.245  12.864 -25.291
  311    HB2  PHE  42           HB2      PHE  42   5.773  14.650 -25.156
  312    HB3  PHE  42           HB3      PHE  42   6.118  13.390 -23.992
  313    HD1  PHE  42           HD2      PHE  42   7.291  16.762 -25.232
  314    HD2  PHE  42           HD1      PHE  42   7.699  13.672 -22.224
  315    HE1  PHE  42           HE2      PHE  42   8.464  18.335 -23.744
  316    HE2  PHE  42           HE1      PHE  42   8.942  15.252 -20.786
  317    HZ   PHE  42           HZ       PHE  42   9.317  17.594 -21.537
  318    H    SER  43           H        SER  43   7.698  10.686 -25.617
  319    HA   SER  43           HA       SER  43   5.214  10.113 -27.173
  320    HB2  SER  43           HB2      SER  43   6.337   8.347 -28.348
  321    HB3  SER  43           HB3      SER  43   7.171   9.884 -28.571
  322    HG   SER  43           HG       SER  43   7.962   7.586 -27.151
  323    H    ASP  44           H        ASP  44   6.108   9.861 -24.170
  324    HA   ASP  44           HA       ASP  44   5.631   8.659 -22.350
  325    HB2  ASP  44           HB2      ASP  44   3.353   8.499 -23.240
  326    HB3  ASP  44           HB3      ASP  44   3.767   7.004 -24.076
  327    H    SER  45           H        SER  45   6.434   6.573 -25.127
  328    HA   SER  45           HA       SER  45   7.689   4.429 -23.678
  329    HB2  SER  45           HB2      SER  45   8.884   4.108 -25.877
  330    HB3  SER  45           HB3      SER  45   7.116   4.164 -25.995
  331    HG   SER  45           HG       SER  45   8.165   5.447 -27.587
  332    H    ALA  46           H        ALA  46   8.847   7.515 -24.949
  333    HA   ALA  46           HA       ALA  46  10.721   7.957 -22.830
  334    HB1  ALA  46           HB1      ALA  46  11.849   7.427 -25.626
  335    HB2  ALA  46           HB2      ALA  46  12.766   8.146 -24.286
  336    HB3  ALA  46           HB3      ALA  46  12.177   6.489 -24.164
  337    H    TRP  47           H        TRP  47  12.087  10.109 -23.684
  338    HA   TRP  47           HA       TRP  47  10.467  11.806 -25.445
  339    HB2  TRP  47           HB2      TRP  47  10.386  13.638 -23.755
  340    HB3  TRP  47           HB3      TRP  47   9.341  12.269 -23.433
  341    HD1  TRP  47           HD1      TRP  47  10.257  10.492 -21.504
  342    HE1  TRP  47           HE1      TRP  47  11.252  11.038 -19.210
  343    HE3  TRP  47           HE3      TRP  47  11.730  15.322 -22.387
  344    HZ2  TRP  47           HZ2      TRP  47  12.420  13.305 -17.881
  345    HZ3  TRP  47           HZ3      TRP  47  12.712  16.671 -20.552
  346    HH2  TRP  47           HH2      TRP  47  13.069  15.680 -18.304
  347    H    ARG  48           H        ARG  48  11.650  13.243 -26.553
  348    HA   ARG  48           HA       ARG  48  14.501  13.701 -25.859
  349    HB2  ARG  48           HB2      ARG  48  15.409  12.806 -27.804
  350    HB3  ARG  48           HB3      ARG  48  14.264  11.586 -27.273
  351    HG2  ARG  48           HG2      ARG  48  13.776  13.493 -29.576
  352    HG3  ARG  48           HG3      ARG  48  14.345  11.835 -29.695
  353    HD2  ARG  48           HD2      ARG  48  11.672  12.706 -28.574
  354    HD3  ARG  48           HD3      ARG  48  11.952  11.978 -30.158
  355    HE   ARG  48           HE       ARG  48  13.038  10.126 -28.400
  356   HH11  ARG  48          HH11      ARG  48   9.819  11.546 -28.328
  357   HH12  ARG  48          HH12      ARG  48   9.132   9.984 -27.898
  358   HH21  ARG  48          HH21      ARG  48  12.071   8.353 -27.707
  359   HH22  ARG  48          HH22      ARG  48  10.305   8.294 -27.562
  360    H    ILE  49           H        ILE  49  15.491  15.399 -26.964
  361    HA   ILE  49           HA       ILE  49  13.738  17.554 -27.899
  362    HB   ILE  49           HB       ILE  49  16.773  17.369 -27.759
  363   HG12  ILE  49          HG12      ILE  49  14.646  18.453 -25.858
  364   HG13  ILE  49          HG13      ILE  49  15.767  17.131 -25.552
  365   HG21  ILE  49          HG21      ILE  49  16.758  19.821 -27.980
  366   HG22  ILE  49          HG22      ILE  49  15.995  19.117 -29.385
  367   HG23  ILE  49          HG23      ILE  49  14.992  19.832 -28.102
  368   HD11  ILE  49          HD11      ILE  49  16.451  19.058 -24.317
  369   HD12  ILE  49          HD12      ILE  49  17.661  18.760 -25.591
  370   HD13  ILE  49          HD13      ILE  49  16.469  20.079 -25.749
  371    H    MET  50           H        MET  50  13.734  18.425 -30.027
  372    HA   MET  50           HA       MET  50  14.651  16.624 -32.212
  373    HB2  MET  50           HB2      MET  50  12.160  16.357 -31.233
  374    HB3  MET  50           HB3      MET  50  11.848  17.737 -32.291
  375    HG2  MET  50           HG2      MET  50  12.715  16.436 -34.210
  376    HG3  MET  50           HG3      MET  50  13.168  15.122 -33.120
  377    HE1  MET  50           HE1      MET  50  11.442  14.487 -35.728
  378    HE2  MET  50           HE2      MET  50  11.887  13.255 -34.523
  379    HE3  MET  50           HE3      MET  50  10.197  13.428 -35.056
  380    H    VAL  51           H        VAL  51  15.130  17.604 -34.105
  381    HA   VAL  51           HA       VAL  51  15.062  20.584 -34.357
  382    HB   VAL  51           HB       VAL  51  17.536  20.438 -34.920
  383   HG11  VAL  51          HG11      VAL  51  16.826  19.678 -32.068
  384   HG12  VAL  51          HG12      VAL  51  18.330  20.441 -32.624
  385   HG13  VAL  51          HG13      VAL  51  16.798  21.309 -32.767
  386   HG21  VAL  51          HG21      VAL  51  17.438  17.702 -33.588
  387   HG22  VAL  51          HG22      VAL  51  17.719  18.001 -35.314
  388   HG23  VAL  51          HG23      VAL  51  18.879  18.588 -34.119
  389    HA   PRO  52           HA       PRO  52  14.881  19.489 -38.756
  390    HB2  PRO  52           HB2      PRO  52  16.306  21.463 -40.022
  391    HB3  PRO  52           HB3      PRO  52  14.683  21.721 -39.317
  392    HG2  PRO  52           HG2      PRO  52  17.380  22.306 -38.053
  393    HG3  PRO  52           HG3      PRO  52  15.968  23.395 -38.188
  394    HD2  PRO  52           HD2      PRO  52  16.453  22.000 -35.920
  395    HD3  PRO  52           HD3      PRO  52  14.782  22.197 -36.509
  396    H    GLY  53           H        GLY  53  16.284  18.803 -40.572
  397    HA2  GLY  53           HA2      GLY  53  19.166  18.457 -40.104
  398    HA3  GLY  53           HA3      GLY  53  18.243  16.957 -40.012
  399    H    LYS  54           H        LYS  54  16.608  16.757 -42.038
  400    HA   LYS  54           HA       LYS  54  18.225  16.677 -44.413
  401    HB2  LYS  54           HB2      LYS  54  15.216  16.356 -44.015
  402    HB3  LYS  54           HB3      LYS  54  16.006  16.131 -45.563
  403    HG2  LYS  54           HG2      LYS  54  16.434  14.489 -43.038
  404    HG3  LYS  54           HG3      LYS  54  15.652  13.986 -44.531
  405    HD2  LYS  54           HD2      LYS  54  18.612  14.475 -44.051
  406    HD3  LYS  54           HD3      LYS  54  17.804  12.971 -44.489
  407    HE2  LYS  54           HE2      LYS  54  17.173  13.999 -46.702
  408    HE3  LYS  54           HE3      LYS  54  18.092  15.444 -46.263
  409    HZ1  LYS  54           HZ1      LYS  54  19.428  13.925 -47.610
  410    HZ2  LYS  54           HZ2      LYS  54  20.093  14.040 -46.129
  411    HZ3  LYS  54           HZ3      LYS  54  19.240  12.712 -46.542
  412    H    THR  55           H        THR  55  16.022  19.165 -43.302
  413    HA   THR  55           HA       THR  55  17.353  21.014 -45.065
  414    HB   THR  55           HB       THR  55  15.713  20.353 -46.670
  415    HG1  THR  55           HG1      THR  55  14.934  22.364 -47.059
  416   HG21  THR  55          HG21      THR  55  13.520  21.185 -44.722
  417   HG22  THR  55          HG22      THR  55  13.318  20.693 -46.411
  418   HG23  THR  55          HG23      THR  55  13.877  19.512 -45.221
  419    HA   PRO  56           HA       PRO  56  15.988  23.536 -41.525
  420    HB2  PRO  56           HB2      PRO  56  17.531  25.719 -41.907
  421    HB3  PRO  56           HB3      PRO  56  18.272  24.134 -41.540
  422    HG2  PRO  56           HG2      PRO  56  17.882  25.409 -44.275
  423    HG3  PRO  56           HG3      PRO  56  19.393  24.736 -43.579
  424    HD2  PRO  56           HD2      PRO  56  17.712  23.289 -45.223
  425    HD3  PRO  56           HD3      PRO  56  18.678  22.528 -43.927
  426    H    SER  57           H        SER  57  14.928  23.809 -44.667
  427    HA   SER  57           HA       SER  57  14.422  26.370 -45.361
  428    HB2  SER  57           HB2      SER  57  12.507  25.525 -46.673
  429    HB3  SER  57           HB3      SER  57  13.945  24.501 -46.796
  430    HG   SER  57           HG       SER  57  12.037  23.276 -46.454
  431    H    ALA  58           H        ALA  58  11.922  24.523 -43.618
  432    HA   ALA  58           HA       ALA  58  11.047  26.844 -42.046
  433    HB1  ALA  58           HB1      ALA  58   9.960  27.329 -44.220
  434    HB2  ALA  58           HB2      ALA  58   9.243  25.703 -44.239
  435    HB3  ALA  58           HB3      ALA  58   8.751  26.884 -43.007
  436    H    TRP  59           H        TRP  59  10.359  23.476 -43.086
  437    HA   TRP  59           HA       TRP  59   9.699  22.744 -40.303
  438    HB2  TRP  59           HB2      TRP  59   7.560  23.505 -41.240
  439    HB3  TRP  59           HB3      TRP  59   7.736  22.402 -42.596
  440    HD1  TRP  59           HD1      TRP  59   7.083  19.906 -42.224
  441    HE1  TRP  59           HE1      TRP  59   5.880  18.620 -40.357
  442    HE3  TRP  59           HE3      TRP  59   7.384  23.415 -38.502
  443    HZ2  TRP  59           HZ2      TRP  59   5.093  19.077 -37.618
  444    HZ3  TRP  59           HZ3      TRP  59   6.386  22.963 -36.272
  445    HH2  TRP  59           HH2      TRP  59   5.235  20.811 -35.820
  446    H    ARG  60           H        ARG  60  11.284  21.297 -40.106
  447    HA   ARG  60           HA       ARG  60  10.751  18.649 -41.226
  448    HB2  ARG  60           HB2      ARG  60  12.593  20.050 -42.652
  449    HB3  ARG  60           HB3      ARG  60  13.640  19.599 -41.331
  450    HG2  ARG  60           HG2      ARG  60  13.809  18.091 -43.265
  451    HG3  ARG  60           HG3      ARG  60  13.318  17.217 -41.820
  452    HD2  ARG  60           HD2      ARG  60  12.151  16.613 -44.032
  453    HD3  ARG  60           HD3      ARG  60  11.126  16.870 -42.628
  454    HE   ARG  60           HE       ARG  60  10.576  19.117 -43.447
  455   HH11  ARG  60          HH11      ARG  60  11.864  17.032 -45.966
  456   HH12  ARG  60          HH12      ARG  60  11.207  18.052 -47.211
  457   HH21  ARG  60          HH21      ARG  60   9.821  20.294 -44.980
  458   HH22  ARG  60          HH22      ARG  60  10.043  19.878 -46.664
  459    H    TRP  61           H        TRP  61  11.638  16.953 -39.868
  460    HA   TRP  61           HA       TRP  61  12.897  17.853 -37.327
  461    HB2  TRP  61           HB2      TRP  61  10.315  16.263 -37.485
  462    HB3  TRP  61           HB3      TRP  61  11.236  16.618 -36.028
  463    HD1  TRP  61           HD1      TRP  61   8.376  17.833 -37.826
  464    HE1  TRP  61           HE1      TRP  61   7.698  20.212 -37.078
  465    HE3  TRP  61           HE3      TRP  61  12.586  19.078 -35.221
  466    HZ2  TRP  61           HZ2      TRP  61   8.802  22.312 -35.428
  467    HZ3  TRP  61           HZ3      TRP  61  12.735  21.249 -34.028
  468    HH2  TRP  61           HH2      TRP  61  10.845  22.851 -34.094
  469    H    VAL  62           H        VAL  62  14.327  16.568 -36.536
  470    HA   VAL  62           HA       VAL  62  14.186  13.627 -36.735
  471    HB   VAL  62           HB       VAL  62  16.675  13.544 -37.022
  472   HG11  VAL  62          HG11      VAL  62  15.260  14.793 -39.402
  473   HG12  VAL  62          HG12      VAL  62  16.695  13.750 -39.428
  474   HG13  VAL  62          HG13      VAL  62  15.135  13.089 -38.911
  475   HG21  VAL  62          HG21      VAL  62  17.261  15.883 -36.449
  476   HG22  VAL  62          HG22      VAL  62  17.905  15.380 -38.016
  477   HG23  VAL  62          HG23      VAL  62  16.479  16.432 -37.947
  478    HA   PRO  63           HA       PRO  63  15.038  14.165 -32.401
  479    HB2  PRO  63           HB2      PRO  63  16.336  11.861 -31.686
  480    HB3  PRO  63           HB3      PRO  63  14.598  11.933 -32.101
  481    HG2  PRO  63           HG2      PRO  63  16.898  11.150 -33.914
  482    HG3  PRO  63           HG3      PRO  63  15.348  10.286 -33.651
  483    HD2  PRO  63           HD2      PRO  63  15.711  11.940 -35.768
  484    HD3  PRO  63           HD3      PRO  63  14.142  11.884 -34.912
  485    H    LEU  64           H        LEU  64  16.533  15.246 -31.230
  486    HA   LEU  64           HA       LEU  64  19.075  15.948 -32.417
  487    HB2  LEU  64           HB2      LEU  64  17.553  17.461 -31.068
  488    HB3  LEU  64           HB3      LEU  64  18.047  16.598 -29.622
  489    HG   LEU  64           HG       LEU  64  19.853  18.213 -31.483
  490   HD11  LEU  64          HD11      LEU  64  18.905  18.772 -28.644
  491   HD12  LEU  64          HD12      LEU  64  19.996  19.793 -29.600
  492   HD13  LEU  64          HD13      LEU  64  18.318  19.584 -30.114
  493   HD21  LEU  64          HD21      LEU  64  20.540  16.815 -28.866
  494   HD22  LEU  64          HD22      LEU  64  21.282  16.537 -30.462
  495   HD23  LEU  64          HD23      LEU  64  21.550  18.056 -29.624
  496    H    GLN  65           H        GLN  65  20.128  13.877 -32.564
  497    HA   GLN  65           HA       GLN  65  21.334  12.931 -29.978
  498    HB2  GLN  65           HB2      GLN  65  20.229  11.245 -32.253
  499    HB3  GLN  65           HB3      GLN  65  21.220  10.614 -30.931
  500    HG2  GLN  65           HG2      GLN  65  19.548  11.442 -29.283
  501    HG3  GLN  65           HG3      GLN  65  18.495  11.933 -30.619
  502   HE21  GLN  65          HE22      GLN  65  18.374   9.876 -32.368
  503   HE22  GLN  65          HE21      GLN  65  17.906   8.401 -31.548
  504    H    GLU  66           H        GLU  66  22.083  14.060 -33.136
  505    HA   GLU  66           HA       GLU  66  24.327  12.500 -33.819
  506    HB2  GLU  66           HB2      GLU  66  23.821  15.455 -34.349
  507    HB3  GLU  66           HB3      GLU  66  25.044  14.465 -35.156
  508    HG2  GLU  66           HG2      GLU  66  23.231  12.946 -35.984
  509    HG3  GLU  66           HG3      GLU  66  22.030  14.036 -35.288
  510    H    ASP  67           H        ASP  67  24.160  15.135 -31.496
  511    HA   ASP  67           HA       ASP  67  26.846  14.386 -30.497
  512    HB2  ASP  67           HB2      ASP  67  27.466  16.688 -30.206
  513    HB3  ASP  67           HB3      ASP  67  26.945  16.502 -31.874
  514    H    ALA  68           H        ALA  68  24.123  13.687 -29.731
  515    HA   ALA  68           HA       ALA  68  24.464  14.035 -26.816
  516    HB1  ALA  68           HB1      ALA  68  22.795  15.738 -27.459
  517    HB2  ALA  68           HB2      ALA  68  21.817  14.495 -28.262
  518    HB3  ALA  68           HB3      ALA  68  22.052  14.448 -26.498
  519    H    ALA  69           H        ALA  69  25.263  12.021 -28.575
  520    HA   ALA  69           HA       ALA  69  23.541  10.020 -29.255
  521    HB1  ALA  69           HB1      ALA  69  26.486   9.809 -28.528
  522    HB2  ALA  69           HB2      ALA  69  25.563   8.618 -29.469
  523    HB3  ALA  69           HB3      ALA  69  25.804  10.253 -30.111
  524    H    ASP  70           H        ASP  70  22.299   8.661 -28.137
  525    HA   ASP  70           HA       ASP  70  21.306   7.511 -26.501
  526    HB2  ASP  70           HB2      ASP  70  23.257   6.064 -27.148
  527    HB3  ASP  70           HB3      ASP  70  24.103   6.641 -25.715
  528    H    GLU  71           H        GLU  71  22.264  10.310 -25.727
  529    HA   GLU  71           HA       GLU  71  21.516  10.011 -22.848
  530    HB2  GLU  71           HB2      GLU  71  23.056  11.716 -22.161
  531    HB3  GLU  71           HB3      GLU  71  23.922  10.388 -22.924
  532    HG2  GLU  71           HG2      GLU  71  24.206  11.698 -24.979
  533    HG3  GLU  71           HG3      GLU  71  23.227  13.011 -24.323
  534    H    SER  72           H        SER  72  20.901  11.653 -25.815
  535    HA   SER  72           HA       SER  72  19.424  13.896 -24.860
  536    HB2  SER  72           HB2      SER  72  20.128  13.262 -27.240
  537    HB3  SER  72           HB3      SER  72  18.727  12.187 -27.271
  538    HG   SER  72           HG       SER  72  18.592  14.422 -28.088
  539    H    GLN  73           H        GLN  73  18.640  10.481 -24.773
  540    HA   GLN  73           HA       GLN  73  16.068  11.001 -23.474
  541    HB2  GLN  73           HB2      GLN  73  14.723   9.762 -25.006
  542    HB3  GLN  73           HB3      GLN  73  15.613  11.008 -25.875
  543    HG2  GLN  73           HG2      GLN  73  17.205   9.315 -26.722
  544    HG3  GLN  73           HG3      GLN  73  16.327   8.044 -25.867
  545   HE21  GLN  73          HE22      GLN  73  16.817   8.753 -28.879
  546   HE22  GLN  73          HE21      GLN  73  15.193   8.554 -29.533
  547    H    ASN  74           H        ASN  74  15.020   9.056 -22.777
  548    HA   ASN  74           HA       ASN  74  14.831   7.278 -21.430
  549    HB2  ASN  74           HB2      ASN  74  15.180   6.153 -23.591
  550    HB3  ASN  74           HB3      ASN  74  16.912   6.060 -23.275
  551   HD21  ASN  74          HD22      ASN  74  17.574   4.114 -22.430
  552   HD22  ASN  74          HD21      ASN  74  16.542   3.049 -21.497
  553    H    ASP  75           H        ASP  75  18.285   8.045 -21.761
  554    HA   ASP  75           HA       ASP  75  19.190   6.934 -19.284
  555    HB2  ASP  75           HB2      ASP  75  20.579   7.490 -21.255
  556    HB3  ASP  75           HB3      ASP  75  20.230   9.202 -21.025
  557    H    TRP  76           H        TRP  76  17.077   9.534 -19.724
  558    HA   TRP  76           HA       TRP  76  17.693  11.623 -18.086
  559    HB2  TRP  76           HB2      TRP  76  15.062  10.125 -18.402
  560    HB3  TRP  76           HB3      TRP  76  15.199  11.643 -17.538
  561    HD1  TRP  76           HD1      TRP  76  14.374  10.427 -20.858
  562    HE1  TRP  76           HE1      TRP  76  14.351  12.350 -22.579
  563    HE3  TRP  76           HE3      TRP  76  16.661  14.018 -18.052
  564    HZ2  TRP  76           HZ2      TRP  76  15.315  15.085 -22.716
  565    HZ3  TRP  76           HZ3      TRP  76  17.071  16.273 -18.989
  566    HH2  TRP  76           HH2      TRP  76  16.428  16.812 -21.326
  567    H    ASP  77           H        ASP  77  16.351   8.533 -16.874
  568    HA   ASP  77           HA       ASP  77  17.224   9.058 -14.120
  569    HB2  ASP  77           HB2      ASP  77  15.054   9.232 -13.177
  570    HB3  ASP  77           HB3      ASP  77  15.058  10.372 -14.509
  571    H    GLU  78           H        GLU  78  16.044   7.292 -12.657
  572    HA   GLU  78           HA       GLU  78  15.549   4.732 -14.050
  573    HB2  GLU  78           HB2      GLU  78  17.096   3.484 -12.700
  574    HB3  GLU  78           HB3      GLU  78  17.969   4.807 -13.467
  575    HG2  GLU  78           HG2      GLU  78  17.590   6.115 -11.252
  576    HG3  GLU  78           HG3      GLU  78  17.130   4.563 -10.556
  577    H    GLU  79           H        GLU  79  13.918   6.786 -12.539
  578    HA   GLU  79           HA       GLU  79  12.645   5.058 -10.468
  579    HB2  GLU  79           HB2      GLU  79  13.827   7.799  -9.868
  580    HB3  GLU  79           HB3      GLU  79  12.805   6.891  -8.772
  581    HG2  GLU  79           HG2      GLU  79  15.590   6.090  -9.662
  582    HG3  GLU  79           HG3      GLU  79  15.140   6.816  -8.131
  583    H    LEU  80           H        LEU  80  12.171   7.305 -12.983
  584    HA   LEU  80           HA       LEU  80   9.730   8.456 -11.715
  585    HB2  LEU  80           HB2      LEU  80  11.335   9.595 -14.005
  586    HB3  LEU  80           HB3      LEU  80  10.057  10.384 -13.103
  587    HG   LEU  80           HG       LEU  80  12.850   9.748 -12.060
  588   HD11  LEU  80          HD11      LEU  80  11.517  12.399 -12.671
  589   HD12  LEU  80          HD12      LEU  80  13.201  12.089 -12.176
  590   HD13  LEU  80          HD13      LEU  80  12.645  11.550 -13.751
  591   HD21  LEU  80          HD21      LEU  80  11.187   9.626 -10.214
  592   HD22  LEU  80          HD22      LEU  80  12.203  11.060 -10.085
  593   HD23  LEU  80          HD23      LEU  80  10.540  11.209 -10.698
  594    H    SER  81           H        SER  81   7.975   8.958 -12.921
  595    HA   SER  81           HA       SER  81   7.627   7.959 -15.713
  596    HB2  SER  81           HB2      SER  81   6.441   6.482 -14.070
  597    HB3  SER  81           HB3      SER  81   5.546   7.897 -13.481
  598    HG   SER  81           HG       SER  81   4.411   6.712 -15.116
  599    H    ILE  82           H        ILE  82   6.730   9.531 -17.061
  600    HA   ILE  82           HA       ILE  82   6.420  12.241 -15.857
  601    HB   ILE  82           HB       ILE  82   7.857  11.163 -18.241
  602   HG12  ILE  82          HG12      ILE  82   9.415  13.010 -17.726
  603   HG13  ILE  82          HG13      ILE  82   8.330  13.601 -16.471
  604   HG21  ILE  82          HG21      ILE  82   6.612  13.936 -18.348
  605   HG22  ILE  82          HG22      ILE  82   7.865  13.304 -19.436
  606   HG23  ILE  82          HG23      ILE  82   6.269  12.563 -19.435
  607   HD11  ILE  82          HD11      ILE  82   8.777  11.654 -15.089
  608   HD12  ILE  82          HD12      ILE  82   9.657  10.855 -16.418
  609   HD13  ILE  82          HD13      ILE  82  10.320  12.308 -15.643
  610    H    HIS  83           H        HIS  83   4.862  13.611 -16.488
  611    HA   HIS  83           HA       HIS  83   2.757  12.750 -18.412
  612    HB2  HIS  83           HB2      HIS  83   2.227  13.811 -15.609
  613    HB3  HIS  83           HB3      HIS  83   1.008  13.501 -16.837
  614    HD1  HIS  83           HD1      HIS  83   0.330  10.908 -17.215
  615    HD2  HIS  83           HD2      HIS  83   3.303  11.665 -14.334
  616    HE1  HIS  83           HE1      HIS  83   0.624   8.742 -15.905
  617    H    LEU  84           H        LEU  84   1.524  14.536 -19.285
  618    HA   LEU  84           HA       LEU  84   2.780  17.228 -19.087
  619    HB2  LEU  84           HB2      LEU  84   3.633  15.364 -20.859
  620    HB3  LEU  84           HB3      LEU  84   2.252  15.940 -21.770
  621    HG   LEU  84           HG       LEU  84   4.616  17.578 -20.782
  622   HD11  LEU  84          HD11      LEU  84   3.821  16.659 -23.585
  623   HD12  LEU  84          HD12      LEU  84   5.258  17.618 -23.158
  624   HD13  LEU  84          HD13      LEU  84   5.110  15.953 -22.586
  625   HD21  LEU  84          HD21      LEU  84   3.731  19.261 -22.551
  626   HD22  LEU  84          HD22      LEU  84   2.183  18.394 -22.406
  627   HD23  LEU  84          HD23      LEU  84   2.913  19.209 -21.002
  628    H    GLN  85           H        GLN  85   1.494  18.933 -19.729
  629    HA   GLN  85           HA       GLN  85  -0.885  18.612 -21.323
  630    HB2  GLN  85           HB2      GLN  85  -2.540  19.484 -19.863
  631    HB3  GLN  85           HB3      GLN  85  -1.779  18.143 -19.049
  632    HG2  GLN  85           HG2      GLN  85  -2.034  19.717 -17.353
  633    HG3  GLN  85           HG3      GLN  85  -0.345  19.863 -17.798
  634   HE21  GLN  85          HE22      GLN  85   0.091  22.061 -17.396
  635   HE22  GLN  85          HE21      GLN  85  -0.896  23.378 -18.032
  636    HA   PRO  86           HA       PRO  86  -2.659  20.314 -21.907
  637    HB2  PRO  86           HB2      PRO  86  -3.129  21.899 -24.047
  638    HB3  PRO  86           HB3      PRO  86  -3.179  22.531 -22.374
  639    HG2  PRO  86           HG2      PRO  86  -0.868  22.677 -24.343
  640    HG3  PRO  86           HG3      PRO  86  -1.592  24.012 -23.388
  641    HD2  PRO  86           HD2      PRO  86   0.636  22.651 -22.563
  642    HD3  PRO  86           HD3      PRO  86  -0.576  23.267 -21.402
  643    H    PHE  87           H        PHE  87   0.347  20.221 -23.662
  644    HA   PHE  87           HA       PHE  87  -0.508  18.661 -25.939
  645    HB2  PHE  87           HB2      PHE  87   2.229  18.832 -24.616
  646    HB3  PHE  87           HB3      PHE  87   1.883  18.219 -26.216
  647    HD1  PHE  87           HD1      PHE  87   0.577  19.911 -27.826
  648    HD2  PHE  87           HD2      PHE  87   2.982  21.057 -24.431
  649    HE1  PHE  87           HE1      PHE  87   0.878  22.180 -28.798
  650    HE2  PHE  87           HE2      PHE  87   3.286  23.315 -25.408
  651    HZ   PHE  87           HZ       PHE  87   2.244  23.872 -27.604
  652    H    LYS  88           H        LYS  88   0.591  16.438 -26.226
  653    HA   LYS  88           HA       LYS  88  -0.075  14.715 -23.891
  654    HB2  LYS  88           HB2      LYS  88  -1.164  13.132 -25.531
  655    HB3  LYS  88           HB3      LYS  88  -1.991  14.605 -25.087
  656    HG2  LYS  88           HG2      LYS  88  -2.469  14.348 -27.322
  657    HG3  LYS  88           HG3      LYS  88  -1.277  15.635 -27.305
  658    HD2  LYS  88           HD2      LYS  88   0.454  14.051 -28.080
  659    HD3  LYS  88           HD3      LYS  88  -0.717  12.714 -27.923
  660    HE2  LYS  88           HE2      LYS  88  -2.117  13.768 -29.671
  661    HE3  LYS  88           HE3      LYS  88  -0.945  15.081 -29.824
  662    HZ1  LYS  88           HZ1      LYS  88   0.715  13.415 -30.561
  663    HZ2  LYS  88           HZ2      LYS  88  -0.367  12.201 -30.404
  664    HZ3  LYS  88           HZ3      LYS  88  -0.602  13.370 -31.521
  665    HA   PRO  89           HA       PRO  89   3.784  12.697 -24.966
  666    HB2  PRO  89           HB2      PRO  89   3.870  10.775 -23.059
  667    HB3  PRO  89           HB3      PRO  89   4.054  12.507 -22.670
  668    HG2  PRO  89           HG2      PRO  89   1.559  10.807 -22.410
  669    HG3  PRO  89           HG3      PRO  89   2.248  11.965 -21.233
  670    HD2  PRO  89           HD2      PRO  89   0.214  12.593 -23.006
  671    HD3  PRO  89           HD3      PRO  89   1.381  13.795 -22.381
  672    H    ASP  90           H        ASP  90   3.467  11.837 -26.970
  673    HA   ASP  90           HA       ASP  90   2.377   9.120 -27.351
  674    HB2  ASP  90           HB2      ASP  90   0.360  10.590 -27.317
  675    HB3  ASP  90           HB3      ASP  90   1.149  11.645 -28.501
  676    H    ASP  91           H        ASP  91   3.196   8.215 -29.249
  677    HA   ASP  91           HA       ASP  91   5.430   9.381 -30.593
  678    HB2  ASP  91           HB2      ASP  91   5.174   6.987 -30.338
  679    HB3  ASP  91           HB3      ASP  91   3.681   7.000 -31.280
  680    H    SER  92           H        SER  92   4.851  11.366 -31.302
  681    HA   SER  92           HA       SER  92   2.647  11.752 -33.246
  682    HB2  SER  92           HB2      SER  92   4.365  13.765 -31.747
  683    HB3  SER  92           HB3      SER  92   2.894  14.114 -32.673
  684    HG   SER  92           HG       SER  92   3.064  12.387 -30.404
  685    H    ASN  93           H        ASN  93   5.957  11.218 -33.451
  686    HA   ASN  93           HA       ASN  93   7.604  11.543 -34.934
  687    HB2  ASN  93           HB2      ASN  93   5.602  10.466 -36.281
  688    HB3  ASN  93           HB3      ASN  93   5.615  11.993 -37.157
  689   HD21  ASN  93          HD22      ASN  93   8.066  12.618 -37.801
  690   HD22  ASN  93          HD21      ASN  93   8.927  11.277 -38.563
  691    H    GLN  94           H        GLN  94   6.489  13.977 -33.621
  692    HA   GLN  94           HA       GLN  94   8.227  15.936 -34.851
  693    HB2  GLN  94           HB2      GLN  94   6.554  17.682 -35.152
  694    HB3  GLN  94           HB3      GLN  94   6.107  16.319 -36.152
  695    HG2  GLN  94           HG2      GLN  94   4.279  15.739 -34.728
  696    HG3  GLN  94           HG3      GLN  94   4.881  16.702 -33.384
  697   HE21  GLN  94          HE22      GLN  94   4.580  18.953 -33.320
  698   HE22  GLN  94          HE21      GLN  94   3.423  19.718 -34.412
  699    HA   PRO  95           HA       PRO  95   8.073  17.054 -30.463
  700    HB2  PRO  95           HB2      PRO  95   8.574  19.719 -30.388
  701    HB3  PRO  95           HB3      PRO  95   9.840  18.507 -30.787
  702    HG2  PRO  95           HG2      PRO  95   8.199  20.182 -32.709
  703    HG3  PRO  95           HG3      PRO  95   9.973  19.910 -32.700
  704    HD2  PRO  95           HD2      PRO  95   8.285  18.483 -34.289
  705    HD3  PRO  95           HD3      PRO  95   9.735  17.741 -33.572
  706    H    GLN  96           H        GLN  96   6.631  17.986 -28.939
  707    HA   GLN  96           HA       GLN  96   4.188  19.329 -30.086
  708    HB2  GLN  96           HB2      GLN  96   4.328  17.999 -27.365
  709    HB3  GLN  96           HB3      GLN  96   2.940  18.597 -28.259
  710    HG2  GLN  96           HG2      GLN  96   2.647  16.406 -28.699
  711    HG3  GLN  96           HG3      GLN  96   3.678  16.776 -30.072
  712   HE21  GLN  96          HE22      GLN  96   3.456  14.149 -29.262
  713   HE22  GLN  96          HE21      GLN  96   4.817  13.644 -28.280
  714    H    VAL  97           H        VAL  97   6.552  19.442 -27.409
  715    HA   VAL  97           HA       VAL  97   5.809  22.232 -26.688
  716    HB   VAL  97           HB       VAL  97   8.098  20.431 -25.777
  717   HG11  VAL  97          HG11      VAL  97   8.735  22.815 -25.549
  718   HG12  VAL  97          HG12      VAL  97   7.207  23.145 -24.700
  719   HG13  VAL  97          HG13      VAL  97   8.433  22.087 -23.975
  720   HG21  VAL  97          HG21      VAL  97   5.895  19.637 -24.970
  721   HG22  VAL  97          HG22      VAL  97   6.848  20.312 -23.646
  722   HG23  VAL  97          HG23      VAL  97   5.532  21.266 -24.355
  723    H    VAL  98           H        VAL  98   6.819  24.021 -27.579
  724    HA   VAL  98           HA       VAL  98   9.187  23.578 -29.357
  725    HB   VAL  98           HB       VAL  98   6.630  25.011 -30.133
  726   HG11  VAL  98          HG11      VAL  98   7.700  25.369 -32.338
  727   HG12  VAL  98          HG12      VAL  98   8.500  26.284 -31.068
  728   HG13  VAL  98          HG13      VAL  98   9.241  24.783 -31.681
  729   HG21  VAL  98          HG21      VAL  98   6.603  23.339 -31.978
  730   HG22  VAL  98          HG22      VAL  98   8.028  22.548 -31.267
  731   HG23  VAL  98          HG23      VAL  98   6.478  22.571 -30.400
  732    H    ILE  99           H        ILE  99  10.540  25.187 -29.652
  733    HA   ILE  99           HA       ILE  99  10.613  27.482 -27.740
  734    HB   ILE  99           HB       ILE  99  12.865  25.689 -28.804
  735   HG12  ILE  99          HG12      ILE  99  13.219  25.242 -26.256
  736   HG13  ILE  99          HG13      ILE  99  11.526  25.674 -26.087
  737   HG21  ILE  99          HG21      ILE  99  12.965  27.968 -26.789
  738   HG22  ILE  99          HG22      ILE  99  14.311  26.898 -27.263
  739   HG23  ILE  99          HG23      ILE  99  13.632  27.990 -28.438
  740   HD11  ILE  99          HD11      ILE  99  11.986  23.232 -26.247
  741   HD12  ILE  99          HD12      ILE  99  10.883  23.779 -27.501
  742   HD13  ILE  99          HD13      ILE  99  12.599  23.464 -27.889
  743    H    LEU 100           H        LEU 100  10.991  29.447 -28.715
  744    HA   LEU 100           HA       LEU 100  11.881  29.507 -31.569
  745    HB2  LEU 100           HB2      LEU 100  10.900  31.806 -29.856
  746    HB3  LEU 100           HB3      LEU 100  11.205  31.805 -31.592
  747    HG   LEU 100           HG       LEU 100   8.921  30.478 -30.094
  748   HD11  LEU 100          HD11      LEU 100   7.548  31.913 -31.502
  749   HD12  LEU 100          HD12      LEU 100   8.785  32.918 -30.731
  750   HD13  LEU 100          HD13      LEU 100   8.970  32.450 -32.424
  751   HD21  LEU 100          HD21      LEU 100   9.657  30.182 -33.038
  752   HD22  LEU 100          HD22      LEU 100   9.599  28.872 -31.835
  753   HD23  LEU 100          HD23      LEU 100   8.108  29.682 -32.320
  754    H    ALA 101           H        ALA 101  13.553  30.933 -32.181
  755    HA   ALA 101           HA       ALA 101  15.963  30.800 -30.708
  756    HB1  ALA 101           HB1      ALA 101  15.133  32.692 -32.953
  757    HB2  ALA 101           HB2      ALA 101  16.798  32.360 -32.447
  758    HB3  ALA 101           HB3      ALA 101  15.814  31.061 -33.152
  759    H    ASP 102           H        ASP 102  13.421  33.164 -30.424
  760    HA   ASP 102           HA       ASP 102  14.899  35.270 -29.088
  761    HB2  ASP 102           HB2      ASP 102  12.825  35.650 -30.328
  762    HB3  ASP 102           HB3      ASP 102  11.955  34.526 -29.289
  763    H    GLY 103           H        GLY 103  13.760  32.163 -28.020
  764    HA2  GLY 103           HA2      GLY 103  14.122  31.196 -25.944
  765    HA3  GLY 103           HA3      GLY 103  14.348  32.775 -25.187
  766    H    GLN 104           H        GLN 104  11.505  32.731 -27.097
  767    HA   GLN 104           HA       GLN 104   9.762  32.358 -24.745
  768    HB2  GLN 104           HB2      GLN 104   7.963  33.194 -26.100
  769    HB3  GLN 104           HB3      GLN 104   9.320  34.316 -26.074
  770    HG2  GLN 104           HG2      GLN 104  10.008  33.405 -28.345
  771    HG3  GLN 104           HG3      GLN 104   8.506  32.465 -28.353
  772   HE21  GLN 104          HE22      GLN 104   9.814  35.806 -28.088
  773   HE22  GLN 104          HE21      GLN 104   8.391  36.566 -28.813
  774    H    ILE 105           H        ILE 105   8.190  30.788 -24.707
  775    HA   ILE 105           HA       ILE 105   8.732  28.346 -26.356
  776    HB   ILE 105           HB       ILE 105   8.231  28.248 -23.390
  777   HG12  ILE 105          HG12      ILE 105  10.176  29.688 -23.415
  778   HG13  ILE 105          HG13      ILE 105  10.528  28.116 -22.750
  779   HG21  ILE 105          HG21      ILE 105   9.598  26.373 -25.332
  780   HG22  ILE 105          HG22      ILE 105   9.556  26.114 -23.578
  781   HG23  ILE 105          HG23      ILE 105   8.050  26.133 -24.504
  782   HD11  ILE 105          HD11      ILE 105  11.733  27.469 -24.772
  783   HD12  ILE 105          HD12      ILE 105  11.343  29.038 -25.530
  784   HD13  ILE 105          HD13      ILE 105  12.366  28.973 -24.100
  785    H    THR 106           H        THR 106   6.930  26.880 -26.528
  786    HA   THR 106           HA       THR 106   4.250  27.860 -26.392
  787    HB   THR 106           HB       THR 106   3.698  25.387 -26.473
  788    HG1  THR 106           HG1      THR 106   5.687  24.834 -25.386
  789   HG21  THR 106          HG21      THR 106   5.709  26.403 -28.506
  790   HG22  THR 106          HG22      THR 106   4.622  25.007 -28.717
  791   HG23  THR 106          HG23      THR 106   3.949  26.641 -28.552
  792    HA   PRO 107           HA       PRO 107   3.867  27.560 -21.853
  793    HB2  PRO 107           HB2      PRO 107   0.925  27.736 -22.507
  794    HB3  PRO 107           HB3      PRO 107   1.857  28.606 -21.252
  795    HG2  PRO 107           HG2      PRO 107   1.158  29.847 -23.561
  796    HG3  PRO 107           HG3      PRO 107   2.793  30.085 -22.867
  797    HD2  PRO 107           HD2      PRO 107   1.963  28.255 -25.131
  798    HD3  PRO 107           HD3      PRO 107   3.381  29.341 -25.010
  799    H    PHE 108           H        PHE 108   3.879  25.706 -20.658
  800    HA   PHE 108           HA       PHE 108   1.866  23.636 -20.855
  801    HB2  PHE 108           HB2      PHE 108   3.116  21.846 -21.687
  802    HB3  PHE 108           HB3      PHE 108   3.496  23.132 -22.801
  803    HD1  PHE 108           HD1      PHE 108   5.698  24.542 -22.153
  804    HD2  PHE 108           HD2      PHE 108   4.881  20.545 -20.793
  805    HE1  PHE 108           HE1      PHE 108   8.103  24.176 -21.846
  806    HE2  PHE 108           HE2      PHE 108   7.310  20.171 -20.474
  807    HZ   PHE 108           HZ       PHE 108   8.934  21.973 -21.005
  808    H    SER 109           H        SER 109   2.486  21.697 -19.433
  809    HA   SER 109           HA       SER 109   4.494  22.370 -17.381
  810    HB2  SER 109           HB2      SER 109   3.132  21.737 -15.513
  811    HB3  SER 109           HB3      SER 109   2.292  23.017 -16.396
  812    HG   SER 109           HG       SER 109   1.770  20.298 -16.998
  813    H    LEU 110           H        LEU 110   5.401  20.641 -16.347
  814    HA   LEU 110           HA       LEU 110   5.153  17.951 -17.641
  815    HB2  LEU 110           HB2      LEU 110   6.943  18.776 -18.771
  816    HB3  LEU 110           HB3      LEU 110   7.396  19.921 -17.520
  817    HG   LEU 110           HG       LEU 110   8.505  18.198 -16.225
  818   HD11  LEU 110          HD11      LEU 110   8.898  15.936 -17.229
  819   HD12  LEU 110          HD12      LEU 110   7.190  16.163 -16.853
  820   HD13  LEU 110          HD13      LEU 110   7.751  16.319 -18.529
  821   HD21  LEU 110          HD21      LEU 110   9.728  19.429 -17.960
  822   HD22  LEU 110          HD22      LEU 110  10.363  17.788 -17.762
  823   HD23  LEU 110          HD23      LEU 110   9.327  18.176 -19.151
  824    H    LEU 111           H        LEU 111   4.433  16.663 -16.084
  825    HA   LEU 111           HA       LEU 111   5.235  17.099 -13.250
  826    HB2  LEU 111           HB2      LEU 111   2.876  17.209 -13.755
  827    HB3  LEU 111           HB3      LEU 111   2.890  15.635 -14.527
  828    HG   LEU 111           HG       LEU 111   3.799  15.859 -11.658
  829   HD11  LEU 111          HD11      LEU 111   1.477  15.628 -10.863
  830   HD12  LEU 111          HD12      LEU 111   1.717  17.154 -11.722
  831   HD13  LEU 111          HD13      LEU 111   0.880  15.810 -12.530
  832   HD21  LEU 111          HD21      LEU 111   2.763  13.643 -11.440
  833   HD22  LEU 111          HD22      LEU 111   2.105  13.751 -13.083
  834   HD23  LEU 111          HD23      LEU 111   3.852  13.614 -12.827
  835    H    MET 112           H        MET 112   6.106  15.483 -12.045
  836    HA   MET 112           HA       MET 112   7.128  13.031 -13.426
  837    HB2  MET 112           HB2      MET 112   8.594  14.858 -11.464
  838    HB3  MET 112           HB3      MET 112   9.198  13.324 -12.099
  839    HG2  MET 112           HG2      MET 112   9.159  14.262 -14.392
  840    HG3  MET 112           HG3      MET 112   8.590  15.807 -13.749
  841    HE1  MET 112           HE1      MET 112  12.245  16.640 -14.855
  842    HE2  MET 112           HE2      MET 112  11.146  15.490 -15.650
  843    HE3  MET 112           HE3      MET 112  10.521  17.037 -15.025
  844    H    ALA 113           H        ALA 113   6.615  11.229 -12.374
  845    HA   ALA 113           HA       ALA 113   5.854  11.319  -9.485
  846    HB1  ALA 113           HB1      ALA 113   4.612   9.715 -11.768
  847    HB2  ALA 113           HB2      ALA 113   4.130   9.634 -10.061
  848    HB3  ALA 113           HB3      ALA 113   3.879  11.130 -10.985
  849    H    ASN 114           H        ASN 114   6.388   9.595  -8.226
  850    HA   ASN 114           HA       ASN 114   8.870   8.214  -8.877
  851    HB2  ASN 114           HB2      ASN 114   8.491   9.117  -6.700
  852    HB3  ASN 114           HB3      ASN 114   6.943   8.280  -6.515
  853   HD21  ASN 114          HD22      ASN 114   8.717   8.104  -4.516
  854   HD22  ASN 114          HD21      ASN 114   9.215   6.422  -4.459
  855    H    ALA 115           H        ALA 115   8.783   6.621 -10.338
  856    HA   ALA 115           HA       ALA 115   6.459   5.111 -11.001
  857    HB1  ALA 115           HB1      ALA 115   8.250   5.634 -12.579
  858    HB2  ALA 115           HB2      ALA 115   9.402   4.647 -11.649
  859    HB3  ALA 115           HB3      ALA 115   8.025   3.883 -12.473
  860    H    GLY 116           H        GLY 116   8.861   4.553  -8.532
  861    HA2  GLY 116           HA2      GLY 116   8.265   1.645  -8.293
  862    HA3  GLY 116           HA3      GLY 116   9.567   2.525  -7.510
  863    H    THR 117           H        THR 117   7.149   4.557  -6.871
  864    HA   THR 117           HA       THR 117   6.059   3.050  -4.510
  865    HB   THR 117           HB       THR 117   6.718   5.995  -4.573
  866    HG1  THR 117           HG1      THR 117   8.257   4.917  -2.882
  867   HG21  THR 117          HG21      THR 117   5.031   5.588  -2.921
  868   HG22  THR 117          HG22      THR 117   5.861   4.133  -2.331
  869   HG23  THR 117          HG23      THR 117   6.567   5.752  -2.073
  870    H    GLY 118           H        GLY 118   5.281   5.334  -7.160
  871    HA2  GLY 118           HA2      GLY 118   3.223   5.062  -8.245
  872    HA3  GLY 118           HA3      GLY 118   2.458   4.532  -6.753
  873    H    GLU 119           H        GLU 119   4.353   7.555  -6.818
  874    HA   GLU 119           HA       GLU 119   1.819   9.134  -6.651
  875    HB2  GLU 119           HB2      GLU 119   4.063   9.032  -4.605
  876    HB3  GLU 119           HB3      GLU 119   2.791  10.246  -4.607
  877    HG2  GLU 119           HG2      GLU 119   2.423   7.246  -4.215
  878    HG3  GLU 119           HG3      GLU 119   2.373   8.478  -2.967
  879    HA   PRO 120           HA       PRO 120   4.121  12.320  -8.907
  880    HB2  PRO 120           HB2      PRO 120   2.413  14.145  -7.243
  881    HB3  PRO 120           HB3      PRO 120   2.802  14.229  -8.992
  882    HG2  PRO 120           HG2      PRO 120   0.410  13.248  -8.162
  883    HG3  PRO 120           HG3      PRO 120   1.313  12.411  -9.468
  884    HD2  PRO 120           HD2      PRO 120   1.174  11.699  -6.526
  885    HD3  PRO 120           HD3      PRO 120   1.043  10.634  -7.962
  886    H    LEU 121           H        LEU 121   5.862  13.631  -8.535
  887    HA   LEU 121           HA       LEU 121   6.880  13.923  -5.747
  888    HB2  LEU 121           HB2      LEU 121   7.667  12.255  -7.898
  889    HB3  LEU 121           HB3      LEU 121   8.779  13.593  -8.007
  890    HG   LEU 121           HG       LEU 121   9.667  11.793  -6.761
  891   HD11  LEU 121          HD11      LEU 121   9.021  14.092  -4.858
  892   HD12  LEU 121          HD12      LEU 121  10.328  12.910  -4.674
  893   HD13  LEU 121          HD13      LEU 121  10.343  14.056  -6.047
  894   HD21  LEU 121          HD21      LEU 121   8.793  10.911  -4.703
  895   HD22  LEU 121          HD22      LEU 121   7.549  12.167  -4.596
  896   HD23  LEU 121          HD23      LEU 121   7.432  10.932  -5.852
  897    H    LEU 122           H        LEU 122   7.102  15.262  -9.044
  898    HA   LEU 122           HA       LEU 122   7.601  17.984  -8.000
  899    HB2  LEU 122           HB2      LEU 122   9.756  16.371  -8.399
  900    HB3  LEU 122           HB3      LEU 122   9.593  16.977 -10.034
  901    HG   LEU 122           HG       LEU 122   9.700  18.861  -7.635
  902   HD11  LEU 122          HD11      LEU 122  12.061  17.662  -9.137
  903   HD12  LEU 122          HD12      LEU 122  12.143  18.956  -7.915
  904   HD13  LEU 122          HD13      LEU 122  11.609  17.338  -7.446
  905   HD21  LEU 122          HD21      LEU 122  10.790  20.391  -9.232
  906   HD22  LEU 122          HD22      LEU 122  10.665  19.162 -10.519
  907   HD23  LEU 122          HD23      LEU 122   9.214  19.926  -9.839
  908    H    THR 123           H        THR 123   7.268  19.601  -9.629
  909    HA   THR 123           HA       THR 123   6.390  18.712 -12.306
  910    HB   THR 123           HB       THR 123   4.560  20.341 -10.485
  911    HG1  THR 123           HG1      THR 123   4.905  17.710 -10.851
  912   HG21  THR 123          HG21      THR 123   4.142  19.302 -13.315
  913   HG22  THR 123          HG22      THR 123   2.891  20.009 -12.278
  914   HG23  THR 123          HG23      THR 123   4.237  21.015 -12.825
  915    H    LEU 124           H        LEU 124   6.713  20.142 -13.858
  916    HA   LEU 124           HA       LEU 124   8.051  22.720 -13.207
  917    HB2  LEU 124           HB2      LEU 124   8.423  20.665 -15.422
  918    HB3  LEU 124           HB3      LEU 124   8.920  22.335 -15.636
  919    HG   LEU 124           HG       LEU 124  10.497  22.209 -13.809
  920   HD11  LEU 124          HD11      LEU 124   9.574  20.583 -12.294
  921   HD12  LEU 124          HD12      LEU 124   9.575  19.313 -13.549
  922   HD13  LEU 124          HD13      LEU 124  11.094  19.934 -12.877
  923   HD21  LEU 124          HD21      LEU 124  10.807  19.888 -15.749
  924   HD22  LEU 124          HD22      LEU 124  11.160  21.596 -16.113
  925   HD23  LEU 124          HD23      LEU 124  12.112  20.741 -14.893
  926    H    VAL 125           H        VAL 125   7.530  24.507 -14.496
  927    HA   VAL 125           HA       VAL 125   5.041  24.342 -16.145
  928    HB   VAL 125           HB       VAL 125   5.316  26.315 -13.848
  929   HG11  VAL 125          HG11      VAL 125   3.875  27.143 -15.657
  930   HG12  VAL 125          HG12      VAL 125   2.972  25.609 -15.672
  931   HG13  VAL 125          HG13      VAL 125   2.891  26.697 -14.270
  932   HG21  VAL 125          HG21      VAL 125   3.634  23.774 -13.957
  933   HG22  VAL 125          HG22      VAL 125   4.973  24.112 -12.836
  934   HG23  VAL 125          HG23      VAL 125   3.492  25.052 -12.726
  935    H    CYS 126           H        CYS 126   4.925  25.693 -17.836
  936    HA   CYS 126           HA       CYS 126   6.926  27.910 -18.053
  937    HB2  CYS 126           HB2      CYS 126   7.203  25.896 -19.659
  938    HB3  CYS 126           HB3      CYS 126   5.676  26.387 -20.373
  939    HG   CYS 126           HG       CYS 126   8.459  28.168 -19.953
  940    H    SER 127           H        SER 127   5.872  29.792 -17.690
  941    HA   SER 127           HA       SER 127   3.109  30.293 -18.405
  942    HB2  SER 127           HB2      SER 127   5.333  32.259 -17.733
  943    HB3  SER 127           HB3      SER 127   3.590  32.589 -17.723
  944    HG   SER 127           HG       SER 127   4.397  32.117 -15.630
  945    H    GLY 128           H        GLY 128   5.909  30.200 -20.353
  946    HA2  GLY 128           HA2      GLY 128   5.177  30.526 -22.794
  947    HA3  GLY 128           HA3      GLY 128   4.888  32.202 -22.335
  948    H    SER 129           H        SER 129   7.623  31.345 -20.588
  949    HA   SER 129           HA       SER 129   9.573  31.804 -22.749
  950    HB2  SER 129           HB2      SER 129   8.632  34.054 -22.087
  951    HB3  SER 129           HB3      SER 129   9.308  33.788 -20.466
  952    HG   SER 129           HG       SER 129  10.726  34.954 -21.868
  953    H    TRP 130           H        TRP 130  11.715  31.534 -22.170
  954    HA   TRP 130           HA       TRP 130  12.353  29.466 -20.391
  955    HB2  TRP 130           HB2      TRP 130  13.695  29.857 -22.266
  956    HB3  TRP 130           HB3      TRP 130  13.845  31.575 -21.948
  957    HD1  TRP 130           HD1      TRP 130  15.818  32.450 -20.629
  958    HE1  TRP 130           HE1      TRP 130  17.854  31.437 -19.444
  959    HE3  TRP 130           HE3      TRP 130  14.556  27.492 -20.951
  960    HZ2  TRP 130           HZ2      TRP 130  18.802  28.823 -18.699
  961    HZ3  TRP 130           HZ3      TRP 130  16.029  25.772 -19.929
  962    HH2  TRP 130           HH2      TRP 130  18.140  26.424 -18.813
  963    HA   PRO 131           HA       PRO 131  13.322  28.396 -18.963
  964    HB2  PRO 131           HB2      PRO 131  14.200  27.551 -16.576
  965    HB3  PRO 131           HB3      PRO 131  15.295  28.413 -17.688
  966    HG2  PRO 131           HG2      PRO 131  13.813  29.528 -15.312
  967    HG3  PRO 131           HG3      PRO 131  15.533  29.739 -15.775
  968    HD2  PRO 131           HD2      PRO 131  13.500  31.564 -16.396
  969    HD3  PRO 131           HD3      PRO 131  14.997  31.377 -17.352
  970    H    LEU 132           H        LEU 132  12.245  26.533 -17.591
  971    HA   LEU 132           HA       LEU 132   9.559  27.295 -16.787
  972    HB2  LEU 132           HB2      LEU 132  11.089  24.654 -16.824
  973    HB3  LEU 132           HB3      LEU 132   9.555  24.832 -15.987
  974    HG   LEU 132           HG       LEU 132   8.673  25.863 -18.196
  975   HD11  LEU 132          HD11      LEU 132  10.761  25.972 -19.467
  976   HD12  LEU 132          HD12      LEU 132  10.998  24.220 -19.254
  977   HD13  LEU 132          HD13      LEU 132   9.652  24.839 -20.232
  978   HD21  LEU 132          HD21      LEU 132   9.208  22.875 -18.072
  979   HD22  LEU 132          HD22      LEU 132   7.894  23.727 -17.229
  980   HD23  LEU 132          HD23      LEU 132   7.913  23.703 -18.973
  981    H    ASP 133           H        ASP 133   8.639  26.913 -14.825
  982    HA   ASP 133           HA       ASP 133  10.249  27.582 -12.419
  983    HB2  ASP 133           HB2      ASP 133   8.090  28.766 -12.964
  984    HB3  ASP 133           HB3      ASP 133   7.248  27.222 -12.816
  985    H    GLN 134           H        GLN 134   9.580  26.245 -10.439
  986    HA   GLN 134           HA       GLN 134   9.095  23.354 -11.003
  987    HB2  GLN 134           HB2      GLN 134  11.482  24.508  -9.498
  988    HB3  GLN 134           HB3      GLN 134  10.929  22.844  -9.304
  989    HG2  GLN 134           HG2      GLN 134  11.292  22.397 -11.688
  990    HG3  GLN 134           HG3      GLN 134  11.864  24.054 -11.935
  991   HE21  GLN 134          HE22      GLN 134  12.603  20.966 -10.204
  992   HE22  GLN 134          HE21      GLN 134  14.312  21.333 -10.049
  993    H    THR 135           H        THR 135   8.073  22.244  -9.399
  994    HA   THR 135           HA       THR 135   7.785  23.338  -6.668
  995    HB   THR 135           HB       THR 135   5.920  24.323  -7.974
  996    HG1  THR 135           HG1      THR 135   5.087  24.174  -6.114
  997   HG21  THR 135          HG21      THR 135   4.911  21.473  -8.302
  998   HG22  THR 135          HG22      THR 135   4.031  22.971  -8.697
  999   HG23  THR 135          HG23      THR 135   5.470  22.536  -9.617
 1000    H    LEU 136           H        LEU 136   6.974  21.721  -5.159
 1001    HA   LEU 136           HA       LEU 136   7.584  18.927  -5.928
 1002    HB2  LEU 136           HB2      LEU 136   6.726  20.257  -3.328
 1003    HB3  LEU 136           HB3      LEU 136   6.759  18.517  -3.531
 1004    HG   LEU 136           HG       LEU 136   8.718  19.251  -2.358
 1005   HD11  LEU 136          HD11      LEU 136   9.560  18.345  -5.136
 1006   HD12  LEU 136          HD12      LEU 136  10.452  18.150  -3.617
 1007   HD13  LEU 136          HD13      LEU 136   8.922  17.288  -3.858
 1008   HD21  LEU 136          HD21      LEU 136  10.464  20.619  -3.261
 1009   HD22  LEU 136          HD22      LEU 136   9.627  20.792  -4.811
 1010   HD23  LEU 136          HD23      LEU 136   8.949  21.533  -3.339
 1011    H    ALA 137           H        ALA 137   6.108  17.435  -6.383
 1012    HA   ALA 137           HA       ALA 137   4.183  16.806  -7.547
 1013    HB1  ALA 137           HB1      ALA 137   4.354  15.733  -5.343
 1014    HB2  ALA 137           HB2      ALA 137   3.409  17.047  -4.611
 1015    HB3  ALA 137           HB3      ALA 137   2.650  15.960  -5.788
 1016    H    ARG 138           H        ARG 138   3.970  18.957  -8.674
 1017    HA   ARG 138           HA       ARG 138   2.938  20.842  -9.374
 1018    HB2  ARG 138           HB2      ARG 138   0.739  20.481 -10.234
 1019    HB3  ARG 138           HB3      ARG 138   1.779  19.107 -10.482
 1020    HG2  ARG 138           HG2      ARG 138  -0.445  18.368  -9.987
 1021    HG3  ARG 138           HG3      ARG 138   0.647  17.840  -8.711
 1022    HD2  ARG 138           HD2      ARG 138  -0.126  19.713  -7.281
 1023    HD3  ARG 138           HD3      ARG 138  -1.133  20.307  -8.593
 1024    HE   ARG 138           HE       ARG 138  -2.707  18.623  -8.169
 1025   HH11  ARG 138          HH21      ARG 138   0.130  17.930  -6.198
 1026   HH12  ARG 138          HH22      ARG 138  -0.741  16.753  -5.248
 1027   HH21  ARG 138          HH11      ARG 138  -3.707  17.094  -6.923
 1028   HH22  ARG 138          HH12      ARG 138  -2.832  16.290  -5.659
 1029    H    ASP 139           H        ASP 139   2.928  20.802  -6.255
 1030    HA   ASP 139           HA       ASP 139   0.590  21.924  -5.324
 1031    HB2  ASP 139           HB2      ASP 139   2.461  21.070  -3.975
 1032    HB3  ASP 139           HB3      ASP 139   3.420  22.492  -4.392
 1033    H    THR 140           H        THR 140   3.209  23.779  -6.836
 1034    HA   THR 140           HA       THR 140   1.831  26.340  -6.372
 1035    HB   THR 140           HB       THR 140   4.304  25.973  -8.074
 1036    HG1  THR 140           HG1      THR 140   5.378  26.418  -6.014
 1037   HG21  THR 140          HG21      THR 140   3.464  28.280  -8.021
 1038   HG22  THR 140          HG22      THR 140   3.338  28.222  -6.248
 1039   HG23  THR 140          HG23      THR 140   4.925  28.173  -7.049
 1040    H    ARG 141           H        ARG 141   1.448  23.964  -8.785
 1041    HA   ARG 141           HA       ARG 141   1.344  25.640 -11.134
 1042    HB2  ARG 141           HB2      ARG 141   1.776  23.197 -11.163
 1043    HB3  ARG 141           HB3      ARG 141   0.094  22.900 -10.714
 1044    HG2  ARG 141           HG2      ARG 141  -0.674  23.985 -12.809
 1045    HG3  ARG 141           HG3      ARG 141   0.995  24.398 -13.215
 1046    HD2  ARG 141           HD2      ARG 141   0.328  22.492 -14.509
 1047    HD3  ARG 141           HD3      ARG 141   1.551  21.975 -13.337
 1048    HE   ARG 141           HE       ARG 141  -0.999  21.543 -12.164
 1049   HH11  ARG 141          HH11      ARG 141   0.655  20.298 -14.992
 1050   HH12  ARG 141          HH12      ARG 141  -0.071  18.722 -14.820
 1051   HH21  ARG 141          HH21      ARG 141  -1.962  19.539 -12.082
 1052   HH22  ARG 141          HH22      ARG 141  -1.536  18.329 -13.246
 1053    HA   PRO 142           HA       PRO 142  -3.550  25.546 -10.401
 1054    HB2  PRO 142           HB2      PRO 142  -3.311  26.117  -7.438
 1055    HB3  PRO 142           HB3      PRO 142  -4.680  25.394  -8.341
 1056    HG2  PRO 142           HG2      PRO 142  -2.952  23.795  -7.015
 1057    HG3  PRO 142           HG3      PRO 142  -3.468  23.353  -8.677
 1058    HD2  PRO 142           HD2      PRO 142  -0.905  24.673  -7.786
 1059    HD3  PRO 142           HD3      PRO 142  -1.153  23.367  -8.981
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1  12.441  -0.642   3.027
    2    H2   MET   1           H2       MET   1  13.956  -0.032   3.178
    3    H3   MET   1           H3       MET   1  12.802   0.353   4.267
    4    HA   MET   1           HA       MET   1  13.153   2.208   2.836
    5    HB2  MET   1           HB2      MET   1  12.756   2.129   0.460
    6    HB3  MET   1           HB3      MET   1  14.015   0.985   0.888
    7    HG2  MET   1           HG2      MET   1  12.466  -0.894   0.620
    8    HG3  MET   1           HG3      MET   1  11.108   0.211   0.409
    9    HE1  MET   1           HE1      MET   1  14.434  -0.488  -2.757
   10    HE2  MET   1           HE2      MET   1  14.777   0.409  -1.266
   11    HE3  MET   1           HE3      MET   1  14.351  -1.318  -1.189
   12    H    ALA   2           H        ALA   2  11.353   3.486   1.703
   13    HA   ALA   2           HA       ALA   2   8.611   2.562   2.294
   14    HB1  ALA   2           HB1      ALA   2   9.412   3.639   4.388
   15    HB2  ALA   2           HB2      ALA   2   9.836   5.103   3.473
   16    HB3  ALA   2           HB3      ALA   2   8.139   4.598   3.619
   17    H    TYR   3           H        TYR   3   7.036   4.331   1.560
   18    HA   TYR   3           HA       TYR   3   7.493   4.869  -1.226
   19    HB2  TYR   3           HB2      TYR   3   5.153   5.576   0.580
   20    HB3  TYR   3           HB3      TYR   3   5.158   5.629  -1.173
   21    HD1  TYR   3           HD1      TYR   3   5.924   3.405  -2.399
   22    HD2  TYR   3           HD2      TYR   3   4.281   3.607   1.585
   23    HE1  TYR   3           HE1      TYR   3   5.228   1.018  -2.565
   24    HE2  TYR   3           HE2      TYR   3   3.592   1.223   1.423
   25    HH   TYR   3           HH       TYR   3   3.545  -0.661   0.120
   26    H    GLY   4           H        GLY   4   9.431   6.292  -0.199
   27    HA2  GLY   4           HA2      GLY   4   9.181   8.892  -1.316
   28    HA3  GLY   4           HA3      GLY   4   9.076   9.042   0.445
   29    H    ARG   5           H        ARG   5  11.188   9.016  -2.118
   30    HA   ARG   5           HA       ARG   5  13.362   8.561  -2.544
   31    HB2  ARG   5           HB2      ARG   5  13.391  10.393  -0.623
   32    HB3  ARG   5           HB3      ARG   5  14.156   9.112   0.314
   33    HG2  ARG   5           HG2      ARG   5  15.821   8.879  -1.663
   34    HG3  ARG   5           HG3      ARG   5  15.098  10.346  -2.319
   35    HD2  ARG   5           HD2      ARG   5  16.684   9.996   0.242
   36    HD3  ARG   5           HD3      ARG   5  17.096  10.995  -1.148
   37    HE   ARG   5           HE       ARG   5  15.380  11.670   1.104
   38   HH11  ARG   5          HH21      ARG   5  16.096  12.721  -2.209
   39   HH12  ARG   5          HH22      ARG   5  14.993  14.069  -2.034
   40   HH21  ARG   5          HH11      ARG   5  14.112  13.472   1.181
   41   HH22  ARG   5          HH12      ARG   5  13.890  14.422  -0.265
   42    H    GLU   6           H        GLU   6  11.899   6.419  -2.200
   43    HA   GLU   6           HA       GLU   6  12.695   4.200  -0.715
   44    HB2  GLU   6           HB2      GLU   6  11.785   2.894  -2.518
   45    HB3  GLU   6           HB3      GLU   6  10.785   4.311  -2.268
   46    HG2  GLU   6           HG2      GLU   6  12.673   3.755  -4.575
   47    HG3  GLU   6           HG3      GLU   6  10.923   3.932  -4.621
   48    H    ASP   7           H        ASP   7  14.227   5.492  -3.661
   49    HA   ASP   7           HA       ASP   7  16.829   4.587  -2.706
   50    HB2  ASP   7           HB2      ASP   7  15.908   2.642  -4.067
   51    HB3  ASP   7           HB3      ASP   7  15.880   3.713  -5.465
   52    H    VAL   8           H        VAL   8  14.879   6.430  -5.054
   53    HA   VAL   8           HA       VAL   8  16.957   8.518  -5.175
   54    HB   VAL   8           HB       VAL   8  16.256   8.053  -7.919
   55   HG11  VAL   8          HG11      VAL   8  18.649   7.981  -8.264
   56   HG12  VAL   8          HG12      VAL   8  18.251   9.221  -7.065
   57   HG13  VAL   8          HG13      VAL   8  18.923   7.663  -6.533
   58   HG21  VAL   8          HG21      VAL   8  17.558   5.549  -6.884
   59   HG22  VAL   8          HG22      VAL   8  15.872   5.676  -7.453
   60   HG23  VAL   8          HG23      VAL   8  17.210   6.000  -8.561
   61    H    ALA   9           H        ALA   9  13.591   7.615  -5.992
   62    HA   ALA   9           HA       ALA   9  12.966   9.456  -7.887
   63    HB1  ALA   9           HB1      ALA   9  11.215   8.667  -5.551
   64    HB2  ALA   9           HB2      ALA   9  10.656   9.306  -7.111
   65    HB3  ALA   9           HB3      ALA   9  11.466   7.730  -7.038
   66    H    ASN  10           H        ASN  10  12.700  10.365  -4.408
   67    HA   ASN  10           HA       ASN  10  11.804  13.020  -4.974
   68    HB2  ASN  10           HB2      ASN  10  11.461  11.751  -2.849
   69    HB3  ASN  10           HB3      ASN  10  13.157  12.014  -2.457
   70   HD21  ASN  10          HD22      ASN  10   9.962  13.476  -2.649
   71   HD22  ASN  10          HD21      ASN  10  10.435  14.996  -1.925
   72    H    THR  11           H        THR  11  15.022  11.733  -5.067
   73    HA   THR  11           HA       THR  11  16.321  14.416  -5.077
   74    HB   THR  11           HB       THR  11  17.576  11.674  -5.501
   75    HG1  THR  11           HG1      THR  11  18.062  11.746  -3.314
   76   HG21  THR  11          HG21      THR  11  18.729  14.290  -4.448
   77   HG22  THR  11          HG22      THR  11  19.602  12.755  -4.673
   78   HG23  THR  11          HG23      THR  11  18.993  13.635  -6.082
   79    H    ARG  12           H        ARG  12  16.011  11.520  -7.146
   80    HA   ARG  12           HA       ARG  12  17.286  12.474  -9.459
   81    HB2  ARG  12           HB2      ARG  12  16.923  10.134  -8.947
   82    HB3  ARG  12           HB3      ARG  12  15.181  10.315  -9.043
   83    HG2  ARG  12           HG2      ARG  12  16.106   9.158 -10.976
   84    HG3  ARG  12           HG3      ARG  12  15.314  10.654 -11.475
   85    HD2  ARG  12           HD2      ARG  12  17.332  11.731 -11.981
   86    HD3  ARG  12           HD3      ARG  12  18.289  10.623 -10.986
   87    HE   ARG  12           HE       ARG  12  18.264   8.976 -12.678
   88   HH11  ARG  12          HH11      ARG  12  16.373  11.721 -13.848
   89   HH12  ARG  12          HH12      ARG  12  16.301  11.059 -15.432
   90   HH21  ARG  12          HH21      ARG  12  18.224   8.285 -14.602
   91   HH22  ARG  12          HH22      ARG  12  17.531   9.185 -15.958
   92    H    ALA  13           H        ALA  13  13.813  12.874  -8.572
   93    HA   ALA  13           HA       ALA  13  12.974  13.922 -11.085
   94    HB1  ALA  13           HB1      ALA  13  11.483  13.355  -9.189
   95    HB2  ALA  13           HB2      ALA  13  12.116  14.757  -8.294
   96    HB3  ALA  13           HB3      ALA  13  11.205  14.992  -9.807
   97    H    ARG  14           H        ARG  14  14.530  15.573  -8.317
   98    HA   ARG  14           HA       ARG  14  14.400  18.257  -9.410
   99    HB2  ARG  14           HB2      ARG  14  16.371  17.205  -7.338
  100    HB3  ARG  14           HB3      ARG  14  15.839  18.869  -7.572
  101    HG2  ARG  14           HG2      ARG  14  13.538  18.228  -6.820
  102    HG3  ARG  14           HG3      ARG  14  14.094  16.558  -6.593
  103    HD2  ARG  14           HD2      ARG  14  15.885  17.488  -5.031
  104    HD3  ARG  14           HD3      ARG  14  15.007  19.023  -5.087
  105    HE   ARG  14           HE       ARG  14  13.792  16.409  -4.204
  106   HH11  ARG  14          HH11      ARG  14  14.196  19.844  -3.556
  107   HH12  ARG  14          HH12      ARG  14  13.322  19.748  -2.057
  108   HH21  ARG  14          HH21      ARG  14  12.787  16.362  -2.239
  109   HH22  ARG  14          HH22      ARG  14  12.536  17.838  -1.346
  110    H    GLU  15           H        GLU  15  16.902  15.743  -9.344
  111    HA   GLU  15           HA       GLU  15  18.891  17.160 -10.881
  112    HB2  GLU  15           HB2      GLU  15  18.326  14.175 -10.580
  113    HB3  GLU  15           HB3      GLU  15  19.746  14.850 -11.392
  114    HG2  GLU  15           HG2      GLU  15  20.371  16.023  -9.276
  115    HG3  GLU  15           HG3      GLU  15  19.020  15.240  -8.457
  116    H    THR  16           H        THR  16  16.216  15.028 -11.914
  117    HA   THR  16           HA       THR  16  16.721  15.112 -14.719
  118    HB   THR  16           HB       THR  16  14.010  14.874 -13.352
  119    HG1  THR  16           HG1      THR  16  15.354  13.319 -12.585
  120   HG21  THR  16          HG21      THR  16  13.443  13.518 -15.357
  121   HG22  THR  16          HG22      THR  16  13.761  15.210 -15.770
  122   HG23  THR  16          HG23      THR  16  14.998  13.972 -16.084
  123    H    ALA  17           H        ALA  17  14.779  17.285 -12.655
  124    HA   ALA  17           HA       ALA  17  13.974  19.027 -14.768
  125    HB1  ALA  17           HB1      ALA  17  12.861  18.914 -12.576
  126    HB2  ALA  17           HB2      ALA  17  14.322  19.536 -11.784
  127    HB3  ALA  17           HB3      ALA  17  13.422  20.572 -12.908
  128    H    ALA  18           H        ALA  18  16.855  19.225 -12.603
  129    HA   ALA  18           HA       ALA  18  17.893  21.640 -13.736
  130    HB1  ALA  18           HB1      ALA  18  20.013  20.908 -12.713
  131    HB2  ALA  18           HB2      ALA  18  18.653  20.663 -11.600
  132    HB3  ALA  18           HB3      ALA  18  19.354  19.278 -12.465
  133    H    ARG  19           H        ARG  19  18.463  18.217 -14.611
  134    HA   ARG  19           HA       ARG  19  20.246  18.594 -16.829
  135    HB2  ARG  19           HB2      ARG  19  19.838  16.440 -15.680
  136    HB3  ARG  19           HB3      ARG  19  18.169  16.443 -16.237
  137    HG2  ARG  19           HG2      ARG  19  19.055  16.334 -18.628
  138    HG3  ARG  19           HG3      ARG  19  20.671  16.110 -17.945
  139    HD2  ARG  19           HD2      ARG  19  19.988  14.089 -16.806
  140    HD3  ARG  19           HD3      ARG  19  18.283  14.360 -17.200
  141    HE   ARG  19           HE       ARG  19  19.290  14.178 -19.687
  142   HH11  ARG  19          HH11      ARG  19  19.818  12.028 -16.927
  143   HH12  ARG  19          HH12      ARG  19  20.036  10.653 -18.016
  144   HH21  ARG  19          HH21      ARG  19  19.590  12.223 -20.919
  145   HH22  ARG  19          HH22      ARG  19  19.972  10.777 -19.973
  146    H    PHE  20           H        PHE  20  16.678  18.334 -16.753
  147    HA   PHE  20           HA       PHE  20  16.239  18.741 -19.525
  148    HB2  PHE  20           HB2      PHE  20  14.595  17.808 -17.955
  149    HB3  PHE  20           HB3      PHE  20  14.467  19.362 -17.137
  150    HD1  PHE  20           HD2      PHE  20  14.222  17.892 -20.601
  151    HD2  PHE  20           HD1      PHE  20  12.728  20.814 -17.801
  152    HE1  PHE  20           HE2      PHE  20  12.352  18.423 -22.134
  153    HE2  PHE  20           HE1      PHE  20  10.909  21.405 -19.389
  154    HZ   PHE  20           HZ       PHE  20  10.708  20.186 -21.555
  155    H    THR  21           H        THR  21  16.336  21.175 -16.866
  156    HA   THR  21           HA       THR  21  15.753  23.427 -18.526
  157    HB   THR  21           HB       THR  21  17.467  23.413 -16.011
  158    HG1  THR  21           HG1      THR  21  15.501  22.485 -15.579
  159   HG21  THR  21          HG21      THR  21  15.815  25.602 -17.371
  160   HG22  THR  21          HG22      THR  21  16.473  25.721 -15.730
  161   HG23  THR  21          HG23      THR  21  17.574  25.591 -17.103
  162    H    ALA  22           H        ALA  22  18.967  21.982 -17.663
  163    HA   ALA  22           HA       ALA  22  20.495  23.756 -19.300
  164    HB1  ALA  22           HB1      ALA  22  22.241  22.024 -19.100
  165    HB2  ALA  22           HB2      ALA  22  21.449  22.314 -17.538
  166    HB3  ALA  22           HB3      ALA  22  21.042  20.866 -18.486
  167    H    ALA  23           H        ALA  23  18.973  20.622 -20.113
  168    HA   ALA  23           HA       ALA  23  19.921  20.531 -22.802
  169    HB1  ALA  23           HB1      ALA  23  17.424  19.244 -21.665
  170    HB2  ALA  23           HB2      ALA  23  18.375  18.730 -23.080
  171    HB3  ALA  23           HB3      ALA  23  19.082  18.609 -21.468
  172    H    LEU  24           H        LEU  24  17.005  22.058 -21.417
  173    HA   LEU  24           HA       LEU  24  15.863  22.853 -23.937
  174    HB2  LEU  24           HB2      LEU  24  14.709  22.611 -21.688
  175    HB3  LEU  24           HB3      LEU  24  15.522  24.082 -21.183
  176    HG   LEU  24           HG       LEU  24  14.343  25.256 -23.153
  177   HD11  LEU  24          HD11      LEU  24  12.279  24.129 -23.982
  178   HD12  LEU  24          HD12      LEU  24  13.721  23.224 -24.465
  179   HD13  LEU  24          HD13      LEU  24  12.720  22.654 -23.112
  180   HD21  LEU  24          HD21      LEU  24  12.198  25.388 -21.930
  181   HD22  LEU  24          HD22      LEU  24  12.641  23.932 -21.008
  182   HD23  LEU  24          HD23      LEU  24  13.571  25.434 -20.808
  183    H    GLU  25           H        GLU  25  18.279  24.368 -21.762
  184    HA   GLU  25           HA       GLU  25  18.548  26.824 -23.247
  185    HB2  GLU  25           HB2      GLU  25  19.563  26.263 -20.948
  186    HB3  GLU  25           HB3      GLU  25  20.821  25.396 -21.824
  187    HG2  GLU  25           HG2      GLU  25  21.350  27.488 -23.089
  188    HG3  GLU  25           HG3      GLU  25  20.112  28.338 -22.163
  189    H    LEU  26           H        LEU  26  20.208  23.666 -23.532
  190    HA   LEU  26           HA       LEU  26  21.738  24.103 -25.878
  191    HB2  LEU  26           HB2      LEU  26  22.244  22.109 -24.883
  192    HB3  LEU  26           HB3      LEU  26  20.619  21.833 -24.353
  193    HG   LEU  26           HG       LEU  26  20.036  21.158 -26.776
  194   HD11  LEU  26          HD11      LEU  26  22.089  22.077 -27.842
  195   HD12  LEU  26          HD12      LEU  26  23.072  20.930 -26.905
  196   HD13  LEU  26          HD13      LEU  26  21.912  20.337 -28.114
  197   HD21  LEU  26          HD21      LEU  26  20.902  18.885 -26.420
  198   HD22  LEU  26          HD22      LEU  26  21.936  19.487 -25.102
  199   HD23  LEU  26          HD23      LEU  26  20.161  19.559 -24.966
  200    H    ALA  27           H        ALA  27  18.310  23.122 -25.612
  201    HA   ALA  27           HA       ALA  27  17.809  23.005 -28.403
  202    HB1  ALA  27           HB1      ALA  27  16.337  22.033 -26.681
  203    HB2  ALA  27           HB2      ALA  27  15.879  23.660 -26.139
  204    HB3  ALA  27           HB3      ALA  27  15.440  23.123 -27.764
  205    H    ILE  28           H        ILE  28  17.536  25.831 -26.182
  206    HA   ILE  28           HA       ILE  28  16.617  27.699 -28.186
  207    HB   ILE  28           HB       ILE  28  18.164  28.139 -25.600
  208   HG12  ILE  28          HG12      ILE  28  15.222  28.674 -26.168
  209   HG13  ILE  28          HG13      ILE  28  15.776  27.127 -25.544
  210   HG21  ILE  28          HG21      ILE  28  17.383  30.516 -25.773
  211   HG22  ILE  28          HG22      ILE  28  18.505  30.096 -27.055
  212   HG23  ILE  28          HG23      ILE  28  16.765  30.174 -27.402
  213   HD11  ILE  28          HD11      ILE  28  15.974  29.787 -24.131
  214   HD12  ILE  28          HD12      ILE  28  15.017  28.350 -23.706
  215   HD13  ILE  28          HD13      ILE  28  16.783  28.298 -23.579
  216    H    ASP  29           H        ASP  29  19.928  26.851 -27.053
  217    HA   ASP  29           HA       ASP  29  21.325  28.605 -28.792
  218    HB2  ASP  29           HB2      ASP  29  22.305  27.445 -26.839
  219    HB3  ASP  29           HB3      ASP  29  22.183  25.905 -27.688
  220    H    ARG  30           H        ARG  30  20.180  25.270 -29.389
  221    HA   ARG  30           HA       ARG  30  21.244  25.292 -32.110
  222    HB2  ARG  30           HB2      ARG  30  20.274  23.305 -30.365
  223    HB3  ARG  30           HB3      ARG  30  19.047  23.356 -31.610
  224    HG2  ARG  30           HG2      ARG  30  22.043  22.955 -32.055
  225    HG3  ARG  30           HG3      ARG  30  20.823  21.682 -32.006
  226    HD2  ARG  30           HD2      ARG  30  19.689  22.772 -33.974
  227    HD3  ARG  30           HD3      ARG  30  21.058  23.883 -34.092
  228    HE   ARG  30           HE       ARG  30  22.206  21.345 -34.085
  229   HH11  ARG  30          HH11      ARG  30  19.980  23.006 -36.252
  230   HH12  ARG  30          HH12      ARG  30  20.491  22.033 -37.610
  231   HH21  ARG  30          HH21      ARG  30  22.745  20.154 -35.882
  232   HH22  ARG  30          HH22      ARG  30  21.914  20.423 -37.390
  233    H    ALA  31           H        ALA  31  18.061  26.190 -30.733
  234    HA   ALA  31           HA       ALA  31  16.768  26.556 -33.265
  235    HB1  ALA  31           HB1      ALA  31  15.592  26.467 -31.055
  236    HB2  ALA  31           HB2      ALA  31  16.284  28.045 -30.641
  237    HB3  ALA  31           HB3      ALA  31  15.156  27.893 -32.005
  238    H    THR  32           H        THR  32  18.928  28.722 -31.415
  239    HA   THR  32           HA       THR  32  18.394  30.984 -33.156
  240    HB   THR  32           HB       THR  32  19.348  30.836 -30.667
  241    HG1  THR  32           HG1      THR  32  18.628  32.646 -31.446
  242   HG21  THR  32          HG21      THR  32  21.597  29.966 -31.334
  243   HG22  THR  32          HG22      THR  32  21.872  31.461 -32.252
  244   HG23  THR  32          HG23      THR  32  21.641  31.519 -30.491
  245    H    LEU  33           H        LEU  33  20.540  28.255 -33.399
  246    HA   LEU  33           HA       LEU  33  22.082  29.523 -35.530
  247    HB2  LEU  33           HB2      LEU  33  23.736  28.003 -35.146
  248    HB3  LEU  33           HB3      LEU  33  23.007  28.179 -33.556
  249    HG   LEU  33           HG       LEU  33  21.713  26.046 -34.058
  250   HD11  LEU  33          HD11      LEU  33  22.166  25.638 -36.440
  251   HD12  LEU  33          HD12      LEU  33  23.913  25.785 -36.160
  252   HD13  LEU  33          HD13      LEU  33  23.000  24.412 -35.509
  253   HD21  LEU  33          HD21      LEU  33  23.616  24.673 -33.276
  254   HD22  LEU  33          HD22      LEU  33  24.739  25.967 -33.749
  255   HD23  LEU  33          HD23      LEU  33  23.565  26.231 -32.443
  256    H    SER  34           H        SER  34  19.522  27.133 -35.210
  257    HA   SER  34           HA       SER  34  19.947  25.881 -37.769
  258    HB2  SER  34           HB2      SER  34  17.482  25.824 -35.979
  259    HB3  SER  34           HB3      SER  34  17.794  24.757 -37.362
  260    HG   SER  34           HG       SER  34  19.174  24.973 -34.917
  261    H    GLY  35           H        GLY  35  18.017  28.714 -36.898
  262    HA2  GLY  35           HA2      GLY  35  16.817  30.166 -38.276
  263    HA3  GLY  35           HA3      GLY  35  17.293  29.223 -39.690
  264    H    GLN  36           H        GLN  36  15.892  27.267 -37.309
  265    HA   GLN  36           HA       GLN  36  13.067  27.706 -37.943
  266    HB2  GLN  36           HB2      GLN  36  13.749  25.951 -39.571
  267    HB3  GLN  36           HB3      GLN  36  14.459  25.011 -38.269
  268    HG2  GLN  36           HG2      GLN  36  12.062  24.967 -37.240
  269    HG3  GLN  36           HG3      GLN  36  11.511  25.549 -38.804
  270   HE21  GLN  36          HE22      GLN  36  11.719  22.840 -36.965
  271   HE22  GLN  36          HE21      GLN  36  11.999  21.629 -38.200
  272    HA   PRO  37           HA       PRO  37  12.951  27.061 -33.439
  273    HB2  PRO  37           HB2      PRO  37  10.378  25.648 -34.194
  274    HB3  PRO  37           HB3      PRO  37  10.683  26.746 -32.813
  275    HG2  PRO  37           HG2      PRO  37   9.472  27.712 -35.010
  276    HG3  PRO  37           HG3      PRO  37  10.808  28.653 -34.263
  277    HD2  PRO  37           HD2      PRO  37  10.902  26.863 -36.689
  278    HD3  PRO  37           HD3      PRO  37  11.650  28.468 -36.433
  279    H    VAL  38           H        VAL  38  12.939  25.388 -31.874
  280    HA   VAL  38           HA       VAL  38  13.639  22.618 -32.812
  281    HB   VAL  38           HB       VAL  38  14.823  24.286 -30.561
  282   HG11  VAL  38          HG11      VAL  38  15.528  21.411 -31.285
  283   HG12  VAL  38          HG12      VAL  38  16.403  22.444 -30.156
  284   HG13  VAL  38          HG13      VAL  38  14.767  21.937 -29.762
  285   HG21  VAL  38          HG21      VAL  38  16.059  23.017 -33.050
  286   HG22  VAL  38          HG22      VAL  38  15.675  24.727 -32.886
  287   HG23  VAL  38          HG23      VAL  38  16.903  24.001 -31.841
  288    H    GLY  39           H        GLY  39  13.106  20.907 -30.967
  289    HA2  GLY  39           HA2      GLY  39  10.895  21.805 -29.228
  290    HA3  GLY  39           HA3      GLY  39  10.424  20.802 -30.586
  291    H    ILE  40           H        ILE  40   9.675  19.920 -28.310
  292    HA   ILE  40           HA       ILE  40  11.441  17.608 -27.710
  293    HB   ILE  40           HB       ILE  40  10.062  19.173 -25.502
  294   HG12  ILE  40          HG12      ILE  40  12.953  19.206 -26.447
  295   HG13  ILE  40          HG13      ILE  40  11.839  20.569 -26.355
  296   HG21  ILE  40          HG21      ILE  40  11.275  17.706 -24.001
  297   HG22  ILE  40          HG22      ILE  40  10.406  16.690 -25.129
  298   HG23  ILE  40          HG23      ILE  40  12.148  16.955 -25.346
  299   HD11  ILE  40          HD11      ILE  40  11.854  20.352 -23.860
  300   HD12  ILE  40          HD12      ILE  40  13.163  19.144 -24.048
  301   HD13  ILE  40          HD13      ILE  40  13.410  20.795 -24.602
  302    H    HIS  41           H        HIS  41  10.446  15.762 -27.394
  303    HA   HIS  41           HA       HIS  41   7.602  15.569 -28.262
  304    HB2  HIS  41           HB2      HIS  41   9.152  14.889 -29.977
  305    HB3  HIS  41           HB3      HIS  41  10.120  13.973 -28.834
  306    HD1  HIS  41           HD1      HIS  41   8.913  11.660 -27.853
  307    HD2  HIS  41           HD2      HIS  41   7.191  13.575 -31.178
  308    HE1  HIS  41           HE1      HIS  41   7.402   9.933 -28.967
  309    H    PHE  42           H        PHE  42   6.268  14.602 -26.879
  310    HA   PHE  42           HA       PHE  42   7.365  12.987 -24.605
  311    HB2  PHE  42           HB2      PHE  42   5.317  15.210 -24.696
  312    HB3  PHE  42           HB3      PHE  42   5.422  14.072 -23.365
  313    HD1  PHE  42           HD1      PHE  42   7.446  13.924 -21.938
  314    HD2  PHE  42           HD2      PHE  42   6.973  17.085 -24.854
  315    HE1  PHE  42           HE1      PHE  42   9.144  15.277 -20.758
  316    HE2  PHE  42           HE2      PHE  42   8.642  18.434 -23.643
  317    HZ   PHE  42           HZ       PHE  42   9.738  17.543 -21.595
  318    H    SER  43           H        SER  43   6.552  10.998 -24.413
  319    HA   SER  43           HA       SER  43   3.745  10.417 -25.098
  320    HB2  SER  43           HB2      SER  43   5.183   9.944 -27.137
  321    HB3  SER  43           HB3      SER  43   6.011   8.706 -26.173
  322    HG   SER  43           HG       SER  43   4.285   7.794 -27.321
  323    H    ASP  44           H        ASP  44   3.181   8.165 -24.450
  324    HA   ASP  44           HA       ASP  44   3.945   7.611 -21.689
  325    HB2  ASP  44           HB2      ASP  44   1.664   7.264 -22.586
  326    HB3  ASP  44           HB3      ASP  44   2.282   6.046 -23.703
  327    H    SER  45           H        SER  45   4.983   6.435 -24.861
  328    HA   SER  45           HA       SER  45   6.313   4.018 -23.969
  329    HB2  SER  45           HB2      SER  45   7.347   4.172 -26.263
  330    HB3  SER  45           HB3      SER  45   5.575   4.177 -26.237
  331    HG   SER  45           HG       SER  45   6.432   5.791 -27.625
  332    H    ALA  46           H        ALA  46   7.542   7.188 -25.050
  333    HA   ALA  46           HA       ALA  46   9.610   7.371 -23.016
  334    HB1  ALA  46           HB1      ALA  46  10.404   7.013 -25.956
  335    HB2  ALA  46           HB2      ALA  46  11.514   7.437 -24.639
  336    HB3  ALA  46           HB3      ALA  46  10.734   5.852 -24.653
  337    H    TRP  47           H        TRP  47  10.965   9.446 -23.476
  338    HA   TRP  47           HA       TRP  47   9.659  11.349 -25.304
  339    HB2  TRP  47           HB2      TRP  47   9.655  13.130 -23.677
  340    HB3  TRP  47           HB3      TRP  47   8.627  11.804 -23.177
  341    HD1  TRP  47           HD1      TRP  47   9.607  10.249 -21.115
  342    HE1  TRP  47           HE1      TRP  47  10.904  10.972 -19.026
  343    HE3  TRP  47           HE3      TRP  47  11.485  14.682 -22.855
  344    HZ2  TRP  47           HZ2      TRP  47  12.139  13.444 -18.073
  345    HZ3  TRP  47           HZ3      TRP  47  12.715  16.195 -21.333
  346    HH2  TRP  47           HH2      TRP  47  13.004  15.623 -18.934
  347    H    ARG  48           H        ARG  48  10.983  13.127 -25.935
  348    HA   ARG  48           HA       ARG  48  13.879  12.947 -25.584
  349    HB2  ARG  48           HB2      ARG  48  14.420  12.267 -27.848
  350    HB3  ARG  48           HB3      ARG  48  13.388  11.039 -27.114
  351    HG2  ARG  48           HG2      ARG  48  11.454  11.806 -28.387
  352    HG3  ARG  48           HG3      ARG  48  12.374  13.170 -29.039
  353    HD2  ARG  48           HD2      ARG  48  12.243  11.427 -30.718
  354    HD3  ARG  48           HD3      ARG  48  13.906  11.664 -30.192
  355    HE   ARG  48           HE       ARG  48  13.960   9.520 -29.258
  356   HH11  ARG  48          HH11      ARG  48  10.633  10.116 -30.247
  357   HH12  ARG  48          HH12      ARG  48  10.201   8.452 -29.980
  358   HH21  ARG  48          HH21      ARG  48  13.357   7.541 -28.942
  359   HH22  ARG  48          HH22      ARG  48  11.716   6.995 -29.250
  360    H    ILE  49           H        ILE  49  15.103  14.448 -26.916
  361    HA   ILE  49           HA       ILE  49  13.559  16.903 -27.648
  362    HB   ILE  49           HB       ILE  49  16.565  16.515 -27.368
  363   HG12  ILE  49          HG12      ILE  49  14.441  17.598 -25.465
  364   HG13  ILE  49          HG13      ILE  49  15.486  16.206 -25.208
  365   HG21  ILE  49          HG21      ILE  49  15.941  18.383 -28.912
  366   HG22  ILE  49          HG22      ILE  49  14.905  19.071 -27.651
  367   HG23  ILE  49          HG23      ILE  49  16.660  18.983 -27.436
  368   HD11  ILE  49          HD11      ILE  49  16.257  18.006 -23.848
  369   HD12  ILE  49          HD12      ILE  49  17.461  17.741 -25.134
  370   HD13  ILE  49          HD13      ILE  49  16.333  19.125 -25.207
  371    H    MET  50           H        MET  50  13.632  17.804 -29.723
  372    HA   MET  50           HA       MET  50  14.845  16.230 -31.936
  373    HB2  MET  50           HB2      MET  50  11.924  17.019 -31.661
  374    HB3  MET  50           HB3      MET  50  12.667  16.630 -33.221
  375    HG2  MET  50           HG2      MET  50  13.245  14.406 -32.495
  376    HG3  MET  50           HG3      MET  50  12.761  14.754 -30.842
  377    HE1  MET  50           HE1      MET  50   9.886  13.809 -34.344
  378    HE2  MET  50           HE2      MET  50  10.909  15.257 -34.397
  379    HE3  MET  50           HE3      MET  50  11.657  13.643 -34.384
  380    H    VAL  51           H        VAL  51  15.268  17.391 -33.802
  381    HA   VAL  51           HA       VAL  51  15.410  20.379 -33.580
  382    HB   VAL  51           HB       VAL  51  17.301  19.203 -32.483
  383   HG11  VAL  51          HG11      VAL  51  17.524  17.195 -33.848
  384   HG12  VAL  51          HG12      VAL  51  18.000  18.158 -35.253
  385   HG13  VAL  51          HG13      VAL  51  19.046  18.090 -33.828
  386   HG21  VAL  51          HG21      VAL  51  17.638  21.441 -33.383
  387   HG22  VAL  51          HG22      VAL  51  19.101  20.453 -33.379
  388   HG23  VAL  51          HG23      VAL  51  18.253  20.735 -34.906
  389    HA   PRO  52           HA       PRO  52  14.791  20.261 -38.061
  390    HB2  PRO  52           HB2      PRO  52  16.890  22.412 -38.190
  391    HB3  PRO  52           HB3      PRO  52  15.259  22.371 -38.932
  392    HG2  PRO  52           HG2      PRO  52  15.749  23.851 -36.692
  393    HG3  PRO  52           HG3      PRO  52  14.228  22.935 -36.864
  394    HD2  PRO  52           HD2      PRO  52  16.663  22.236 -35.296
  395    HD3  PRO  52           HD3      PRO  52  14.933  22.051 -34.866
  396    H    GLY  53           H        GLY  53  18.032  20.257 -36.720
  397    HA2  GLY  53           HA2      GLY  53  19.830  18.890 -36.996
  398    HA3  GLY  53           HA3      GLY  53  18.807  17.848 -37.972
  399    H    LYS  54           H        LYS  54  18.406  18.716 -40.229
  400    HA   LYS  54           HA       LYS  54  20.970  19.601 -41.523
  401    HB2  LYS  54           HB2      LYS  54  20.901  17.159 -41.283
  402    HB3  LYS  54           HB3      LYS  54  19.320  17.096 -42.069
  403    HG2  LYS  54           HG2      LYS  54  20.290  17.833 -44.189
  404    HG3  LYS  54           HG3      LYS  54  21.875  18.069 -43.420
  405    HD2  LYS  54           HD2      LYS  54  22.047  15.663 -42.978
  406    HD3  LYS  54           HD3      LYS  54  20.400  15.400 -43.597
  407    HE2  LYS  54           HE2      LYS  54  21.084  16.241 -45.819
  408    HE3  LYS  54           HE3      LYS  54  22.722  16.533 -45.221
  409    HZ1  LYS  54           HZ1      LYS  54  21.423  13.861 -45.380
  410    HZ2  LYS  54           HZ2      LYS  54  22.577  14.407 -46.389
  411    HZ3  LYS  54           HZ3      LYS  54  22.934  14.132 -44.825
  412    H    THR  55           H        THR  55  17.466  19.666 -41.654
  413    HA   THR  55           HA       THR  55  17.630  21.078 -44.287
  414    HB   THR  55           HB       THR  55  15.240  19.366 -43.945
  415    HG1  THR  55           HG1      THR  55  17.650  18.152 -44.688
  416   HG21  THR  55          HG21      THR  55  15.638  20.636 -45.989
  417   HG22  THR  55          HG22      THR  55  17.188  19.793 -46.228
  418   HG23  THR  55          HG23      THR  55  15.655  18.891 -46.293
  419    HA   PRO  56           HA       PRO  56  14.800  23.441 -41.311
  420    HB2  PRO  56           HB2      PRO  56  16.279  25.697 -40.873
  421    HB3  PRO  56           HB3      PRO  56  16.483  24.211 -39.910
  422    HG2  PRO  56           HG2      PRO  56  18.104  25.087 -42.323
  423    HG3  PRO  56           HG3      PRO  56  18.714  24.552 -40.721
  424    HD2  PRO  56           HD2      PRO  56  18.556  22.841 -42.808
  425    HD3  PRO  56           HD3      PRO  56  18.161  22.314 -41.142
  426    H    SER  57           H        SER  57  15.884  23.560 -44.398
  427    HA   SER  57           HA       SER  57  15.531  25.917 -45.661
  428    HB2  SER  57           HB2      SER  57  14.504  23.187 -46.538
  429    HB3  SER  57           HB3      SER  57  14.951  24.541 -47.608
  430    HG   SER  57           HG       SER  57  16.670  23.081 -47.424
  431    H    ALA  58           H        ALA  58  12.857  23.936 -44.436
  432    HA   ALA  58           HA       ALA  58  11.098  26.252 -44.499
  433    HB1  ALA  58           HB1      ALA  58  10.342  23.788 -46.149
  434    HB2  ALA  58           HB2      ALA  58   9.260  25.141 -45.756
  435    HB3  ALA  58           HB3      ALA  58  10.681  25.413 -46.778
  436    H    TRP  59           H        TRP  59  11.034  22.670 -44.153
  437    HA   TRP  59           HA       TRP  59  10.439  22.830 -41.288
  438    HB2  TRP  59           HB2      TRP  59   8.195  23.070 -42.226
  439    HB3  TRP  59           HB3      TRP  59   8.445  21.694 -43.285
  440    HD1  TRP  59           HD1      TRP  59   8.245  19.274 -42.245
  441    HE1  TRP  59           HE1      TRP  59   7.029  18.390 -40.168
  442    HE3  TRP  59           HE3      TRP  59   7.870  23.650 -39.601
  443    HZ2  TRP  59           HZ2      TRP  59   5.949  19.459 -37.703
  444    HZ3  TRP  59           HZ3      TRP  59   6.782  23.673 -37.367
  445    HH2  TRP  59           HH2      TRP  59   5.805  21.596 -36.420
  446    H    ARG  60           H        ARG  60  11.685  21.314 -40.412
  447    HA   ARG  60           HA       ARG  60  11.668  18.539 -41.428
  448    HB2  ARG  60           HB2      ARG  60  13.560  19.565 -42.602
  449    HB3  ARG  60           HB3      ARG  60  14.184  20.244 -41.097
  450    HG2  ARG  60           HG2      ARG  60  15.557  18.376 -41.726
  451    HG3  ARG  60           HG3      ARG  60  14.688  17.956 -40.274
  452    HD2  ARG  60           HD2      ARG  60  12.959  16.824 -41.910
  453    HD3  ARG  60           HD3      ARG  60  14.235  16.972 -43.113
  454    HE   ARG  60           HE       ARG  60  14.168  15.229 -40.719
  455   HH11  ARG  60          HH11      ARG  60  16.386  16.540 -43.163
  456   HH12  ARG  60          HH12      ARG  60  17.449  15.177 -42.979
  457   HH21  ARG  60          HH21      ARG  60  15.590  13.577 -40.593
  458   HH22  ARG  60          HH22      ARG  60  17.054  13.593 -41.528
  459    H    TRP  61           H        TRP  61  12.269  17.002 -39.872
  460    HA   TRP  61           HA       TRP  61  13.179  17.900 -37.216
  461    HB2  TRP  61           HB2      TRP  61  10.702  16.195 -37.700
  462    HB3  TRP  61           HB3      TRP  61  11.538  16.315 -36.155
  463    HD1  TRP  61           HD1      TRP  61   8.792  17.902 -37.971
  464    HE1  TRP  61           HE1      TRP  61   8.174  20.198 -37.000
  465    HE3  TRP  61           HE3      TRP  61  12.809  18.567 -34.895
  466    HZ2  TRP  61           HZ2      TRP  61   9.291  22.090 -35.115
  467    HZ3  TRP  61           HZ3      TRP  61  13.025  20.628 -33.535
  468    HH2  TRP  61           HH2      TRP  61  11.299  22.396 -33.651
  469    H    VAL  62           H        VAL  62  14.372  16.470 -36.105
  470    HA   VAL  62           HA       VAL  62  14.486  13.613 -36.635
  471    HB   VAL  62           HB       VAL  62  16.095  14.534 -38.291
  472   HG11  VAL  62          HG11      VAL  62  16.859  16.563 -37.134
  473   HG12  VAL  62          HG12      VAL  62  17.711  15.566 -35.931
  474   HG13  VAL  62          HG13      VAL  62  18.209  15.536 -37.633
  475   HG21  VAL  62          HG21      VAL  62  16.488  12.304 -37.327
  476   HG22  VAL  62          HG22      VAL  62  17.976  13.124 -37.808
  477   HG23  VAL  62          HG23      VAL  62  17.550  13.039 -36.092
  478    HA   PRO  63           HA       PRO  63  15.230  13.870 -32.133
  479    HB2  PRO  63           HB2      PRO  63  17.122  11.578 -32.664
  480    HB3  PRO  63           HB3      PRO  63  15.944  11.789 -31.329
  481    HG2  PRO  63           HG2      PRO  63  15.314  10.204 -33.422
  482    HG3  PRO  63           HG3      PRO  63  14.096  11.366 -32.801
  483    HD2  PRO  63           HD2      PRO  63  15.904  11.639 -35.201
  484    HD3  PRO  63           HD3      PRO  63  14.164  12.032 -35.054
  485    H    LEU  64           H        LEU  64  16.685  14.966 -30.845
  486    HA   LEU  64           HA       LEU  64  19.024  16.118 -32.144
  487    HB2  LEU  64           HB2      LEU  64  17.328  17.302 -30.612
  488    HB3  LEU  64           HB3      LEU  64  18.229  16.623 -29.261
  489    HG   LEU  64           HG       LEU  64  19.351  18.423 -31.467
  490   HD11  LEU  64          HD11      LEU  64  17.771  19.597 -29.971
  491   HD12  LEU  64          HD12      LEU  64  18.743  19.087 -28.566
  492   HD13  LEU  64          HD13      LEU  64  19.426  20.185 -29.783
  493   HD21  LEU  64          HD21      LEU  64  21.187  17.103 -30.571
  494   HD22  LEU  64          HD22      LEU  64  21.306  18.755 -29.979
  495   HD23  LEU  64          HD23      LEU  64  20.686  17.481 -28.905
  496    H    GLN  65           H        GLN  65  19.797  13.826 -32.389
  497    HA   GLN  65           HA       GLN  65  21.538  12.939 -30.111
  498    HB2  GLN  65           HB2      GLN  65  19.632  11.380 -31.887
  499    HB3  GLN  65           HB3      GLN  65  20.955  10.589 -31.027
  500    HG2  GLN  65           HG2      GLN  65  20.127  11.369 -28.869
  501    HG3  GLN  65           HG3      GLN  65  18.851  12.308 -29.656
  502   HE21  GLN  65          HE22      GLN  65  19.999   8.831 -29.764
  503   HE22  GLN  65          HE21      GLN  65  18.346   8.228 -29.567
  504    H    GLU  66           H        GLU  66  21.821  14.268 -33.069
  505    HA   GLU  66           HA       GLU  66  23.717  12.637 -34.440
  506    HB2  GLU  66           HB2      GLU  66  23.360  15.661 -34.397
  507    HB3  GLU  66           HB3      GLU  66  24.342  14.786 -35.569
  508    HG2  GLU  66           HG2      GLU  66  21.330  14.446 -35.214
  509    HG3  GLU  66           HG3      GLU  66  22.109  15.430 -36.439
  510    H    ASP  67           H        ASP  67  24.150  14.520 -31.572
  511    HA   ASP  67           HA       ASP  67  27.030  13.714 -31.504
  512    HB2  ASP  67           HB2      ASP  67  26.866  16.118 -32.060
  513    HB3  ASP  67           HB3      ASP  67  25.903  16.391 -30.608
  514    H    ALA  68           H        ALA  68  24.084  14.485 -29.600
  515    HA   ALA  68           HA       ALA  68  25.123  13.582 -27.082
  516    HB1  ALA  68           HB1      ALA  68  23.207  15.131 -27.347
  517    HB2  ALA  68           HB2      ALA  68  22.250  13.823 -28.076
  518    HB3  ALA  68           HB3      ALA  68  22.769  13.710 -26.386
  519    H    ALA  69           H        ALA  69  24.265  11.763 -29.812
  520    HA   ALA  69           HA       ALA  69  23.873   9.673 -30.386
  521    HB1  ALA  69           HB1      ALA  69  25.306   8.982 -27.804
  522    HB2  ALA  69           HB2      ALA  69  25.073   7.916 -29.204
  523    HB3  ALA  69           HB3      ALA  69  26.066   9.378 -29.361
  524    H    ASP  70           H        ASP  70  23.083   9.671 -26.929
  525    HA   ASP  70           HA       ASP  70  20.340   8.714 -27.486
  526    HB2  ASP  70           HB2      ASP  70  21.872   6.693 -27.318
  527    HB3  ASP  70           HB3      ASP  70  22.174   7.146 -25.642
  528    H    GLU  71           H        GLU  71  22.542  10.464 -25.414
  529    HA   GLU  71           HA       GLU  71  21.118  10.342 -22.959
  530    HB2  GLU  71           HB2      GLU  71  22.892  12.544 -24.093
  531    HB3  GLU  71           HB3      GLU  71  22.343  12.443 -22.415
  532    HG2  GLU  71           HG2      GLU  71  23.451  10.211 -22.205
  533    HG3  GLU  71           HG3      GLU  71  24.091  10.391 -23.839
  534    H    SER  72           H        SER  72  20.331  12.145 -25.822
  535    HA   SER  72           HA       SER  72  18.523  14.053 -24.602
  536    HB2  SER  72           HB2      SER  72  18.716  13.088 -27.476
  537    HB3  SER  72           HB3      SER  72  17.852  14.529 -26.917
  538    HG   SER  72           HG       SER  72  20.037  14.806 -27.773
  539    H    GLN  73           H        GLN  73  18.087  10.700 -24.858
  540    HA   GLN  73           HA       GLN  73  15.152  11.032 -24.675
  541    HB2  GLN  73           HB2      GLN  73  14.631   9.345 -26.229
  542    HB3  GLN  73           HB3      GLN  73  15.734  10.449 -27.059
  543    HG2  GLN  73           HG2      GLN  73  17.588   8.846 -26.714
  544    HG3  GLN  73           HG3      GLN  73  16.490   7.744 -25.867
  545   HE21  GLN  73          HE22      GLN  73  17.844   6.714 -27.932
  546   HE22  GLN  73          HE21      GLN  73  16.715   6.438 -29.275
  547    H    ASN  74           H        ASN  74  14.077   9.130 -23.850
  548    HA   ASN  74           HA       ASN  74  13.594   7.586 -22.305
  549    HB2  ASN  74           HB2      ASN  74  14.273   6.353 -24.313
  550    HB3  ASN  74           HB3      ASN  74  15.921   6.227 -23.699
  551   HD21  ASN  74          HD22      ASN  74  16.373   4.341 -22.590
  552   HD22  ASN  74          HD21      ASN  74  15.150   3.333 -21.846
  553    H    ASP  75           H        ASP  75  17.171   7.758 -22.019
  554    HA   ASP  75           HA       ASP  75  17.474   6.797 -19.338
  555    HB2  ASP  75           HB2      ASP  75  19.280   6.967 -20.978
  556    HB3  ASP  75           HB3      ASP  75  19.058   8.712 -21.094
  557    H    TRP  76           H        TRP  76  16.071   9.664 -20.520
  558    HA   TRP  76           HA       TRP  76  16.299  11.655 -18.641
  559    HB2  TRP  76           HB2      TRP  76  13.965  10.552 -20.236
  560    HB3  TRP  76           HB3      TRP  76  13.753  11.877 -19.110
  561    HD1  TRP  76           HD1      TRP  76  14.349  11.451 -22.612
  562    HE1  TRP  76           HE1      TRP  76  15.453  13.506 -23.697
  563    HE3  TRP  76           HE3      TRP  76  15.608  13.970 -18.368
  564    HZ2  TRP  76           HZ2      TRP  76  16.781  15.928 -22.797
  565    HZ3  TRP  76           HZ3      TRP  76  16.700  16.184 -18.490
  566    HH2  TRP  76           HH2      TRP  76  17.356  17.140 -20.689
  567    H    ASP  77           H        ASP  77  14.655   8.542 -18.031
  568    HA   ASP  77           HA       ASP  77  14.531   9.283 -15.195
  569    HB2  ASP  77           HB2      ASP  77  12.125   8.572 -15.008
  570    HB3  ASP  77           HB3      ASP  77  12.429  10.139 -15.729
  571    H    GLU  78           H        GLU  78  14.229   7.590 -13.768
  572    HA   GLU  78           HA       GLU  78  14.383   4.795 -14.770
  573    HB2  GLU  78           HB2      GLU  78  16.431   4.322 -13.603
  574    HB3  GLU  78           HB3      GLU  78  16.686   5.671 -14.706
  575    HG2  GLU  78           HG2      GLU  78  16.351   7.228 -12.692
  576    HG3  GLU  78           HG3      GLU  78  16.405   5.791 -11.673
  577    H    GLU  79           H        GLU  79  13.606   6.987 -12.157
  578    HA   GLU  79           HA       GLU  79  12.043   4.813 -10.878
  579    HB2  GLU  79           HB2      GLU  79  14.308   5.448  -9.708
  580    HB3  GLU  79           HB3      GLU  79  13.482   6.924  -9.236
  581    HG2  GLU  79           HG2      GLU  79  13.397   5.314  -7.444
  582    HG3  GLU  79           HG3      GLU  79  11.763   5.534  -8.042
  583    H    LEU  80           H        LEU  80  11.540   7.149 -12.759
  584    HA   LEU  80           HA       LEU  80   9.337   8.478 -11.281
  585    HB2  LEU  80           HB2      LEU  80  11.370   9.825 -13.119
  586    HB3  LEU  80           HB3      LEU  80   9.843  10.538 -12.671
  587    HG   LEU  80           HG       LEU  80  11.525  11.596 -11.431
  588   HD11  LEU  80          HD11      LEU  80  10.792  11.231  -9.113
  589   HD12  LEU  80          HD12      LEU  80   9.404  11.191 -10.221
  590   HD13  LEU  80          HD13      LEU  80  10.079   9.682  -9.560
  591   HD21  LEU  80          HD21      LEU  80  12.390   9.045 -10.083
  592   HD22  LEU  80          HD22      LEU  80  13.210   9.740 -11.502
  593   HD23  LEU  80          HD23      LEU  80  13.086  10.664  -9.988
  594    H    SER  81           H        SER  81   7.614   9.126 -12.548
  595    HA   SER  81           HA       SER  81   7.428   8.130 -15.375
  596    HB2  SER  81           HB2      SER  81   5.308   8.185 -13.184
  597    HB3  SER  81           HB3      SER  81   5.002   7.780 -14.884
  598    HG   SER  81           HG       SER  81   6.381   5.997 -14.664
  599    H    ILE  82           H        ILE  82   6.820   9.644 -16.847
  600    HA   ILE  82           HA       ILE  82   6.384  12.414 -15.852
  601    HB   ILE  82           HB       ILE  82   7.926  11.178 -18.094
  602   HG12  ILE  82          HG12      ILE  82   9.467  13.042 -17.592
  603   HG13  ILE  82          HG13      ILE  82   8.313  13.707 -16.438
  604   HG21  ILE  82          HG21      ILE  82   7.988  13.283 -19.398
  605   HG22  ILE  82          HG22      ILE  82   6.424  12.481 -19.470
  606   HG23  ILE  82          HG23      ILE  82   6.636  13.914 -18.439
  607   HD11  ILE  82          HD11      ILE  82   8.657  11.858 -14.917
  608   HD12  ILE  82          HD12      ILE  82   9.597  10.962 -16.137
  609   HD13  ILE  82          HD13      ILE  82  10.241  12.454 -15.423
  610    H    HIS  83           H        HIS  83   4.752  13.636 -16.473
  611    HA   HIS  83           HA       HIS  83   2.671  12.579 -18.342
  612    HB2  HIS  83           HB2      HIS  83   2.211  13.695 -15.549
  613    HB3  HIS  83           HB3      HIS  83   0.958  13.218 -16.691
  614    HD1  HIS  83           HD1      HIS  83   0.545  10.544 -16.944
  615    HD2  HIS  83           HD2      HIS  83   3.584  11.717 -14.280
  616    HE1  HIS  83           HE1      HIS  83   1.177   8.463 -15.617
  617    H    LEU  84           H        LEU  84   2.198  14.070 -19.834
  618    HA   LEU  84           HA       LEU  84   3.078  16.875 -19.421
  619    HB2  LEU  84           HB2      LEU  84   3.983  14.979 -21.149
  620    HB3  LEU  84           HB3      LEU  84   2.672  15.602 -22.117
  621    HG   LEU  84           HG       LEU  84   4.765  16.546 -22.701
  622   HD11  LEU  84          HD11      LEU  84   2.732  18.055 -22.777
  623   HD12  LEU  84          HD12      LEU  84   3.375  18.846 -21.313
  624   HD13  LEU  84          HD13      LEU  84   4.315  18.855 -22.810
  625   HD21  LEU  84          HD21      LEU  84   6.163  17.909 -21.296
  626   HD22  LEU  84          HD22      LEU  84   5.042  17.739 -19.932
  627   HD23  LEU  84          HD23      LEU  84   5.928  16.323 -20.550
  628    H    GLN  85           H        GLN  85   1.867  18.572 -20.089
  629    HA   GLN  85           HA       GLN  85  -0.675  18.335 -21.476
  630    HB2  GLN  85           HB2      GLN  85  -1.904  19.577 -19.626
  631    HB3  GLN  85           HB3      GLN  85  -1.631  17.869 -19.369
  632    HG2  GLN  85           HG2      GLN  85   0.236  19.951 -18.170
  633    HG3  GLN  85           HG3      GLN  85  -1.286  19.528 -17.398
  634   HE21  GLN  85          HE22      GLN  85   2.025  18.628 -17.617
  635   HE22  GLN  85          HE21      GLN  85   1.851  17.031 -16.913
  636    HA   PRO  86           HA       PRO  86  -2.475  20.014 -21.799
  637    HB2  PRO  86           HB2      PRO  86  -3.170  21.650 -23.841
  638    HB3  PRO  86           HB3      PRO  86  -3.078  22.229 -22.150
  639    HG2  PRO  86           HG2      PRO  86  -0.966  22.491 -24.318
  640    HG3  PRO  86           HG3      PRO  86  -1.618  23.775 -23.248
  641    HD2  PRO  86           HD2      PRO  86   0.704  22.431 -22.698
  642    HD3  PRO  86           HD3      PRO  86  -0.395  22.987 -21.402
  643    H    PHE  87           H        PHE  87   0.339  20.078 -23.882
  644    HA   PHE  87           HA       PHE  87  -0.652  18.762 -26.185
  645    HB2  PHE  87           HB2      PHE  87   2.099  18.544 -24.906
  646    HB3  PHE  87           HB3      PHE  87   1.680  18.094 -26.545
  647    HD1  PHE  87           HD2      PHE  87   0.326  20.158 -27.838
  648    HD2  PHE  87           HD1      PHE  87   3.306  20.540 -24.738
  649    HE1  PHE  87           HE2      PHE  87   0.890  22.432 -28.655
  650    HE2  PHE  87           HE1      PHE  87   3.877  22.806 -25.575
  651    HZ   PHE  87           HZ       PHE  87   2.674  23.746 -27.541
  652    H    LYS  88           H        LYS  88  -1.397  16.800 -26.512
  653    HA   LYS  88           HA       LYS  88  -1.648  14.811 -24.527
  654    HB2  LYS  88           HB2      LYS  88  -2.267  13.296 -26.524
  655    HB3  LYS  88           HB3      LYS  88  -3.259  14.662 -26.080
  656    HG2  LYS  88           HG2      LYS  88  -3.279  14.615 -28.384
  657    HG3  LYS  88           HG3      LYS  88  -2.287  15.998 -27.974
  658    HD2  LYS  88           HD2      LYS  88  -0.247  14.759 -28.635
  659    HD3  LYS  88           HD3      LYS  88  -1.218  13.280 -28.839
  660    HE2  LYS  88           HE2      LYS  88  -2.553  14.417 -30.597
  661    HE3  LYS  88           HE3      LYS  88  -1.548  15.859 -30.422
  662    HZ1  LYS  88           HZ1      LYS  88  -0.812  14.446 -32.272
  663    HZ2  LYS  88           HZ2      LYS  88   0.372  14.527 -31.151
  664    HZ3  LYS  88           HZ3      LYS  88  -0.524  13.179 -31.276
  665    HA   PRO  89           HA       PRO  89   2.328  12.726 -24.805
  666    HB2  PRO  89           HB2      PRO  89   1.820  10.510 -23.285
  667    HB3  PRO  89           HB3      PRO  89   2.067  12.142 -22.595
  668    HG2  PRO  89           HG2      PRO  89  -0.554  10.729 -23.147
  669    HG3  PRO  89           HG3      PRO  89  -0.070  11.645 -21.689
  670    HD2  PRO  89           HD2      PRO  89  -1.596  12.719 -23.709
  671    HD3  PRO  89           HD3      PRO  89  -0.459  13.703 -22.738
  672    H    ASP  90           H        ASP  90   2.731  11.975 -26.816
  673    HA   ASP  90           HA       ASP  90   1.460   9.545 -27.902
  674    HB2  ASP  90           HB2      ASP  90  -0.226  11.284 -28.304
  675    HB3  ASP  90           HB3      ASP  90   1.004  12.358 -28.976
  676    H    ASP  91           H        ASP  91   2.596   8.665 -29.622
  677    HA   ASP  91           HA       ASP  91   5.289   9.619 -30.147
  678    HB2  ASP  91           HB2      ASP  91   5.566   7.574 -31.384
  679    HB3  ASP  91           HB3      ASP  91   4.904   7.271 -29.790
  680    H    SER  92           H        SER  92   3.801  11.646 -30.908
  681    HA   SER  92           HA       SER  92   2.655  11.722 -33.493
  682    HB2  SER  92           HB2      SER  92   4.020  14.059 -32.117
  683    HB3  SER  92           HB3      SER  92   2.659  14.102 -33.247
  684    HG   SER  92           HG       SER  92   1.653  12.671 -31.460
  685    H    ASN  93           H        ASN  93   3.381  12.739 -35.459
  686    HA   ASN  93           HA       ASN  93   5.978  11.940 -36.353
  687    HB2  ASN  93           HB2      ASN  93   5.264  12.841 -38.485
  688    HB3  ASN  93           HB3      ASN  93   3.898  12.028 -37.740
  689   HD21  ASN  93          HD22      ASN  93   5.290  15.205 -38.528
  690   HD22  ASN  93          HD21      ASN  93   3.767  16.071 -38.385
  691    H    GLN  94           H        GLN  94   5.651  14.346 -34.282
  692    HA   GLN  94           HA       GLN  94   7.980  15.880 -35.066
  693    HB2  GLN  94           HB2      GLN  94   6.815  18.059 -35.102
  694    HB3  GLN  94           HB3      GLN  94   6.222  17.043 -36.399
  695    HG2  GLN  94           HG2      GLN  94   4.134  16.648 -35.275
  696    HG3  GLN  94           HG3      GLN  94   4.743  17.236 -33.730
  697   HE21  GLN  94          HE22      GLN  94   5.170  19.527 -33.430
  698   HE22  GLN  94          HE21      GLN  94   4.310  20.678 -34.454
  699    HA   PRO  95           HA       PRO  95   7.768  16.496 -30.552
  700    HB2  PRO  95           HB2      PRO  95   8.833  19.004 -30.225
  701    HB3  PRO  95           HB3      PRO  95   9.835  17.555 -30.572
  702    HG2  PRO  95           HG2      PRO  95   8.803  19.651 -32.513
  703    HG3  PRO  95           HG3      PRO  95  10.469  18.993 -32.376
  704    HD2  PRO  95           HD2      PRO  95   8.739  18.060 -34.223
  705    HD3  PRO  95           HD3      PRO  95   9.822  16.941 -33.358
  706    H    GLN  96           H        GLN  96   6.342  17.499 -29.065
  707    HA   GLN  96           HA       GLN  96   4.216  19.200 -30.294
  708    HB2  GLN  96           HB2      GLN  96   4.172  17.955 -27.528
  709    HB3  GLN  96           HB3      GLN  96   2.869  18.689 -28.450
  710    HG2  GLN  96           HG2      GLN  96   2.373  16.476 -28.758
  711    HG3  GLN  96           HG3      GLN  96   3.293  16.807 -30.218
  712   HE21  GLN  96          HE22      GLN  96   3.302  14.256 -29.976
  713   HE22  GLN  96          HE21      GLN  96   4.541  13.572 -28.961
  714    H    VAL  97           H        VAL  97   6.554  19.274 -27.576
  715    HA   VAL  97           HA       VAL  97   5.973  22.086 -26.869
  716    HB   VAL  97           HB       VAL  97   8.125  20.074 -26.115
  717   HG11  VAL  97          HG11      VAL  97   8.901  21.660 -24.392
  718   HG12  VAL  97          HG12      VAL  97   9.229  22.250 -26.017
  719   HG13  VAL  97          HG13      VAL  97   7.867  22.923 -25.092
  720   HG21  VAL  97          HG21      VAL  97   5.843  21.345 -24.557
  721   HG22  VAL  97          HG22      VAL  97   5.935  19.656 -25.100
  722   HG23  VAL  97          HG23      VAL  97   7.056  20.251 -23.869
  723    H    VAL  98           H        VAL  98   7.095  23.876 -27.624
  724    HA   VAL  98           HA       VAL  98   9.279  23.425 -29.618
  725    HB   VAL  98           HB       VAL  98   6.797  25.089 -30.140
  726   HG11  VAL  98          HG11      VAL  98   9.290  24.717 -31.851
  727   HG12  VAL  98          HG12      VAL  98   7.777  25.472 -32.392
  728   HG13  VAL  98          HG13      VAL  98   8.718  26.242 -31.124
  729   HG21  VAL  98          HG21      VAL  98   7.884  22.582 -31.493
  730   HG22  VAL  98          HG22      VAL  98   6.393  22.703 -30.535
  731   HG23  VAL  98          HG23      VAL  98   6.508  23.547 -32.074
  732    H    ILE  99           H        ILE  99  10.735  24.963 -29.860
  733    HA   ILE  99           HA       ILE  99  10.954  27.189 -27.879
  734    HB   ILE  99           HB       ILE  99  13.102  25.244 -28.881
  735   HG12  ILE  99          HG12      ILE  99  13.331  24.856 -26.294
  736   HG13  ILE  99          HG13      ILE  99  11.661  25.393 -26.222
  737   HG21  ILE  99          HG21      ILE  99  14.002  27.512 -28.534
  738   HG22  ILE  99          HG22      ILE  99  13.289  27.560 -26.910
  739   HG23  ILE  99          HG23      ILE  99  14.582  26.403 -27.310
  740   HD11  ILE  99          HD11      ILE  99  12.708  23.043 -27.868
  741   HD12  ILE  99          HD12      ILE  99  11.937  22.925 -26.276
  742   HD13  ILE  99          HD13      ILE  99  10.995  23.482 -27.654
  743    H    LEU 100           H        LEU 100  11.097  29.089 -28.937
  744    HA   LEU 100           HA       LEU 100  11.798  29.183 -31.800
  745    HB2  LEU 100           HB2      LEU 100  11.203  31.545 -30.002
  746    HB3  LEU 100           HB3      LEU 100  11.176  31.483 -31.753
  747    HG   LEU 100           HG       LEU 100   9.139  30.433 -29.794
  748   HD11  LEU 100          HD11      LEU 100   8.884  32.105 -32.327
  749   HD12  LEU 100          HD12      LEU 100   7.608  31.760 -31.138
  750   HD13  LEU 100          HD13      LEU 100   8.997  32.761 -30.689
  751   HD21  LEU 100          HD21      LEU 100   7.889  29.418 -31.695
  752   HD22  LEU 100          HD22      LEU 100   9.268  29.728 -32.770
  753   HD23  LEU 100          HD23      LEU 100   9.411  28.570 -31.429
  754    H    ALA 101           H        ALA 101  13.253  30.812 -32.583
  755    HA   ALA 101           HA       ALA 101  15.911  30.320 -31.843
  756    HB1  ALA 101           HB1      ALA 101  15.131  30.906 -34.100
  757    HB2  ALA 101           HB2      ALA 101  14.716  32.547 -33.536
  758    HB3  ALA 101           HB3      ALA 101  16.408  32.022 -33.579
  759    H    ASP 102           H        ASP 102  13.870  32.698 -30.375
  760    HA   ASP 102           HA       ASP 102  16.222  34.122 -29.219
  761    HB2  ASP 102           HB2      ASP 102  14.962  36.095 -29.208
  762    HB3  ASP 102           HB3      ASP 102  14.708  35.394 -30.800
  763    H    GLY 103           H        GLY 103  14.349  31.694 -28.315
  764    HA2  GLY 103           HA2      GLY 103  14.336  30.821 -26.135
  765    HA3  GLY 103           HA3      GLY 103  14.573  32.422 -25.448
  766    H    GLN 104           H        GLN 104  11.928  32.342 -27.677
  767    HA   GLN 104           HA       GLN 104   9.900  32.406 -25.540
  768    HB2  GLN 104           HB2      GLN 104   9.723  32.454 -28.570
  769    HB3  GLN 104           HB3      GLN 104   8.326  32.547 -27.492
  770    HG2  GLN 104           HG2      GLN 104   9.141  34.647 -26.549
  771    HG3  GLN 104           HG3      GLN 104  10.631  34.530 -27.499
  772   HE21  GLN 104          HE22      GLN 104  10.605  34.971 -29.723
  773   HE22  GLN 104          HE21      GLN 104   9.202  35.727 -30.505
  774    H    ILE 105           H        ILE 105   8.578  30.712 -25.060
  775    HA   ILE 105           HA       ILE 105   9.106  28.055 -26.336
  776    HB   ILE 105           HB       ILE 105   8.680  28.323 -23.358
  777   HG12  ILE 105          HG12      ILE 105  10.670  29.696 -23.728
  778   HG13  ILE 105          HG13      ILE 105  10.995  28.247 -22.804
  779   HG21  ILE 105          HG21      ILE 105   9.910  26.241 -25.194
  780   HG22  ILE 105          HG22      ILE 105   9.983  26.135 -23.419
  781   HG23  ILE 105          HG23      ILE 105   8.418  26.098 -24.245
  782   HD11  ILE 105          HD11      ILE 105  12.114  27.214 -24.683
  783   HD12  ILE 105          HD12      ILE 105  11.606  28.544 -25.755
  784   HD13  ILE 105          HD13      ILE 105  12.759  28.850 -24.452
  785    H    THR 106           H        THR 106   7.316  26.642 -26.433
  786    HA   THR 106           HA       THR 106   4.658  27.626 -26.305
  787    HB   THR 106           HB       THR 106   4.114  25.119 -26.111
  788    HG1  THR 106           HG1      THR 106   6.230  24.670 -25.183
  789   HG21  THR 106          HG21      THR 106   5.904  26.119 -28.346
  790   HG22  THR 106          HG22      THR 106   4.924  24.632 -28.411
  791   HG23  THR 106          HG23      THR 106   4.133  26.214 -28.276
  792    HA   PRO 107           HA       PRO 107   4.163  27.388 -21.807
  793    HB2  PRO 107           HB2      PRO 107   1.542  28.090 -21.542
  794    HB3  PRO 107           HB3      PRO 107   2.862  29.240 -21.899
  795    HG2  PRO 107           HG2      PRO 107   0.908  27.995 -23.829
  796    HG3  PRO 107           HG3      PRO 107   1.494  29.692 -23.746
  797    HD2  PRO 107           HD2      PRO 107   2.496  27.790 -25.490
  798    HD3  PRO 107           HD3      PRO 107   3.452  29.171 -24.872
  799    H    PHE 108           H        PHE 108   4.531  25.223 -21.491
  800    HA   PHE 108           HA       PHE 108   2.144  23.444 -21.279
  801    HB2  PHE 108           HB2      PHE 108   3.395  21.569 -21.953
  802    HB3  PHE 108           HB3      PHE 108   3.756  22.804 -23.134
  803    HD1  PHE 108           HD2      PHE 108   5.974  24.007 -23.017
  804    HD2  PHE 108           HD1      PHE 108   5.155  20.519 -20.650
  805    HE1  PHE 108           HE2      PHE 108   8.397  23.769 -22.569
  806    HE2  PHE 108           HE1      PHE 108   7.596  20.237 -20.255
  807    HZ   PHE 108           HZ       PHE 108   9.209  21.878 -21.182
  808    H    SER 109           H        SER 109   2.709  21.529 -19.787
  809    HA   SER 109           HA       SER 109   4.445  22.283 -17.528
  810    HB2  SER 109           HB2      SER 109   2.273  23.105 -16.852
  811    HB3  SER 109           HB3      SER 109   1.506  21.571 -17.286
  812    HG   SER 109           HG       SER 109   3.554  21.803 -15.318
  813    H    LEU 110           H        LEU 110   5.234  20.569 -16.400
  814    HA   LEU 110           HA       LEU 110   5.070  17.852 -17.643
  815    HB2  LEU 110           HB2      LEU 110   6.859  18.839 -18.715
  816    HB3  LEU 110           HB3      LEU 110   7.343  19.803 -17.335
  817    HG   LEU 110           HG       LEU 110   8.370  17.889 -16.256
  818   HD11  LEU 110          HD11      LEU 110   8.621  15.742 -17.500
  819   HD12  LEU 110          HD12      LEU 110   6.936  16.034 -17.044
  820   HD13  LEU 110          HD13      LEU 110   7.472  16.321 -18.718
  821   HD21  LEU 110          HD21      LEU 110  10.195  17.535 -17.847
  822   HD22  LEU 110          HD22      LEU 110   9.178  18.127 -19.176
  823   HD23  LEU 110          HD23      LEU 110   9.665  19.223 -17.867
  824    H    LEU 111           H        LEU 111   3.969  16.898 -16.019
  825    HA   LEU 111           HA       LEU 111   4.794  17.194 -13.204
  826    HB2  LEU 111           HB2      LEU 111   2.466  17.266 -13.772
  827    HB3  LEU 111           HB3      LEU 111   2.523  15.706 -14.575
  828    HG   LEU 111           HG       LEU 111   3.284  15.938 -11.647
  829   HD11  LEU 111          HD11      LEU 111   1.140  17.079 -11.809
  830   HD12  LEU 111          HD12      LEU 111   0.465  15.758 -12.788
  831   HD13  LEU 111          HD13      LEU 111   0.889  15.476 -11.090
  832   HD21  LEU 111          HD21      LEU 111   2.409  13.662 -11.489
  833   HD22  LEU 111          HD22      LEU 111   1.824  13.720 -13.161
  834   HD23  LEU 111          HD23      LEU 111   3.560  13.697 -12.820
  835    H    MET 112           H        MET 112   5.711  15.631 -12.021
  836    HA   MET 112           HA       MET 112   6.760  13.161 -13.348
  837    HB2  MET 112           HB2      MET 112   8.200  14.957 -11.342
  838    HB3  MET 112           HB3      MET 112   8.808  13.439 -12.009
  839    HG2  MET 112           HG2      MET 112   8.826  14.457 -14.274
  840    HG3  MET 112           HG3      MET 112   8.257  15.983 -13.586
  841    HE1  MET 112           HE1      MET 112  10.222  17.309 -14.686
  842    HE2  MET 112           HE2      MET 112  11.939  16.883 -14.515
  843    HE3  MET 112           HE3      MET 112  10.844  15.814 -15.424
  844    H    ALA 113           H        ALA 113   6.293  11.353 -12.197
  845    HA   ALA 113           HA       ALA 113   5.361  11.589  -9.356
  846    HB1  ALA 113           HB1      ALA 113   3.486  11.261 -10.924
  847    HB2  ALA 113           HB2      ALA 113   4.304   9.853 -11.633
  848    HB3  ALA 113           HB3      ALA 113   3.739   9.796  -9.953
  849    H    ASN 114           H        ASN 114   5.954   9.964  -7.930
  850    HA   ASN 114           HA       ASN 114   8.468   8.613  -8.460
  851    HB2  ASN 114           HB2      ASN 114   7.837   9.542  -6.288
  852    HB3  ASN 114           HB3      ASN 114   6.470   8.437  -6.160
  853   HD21  ASN 114          HD22      ASN 114   8.438   8.599  -4.177
  854   HD22  ASN 114          HD21      ASN 114   9.550   7.230  -4.312
  855    H    ALA 115           H        ALA 115   8.620   6.884  -9.782
  856    HA   ALA 115           HA       ALA 115   6.395   5.262 -10.552
  857    HB1  ALA 115           HB1      ALA 115   9.375   4.719 -10.856
  858    HB2  ALA 115           HB2      ALA 115   8.061   3.983 -11.791
  859    HB3  ALA 115           HB3      ALA 115   8.388   5.716 -11.956
  860    H    GLY 116           H        GLY 116   8.482   5.034  -7.775
  861    HA2  GLY 116           HA2      GLY 116   7.900   2.189  -7.203
  862    HA3  GLY 116           HA3      GLY 116   8.927   3.293  -6.285
  863    H    THR 117           H        THR 117   6.159   5.030  -6.812
  864    HA   THR 117           HA       THR 117   4.723   3.994  -4.376
  865    HB   THR 117           HB       THR 117   5.352   6.891  -5.047
  866    HG1  THR 117           HG1      THR 117   7.083   5.844  -4.127
  867   HG21  THR 117          HG21      THR 117   3.200   6.900  -4.002
  868   HG22  THR 117          HG22      THR 117   3.686   5.677  -2.821
  869   HG23  THR 117          HG23      THR 117   4.382   7.320  -2.758
  870    H    GLY 118           H        GLY 118   4.429   5.793  -7.470
  871    HA2  GLY 118           HA2      GLY 118   2.572   5.741  -8.890
  872    HA3  GLY 118           HA3      GLY 118   1.589   5.012  -7.609
  873    H    GLU 119           H        GLU 119   3.496   8.010  -7.159
  874    HA   GLU 119           HA       GLU 119   1.013   9.619  -6.944
  875    HB2  GLU 119           HB2      GLU 119   1.502   8.537  -4.800
  876    HB3  GLU 119           HB3      GLU 119   3.166   9.145  -4.841
  877    HG2  GLU 119           HG2      GLU 119   2.394  11.421  -4.697
  878    HG3  GLU 119           HG3      GLU 119   0.704  10.907  -4.817
  879    HA   PRO 120           HA       PRO 120   3.550  12.783  -8.953
  880    HB2  PRO 120           HB2      PRO 120   1.926  14.607  -7.183
  881    HB3  PRO 120           HB3      PRO 120   2.372  14.799  -8.912
  882    HG2  PRO 120           HG2      PRO 120  -0.094  13.899  -8.234
  883    HG3  PRO 120           HG3      PRO 120   0.807  13.111  -9.571
  884    HD2  PRO 120           HD2      PRO 120   0.496  12.189  -6.711
  885    HD3  PRO 120           HD3      PRO 120   0.405  11.241  -8.227
  886    H    LEU 121           H        LEU 121   5.369  13.888  -8.549
  887    HA   LEU 121           HA       LEU 121   6.453  14.040  -5.779
  888    HB2  LEU 121           HB2      LEU 121   7.016  12.089  -7.313
  889    HB3  LEU 121           HB3      LEU 121   7.724  13.224  -8.437
  890    HG   LEU 121           HG       LEU 121   9.387  12.103  -7.272
  891   HD11  LEU 121          HD11      LEU 121  10.790  13.841  -6.567
  892   HD12  LEU 121          HD12      LEU 121   9.666  14.610  -7.674
  893   HD13  LEU 121          HD13      LEU 121   9.457  14.814  -5.920
  894   HD21  LEU 121          HD21      LEU 121   9.681  12.040  -4.869
  895   HD22  LEU 121          HD22      LEU 121   8.325  13.170  -4.621
  896   HD23  LEU 121          HD23      LEU 121   8.023  11.535  -5.229
  897    H    LEU 122           H        LEU 122   6.782  15.273  -9.114
  898    HA   LEU 122           HA       LEU 122   7.363  18.001  -8.112
  899    HB2  LEU 122           HB2      LEU 122   9.430  16.328  -9.208
  900    HB3  LEU 122           HB3      LEU 122   8.973  17.430 -10.485
  901    HG   LEU 122           HG       LEU 122   9.241  19.319  -8.726
  902   HD11  LEU 122          HD11      LEU 122   9.400  17.830  -6.726
  903   HD12  LEU 122          HD12      LEU 122  10.887  17.125  -7.383
  904   HD13  LEU 122          HD13      LEU 122  10.836  18.842  -6.924
  905   HD21  LEU 122          HD21      LEU 122  11.673  19.403  -9.096
  906   HD22  LEU 122          HD22      LEU 122  11.623  17.753  -9.758
  907   HD23  LEU 122          HD23      LEU 122  10.760  19.081 -10.575
  908    H    THR 123           H        THR 123   7.013  19.636  -9.732
  909    HA   THR 123           HA       THR 123   5.638  18.831 -12.242
  910    HB   THR 123           HB       THR 123   4.411  20.862 -10.344
  911    HG1  THR 123           HG1      THR 123   4.102  18.101 -10.524
  912   HG21  THR 123          HG21      THR 123   3.742  21.115 -12.700
  913   HG22  THR 123          HG22      THR 123   3.310  19.390 -12.771
  914   HG23  THR 123          HG23      THR 123   2.402  20.493 -11.717
  915    H    LEU 124           H        LEU 124   6.662  19.836 -13.802
  916    HA   LEU 124           HA       LEU 124   7.938  22.461 -13.351
  917    HB2  LEU 124           HB2      LEU 124   8.332  20.200 -15.277
  918    HB3  LEU 124           HB3      LEU 124   8.586  21.829 -15.895
  919    HG   LEU 124           HG       LEU 124  10.202  22.304 -14.112
  920   HD11  LEU 124          HD11      LEU 124   9.935  19.360 -13.342
  921   HD12  LEU 124          HD12      LEU 124  11.097  20.542 -12.680
  922   HD13  LEU 124          HD13      LEU 124   9.389  20.731 -12.353
  923   HD21  LEU 124          HD21      LEU 124  10.947  21.404 -16.277
  924   HD22  LEU 124          HD22      LEU 124  12.010  20.904 -14.954
  925   HD23  LEU 124          HD23      LEU 124  10.839  19.749 -15.633
  926    H    VAL 125           H        VAL 125   7.506  24.208 -14.629
  927    HA   VAL 125           HA       VAL 125   4.898  24.288 -16.069
  928    HB   VAL 125           HB       VAL 125   5.530  26.291 -13.880
  929   HG11  VAL 125          HG11      VAL 125   3.079  26.609 -13.899
  930   HG12  VAL 125          HG12      VAL 125   3.753  26.875 -15.506
  931   HG13  VAL 125          HG13      VAL 125   2.913  25.349 -15.140
  932   HG21  VAL 125          HG21      VAL 125   3.977  23.702 -13.463
  933   HG22  VAL 125          HG22      VAL 125   5.465  24.200 -12.627
  934   HG23  VAL 125          HG23      VAL 125   3.979  25.090 -12.346
  935    H    CYS 126           H        CYS 126   4.761  25.682 -17.722
  936    HA   CYS 126           HA       CYS 126   6.919  27.720 -18.132
  937    HB2  CYS 126           HB2      CYS 126   6.839  25.642 -19.662
  938    HB3  CYS 126           HB3      CYS 126   5.281  26.239 -20.211
  939    HG   CYS 126           HG       CYS 126   6.861  26.886 -22.081
  940    H    SER 127           H        SER 127   6.284  29.629 -19.302
  941    HA   SER 127           HA       SER 127   3.396  30.406 -19.166
  942    HB2  SER 127           HB2      SER 127   4.109  32.528 -18.136
  943    HB3  SER 127           HB3      SER 127   4.555  31.132 -17.141
  944    HG   SER 127           HG       SER 127   6.283  32.631 -17.365
  945    H    GLY 128           H        GLY 128   5.907  30.122 -21.311
  946    HA2  GLY 128           HA2      GLY 128   5.207  30.953 -23.589
  947    HA3  GLY 128           HA3      GLY 128   5.141  32.564 -22.888
  948    H    SER 129           H        SER 129   7.742  31.480 -21.321
  949    HA   SER 129           HA       SER 129   9.780  31.763 -23.420
  950    HB2  SER 129           HB2      SER 129  10.723  33.830 -22.506
  951    HB3  SER 129           HB3      SER 129   9.080  34.080 -23.112
  952    HG   SER 129           HG       SER 129   9.398  35.058 -21.066
  953    H    TRP 130           H        TRP 130  11.918  31.588 -22.721
  954    HA   TRP 130           HA       TRP 130  12.512  29.610 -20.876
  955    HB2  TRP 130           HB2      TRP 130  13.934  30.057 -22.692
  956    HB3  TRP 130           HB3      TRP 130  14.042  31.768 -22.333
  957    HD1  TRP 130           HD1      TRP 130  15.962  32.637 -20.944
  958    HE1  TRP 130           HE1      TRP 130  17.958  31.624 -19.693
  959    HE3  TRP 130           HE3      TRP 130  14.715  27.680 -21.318
  960    HZ2  TRP 130           HZ2      TRP 130  18.883  29.006 -18.920
  961    HZ3  TRP 130           HZ3      TRP 130  16.156  25.959 -20.251
  962    HH2  TRP 130           HH2      TRP 130  18.227  26.607 -19.065
  963    HA   PRO 131           HA       PRO 131  13.306  28.560 -19.359
  964    HB2  PRO 131           HB2      PRO 131  14.203  27.763 -16.975
  965    HB3  PRO 131           HB3      PRO 131  15.283  28.662 -18.070
  966    HG2  PRO 131           HG2      PRO 131  13.720  29.732 -15.720
  967    HG3  PRO 131           HG3      PRO 131  15.445  29.989 -16.139
  968    HD2  PRO 131           HD2      PRO 131  13.375  31.752 -16.820
  969    HD3  PRO 131           HD3      PRO 131  14.907  31.611 -17.726
  970    H    LEU 132           H        LEU 132  12.274  26.715 -17.949
  971    HA   LEU 132           HA       LEU 132   9.570  27.406 -17.060
  972    HB2  LEU 132           HB2      LEU 132  11.207  24.842 -17.261
  973    HB3  LEU 132           HB3      LEU 132   9.766  24.906 -16.266
  974    HG   LEU 132           HG       LEU 132   8.542  25.859 -18.324
  975   HD11  LEU 132          HD11      LEU 132  10.475  26.245 -19.797
  976   HD12  LEU 132          HD12      LEU 132  10.872  24.510 -19.714
  977   HD13  LEU 132          HD13      LEU 132   9.374  25.057 -20.494
  978   HD21  LEU 132          HD21      LEU 132   8.043  23.587 -19.124
  979   HD22  LEU 132          HD22      LEU 132   9.475  22.966 -18.267
  980   HD23  LEU 132          HD23      LEU 132   8.106  23.654 -17.365
  981    H    ASP 133           H        ASP 133   8.822  26.565 -14.989
  982    HA   ASP 133           HA       ASP 133  10.735  27.031 -12.720
  983    HB2  ASP 133           HB2      ASP 133   8.991  28.832 -12.966
  984    HB3  ASP 133           HB3      ASP 133   7.745  27.593 -12.766
  985    H    GLN 134           H        GLN 134  10.080  25.735 -10.745
  986    HA   GLN 134           HA       GLN 134   8.588  23.264 -11.355
  987    HB2  GLN 134           HB2      GLN 134  10.380  21.831 -10.576
  988    HB3  GLN 134           HB3      GLN 134  10.908  22.806 -11.958
  989    HG2  GLN 134           HG2      GLN 134  12.045  24.359 -10.350
  990    HG3  GLN 134           HG3      GLN 134  11.646  23.213  -9.054
  991   HE21  GLN 134          HE22      GLN 134  12.603  20.975  -9.244
  992   HE22  GLN 134          HE21      GLN 134  14.127  20.840 -10.107
  993    H    THR 135           H        THR 135   7.737  22.176  -9.623
  994    HA   THR 135           HA       THR 135   8.065  23.258  -6.864
  995    HB   THR 135           HB       THR 135   6.212  24.458  -7.960
  996    HG1  THR 135           HG1      THR 135   6.058  24.113  -5.780
  997   HG21  THR 135          HG21      THR 135   4.815  21.751  -8.160
  998   HG22  THR 135          HG22      THR 135   4.064  23.334  -8.413
  999   HG23  THR 135          HG23      THR 135   5.317  22.799  -9.517
 1000    H    LEU 136           H        LEU 136   7.411  21.781  -5.198
 1001    HA   LEU 136           HA       LEU 136   7.511  18.936  -5.907
 1002    HB2  LEU 136           HB2      LEU 136   7.202  20.483  -3.318
 1003    HB3  LEU 136           HB3      LEU 136   6.799  18.773  -3.404
 1004    HG   LEU 136           HG       LEU 136   9.080  18.227  -4.202
 1005   HD11  LEU 136          HD11      LEU 136   9.690  21.158  -3.617
 1006   HD12  LEU 136          HD12      LEU 136  10.902  19.885  -3.888
 1007   HD13  LEU 136          HD13      LEU 136   9.815  20.346  -5.196
 1008   HD21  LEU 136          HD21      LEU 136   8.472  18.103  -1.815
 1009   HD22  LEU 136          HD22      LEU 136  10.169  18.554  -2.027
 1010   HD23  LEU 136          HD23      LEU 136   8.971  19.794  -1.593
 1011    H    ALA 137           H        ALA 137   5.888  17.634  -6.218
 1012    HA   ALA 137           HA       ALA 137   3.802  17.199  -7.181
 1013    HB1  ALA 137           HB1      ALA 137   3.425  17.272  -4.162
 1014    HB2  ALA 137           HB2      ALA 137   2.508  16.269  -5.307
 1015    HB3  ALA 137           HB3      ALA 137   4.245  15.993  -5.082
 1016    H    ARG 138           H        ARG 138   3.478  19.376  -8.195
 1017    HA   ARG 138           HA       ARG 138   2.116  20.981  -8.936
 1018    HB2  ARG 138           HB2      ARG 138  -0.152  19.704  -7.374
 1019    HB3  ARG 138           HB3      ARG 138  -0.255  20.688  -8.804
 1020    HG2  ARG 138           HG2      ARG 138  -0.497  18.755  -9.883
 1021    HG3  ARG 138           HG3      ARG 138   1.253  18.733  -9.857
 1022    HD2  ARG 138           HD2      ARG 138   0.587  16.580  -9.187
 1023    HD3  ARG 138           HD3      ARG 138   1.060  17.330  -7.685
 1024    HE   ARG 138           HE       ARG 138  -1.697  16.715  -8.627
 1025   HH11  ARG 138          HH11      ARG 138   0.151  17.988  -5.874
 1026   HH12  ARG 138          HH12      ARG 138  -1.141  17.581  -4.787
 1027   HH21  ARG 138          HH21      ARG 138  -3.259  16.335  -7.148
 1028   HH22  ARG 138          HH22      ARG 138  -3.004  16.736  -5.481
 1029    H    ASP 139           H        ASP 139   3.108  21.413  -5.859
 1030    HA   ASP 139           HA       ASP 139   1.090  22.867  -4.636
 1031    HB2  ASP 139           HB2      ASP 139   3.105  22.003  -3.537
 1032    HB3  ASP 139           HB3      ASP 139   4.065  23.282  -4.272
 1033    H    THR 140           H        THR 140   3.351  24.297  -6.992
 1034    HA   THR 140           HA       THR 140   1.965  26.934  -6.735
 1035    HB   THR 140           HB       THR 140   3.596  27.789  -8.305
 1036    HG1  THR 140           HG1      THR 140   5.129  26.486  -9.192
 1037   HG21  THR 140          HG21      THR 140   5.018  26.099  -6.223
 1038   HG22  THR 140          HG22      THR 140   5.687  27.486  -7.104
 1039   HG23  THR 140          HG23      THR 140   4.340  27.722  -5.970
 1040    H    ARG 141           H        ARG 141   1.339  24.131  -8.469
 1041    HA   ARG 141           HA       ARG 141   1.214  25.088 -11.135
 1042    HB2  ARG 141           HB2      ARG 141   1.506  22.722 -10.468
 1043    HB3  ARG 141           HB3      ARG 141  -0.161  22.683  -9.886
 1044    HG2  ARG 141           HG2      ARG 141   0.053  21.594 -12.061
 1045    HG3  ARG 141           HG3      ARG 141  -1.023  22.981 -12.138
 1046    HD2  ARG 141           HD2      ARG 141   0.963  24.336 -13.065
 1047    HD3  ARG 141           HD3      ARG 141   1.867  22.822 -13.095
 1048    HE   ARG 141           HE       ARG 141   0.739  22.194 -14.977
 1049   HH11  ARG 141          HH21      ARG 141  -1.059  24.911 -13.587
 1050   HH12  ARG 141          HH22      ARG 141  -2.071  25.052 -14.997
 1051   HH21  ARG 141          HH11      ARG 141  -0.740  22.394 -16.677
 1052   HH22  ARG 141          HH12      ARG 141  -1.888  23.692 -16.673
 1053    HA   PRO 142           HA       PRO 142  -3.666  25.468 -10.494
 1054    HB2  PRO 142           HB2      PRO 142  -3.368  27.136  -7.986
 1055    HB3  PRO 142           HB3      PRO 142  -4.781  26.186  -8.547
 1056    HG2  PRO 142           HG2      PRO 142  -3.119  25.142  -6.692
 1057    HG3  PRO 142           HG3      PRO 142  -3.670  24.117  -8.059
 1058    HD2  PRO 142           HD2      PRO 142  -1.038  25.555  -7.719
 1059    HD3  PRO 142           HD3      PRO 142  -1.356  23.902  -8.327
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1   7.353  -2.474   2.448
    2    H2   MET   1           H2       MET   1   8.833  -2.314   1.779
    3    H3   MET   1           H3       MET   1   7.831  -1.028   1.838
    4    HA   MET   1           HA       MET   1   7.395  -3.477   0.244
    5    HB2  MET   1           HB2      MET   1   5.703  -0.936   0.421
    6    HB3  MET   1           HB3      MET   1   5.537  -2.167  -0.831
    7    HG2  MET   1           HG2      MET   1   5.014  -3.870   0.888
    8    HG3  MET   1           HG3      MET   1   5.100  -2.622   2.140
    9    HE1  MET   1           HE1      MET   1   2.706  -3.334   3.006
   10    HE2  MET   1           HE2      MET   1   1.272  -3.446   1.963
   11    HE3  MET   1           HE3      MET   1   2.621  -4.581   1.739
   12    H    ALA   2           H        ALA   2   7.892  -3.355  -1.954
   13    HA   ALA   2           HA       ALA   2  10.141  -1.847  -2.680
   14    HB1  ALA   2           HB1      ALA   2   9.502  -4.041  -3.608
   15    HB2  ALA   2           HB2      ALA   2   8.127  -3.291  -4.456
   16    HB3  ALA   2           HB3      ALA   2   9.795  -2.860  -4.893
   17    H    TYR   3           H        TYR   3   6.908  -0.664  -2.753
   18    HA   TYR   3           HA       TYR   3   7.227   1.323  -4.835
   19    HB2  TYR   3           HB2      TYR   3   5.344   1.507  -2.476
   20    HB3  TYR   3           HB3      TYR   3   5.109   2.109  -4.105
   21    HD1  TYR   3           HD2      TYR   3   5.444  -0.095  -5.913
   22    HD2  TYR   3           HD1      TYR   3   3.827  -0.152  -1.909
   23    HE1  TYR   3           HE2      TYR   3   4.189  -2.170  -6.449
   24    HE2  TYR   3           HE1      TYR   3   2.579  -2.234  -2.448
   25    HH   TYR   3           HH       TYR   3   2.753  -3.781  -5.675
   26    H    GLY   4           H        GLY   4   8.240   1.156  -1.510
   27    HA2  GLY   4           HA2      GLY   4   8.012   3.888  -0.731
   28    HA3  GLY   4           HA3      GLY   4   8.883   2.610   0.110
   29    H    ARG   5           H        ARG   5   9.181   4.647  -2.774
   30    HA   ARG   5           HA       ARG   5  12.151   4.930  -2.376
   31    HB2  ARG   5           HB2      ARG   5  10.596   5.208  -4.972
   32    HB3  ARG   5           HB3      ARG   5  12.346   5.088  -4.773
   33    HG2  ARG   5           HG2      ARG   5  12.067   2.731  -3.962
   34    HG3  ARG   5           HG3      ARG   5  10.321   2.879  -4.231
   35    HD2  ARG   5           HD2      ARG   5  10.941   3.562  -6.658
   36    HD3  ARG   5           HD3      ARG   5  12.535   2.868  -6.281
   37    HE   ARG   5           HE       ARG   5  10.530   1.012  -5.481
   38   HH11  ARG   5          HH11      ARG   5  11.822   2.233  -8.519
   39   HH12  ARG   5          HH12      ARG   5  11.153   0.876  -9.406
   40   HH21  ARG   5          HH21      ARG   5   9.781  -0.608  -6.605
   41   HH22  ARG   5          HH22      ARG   5  10.042  -0.740  -8.331
   42    H    GLU   6           H        GLU   6   9.638   6.730  -1.602
   43    HA   GLU   6           HA       GLU   6   9.514   8.976  -3.193
   44    HB2  GLU   6           HB2      GLU   6   8.422  10.096  -1.395
   45    HB3  GLU   6           HB3      GLU   6   7.888   8.431  -1.497
   46    HG2  GLU   6           HG2      GLU   6   9.831   9.583   0.552
   47    HG3  GLU   6           HG3      GLU   6   8.135   9.224   0.823
   48    H    ASP   7           H        ASP   7  11.982   8.597  -0.600
   49    HA   ASP   7           HA       ASP   7  12.921  11.326  -0.848
   50    HB2  ASP   7           HB2      ASP   7  13.281   9.910   1.147
   51    HB3  ASP   7           HB3      ASP   7  14.306   8.829   0.202
   52    H    VAL   8           H        VAL   8  13.889   8.277  -2.377
   53    HA   VAL   8           HA       VAL   8  16.133   9.380  -3.888
   54    HB   VAL   8           HB       VAL   8  14.506   6.859  -4.442
   55   HG11  VAL   8          HG11      VAL   8  16.530   6.141  -5.685
   56   HG12  VAL   8          HG12      VAL   8  15.815   7.581  -6.409
   57   HG13  VAL   8          HG13      VAL   8  17.270   7.731  -5.401
   58   HG21  VAL   8          HG21      VAL   8  16.385   5.663  -3.347
   59   HG22  VAL   8          HG22      VAL   8  17.108   7.221  -2.891
   60   HG23  VAL   8          HG23      VAL   8  15.544   6.719  -2.211
   61    H    ALA   9           H        ALA   9  12.686   8.666  -4.599
   62    HA   ALA   9           HA       ALA   9  12.694   9.631  -7.272
   63    HB1  ALA   9           HB1      ALA   9  10.262   9.657  -7.026
   64    HB2  ALA   9           HB2      ALA   9  10.939   8.188  -6.296
   65    HB3  ALA   9           HB3      ALA   9  10.409   9.535  -5.260
   66    H    ASN  10           H        ASN  10  12.080  11.436  -4.176
   67    HA   ASN  10           HA       ASN  10  11.573  13.953  -5.453
   68    HB2  ASN  10           HB2      ASN  10  11.090  13.445  -3.046
   69    HB3  ASN  10           HB3      ASN  10  12.820  13.371  -2.722
   70   HD21  ASN  10          HD22      ASN  10  10.107  15.518  -3.475
   71   HD22  ASN  10          HD21      ASN  10  10.986  16.989  -3.109
   72    H    THR  11           H        THR  11  14.642  12.588  -4.212
   73    HA   THR  11           HA       THR  11  16.326  14.730  -5.011
   74    HB   THR  11           HB       THR  11  17.081  11.776  -4.967
   75    HG1  THR  11           HG1      THR  11  16.187  12.257  -3.006
   76   HG21  THR  11          HG21      THR  11  18.836  13.265  -5.892
   77   HG22  THR  11          HG22      THR  11  18.702  14.317  -4.467
   78   HG23  THR  11          HG23      THR  11  19.297  12.649  -4.300
   79    H    ARG  12           H        ARG  12  15.571  11.709  -6.812
   80    HA   ARG  12           HA       ARG  12  16.896  12.497  -9.225
   81    HB2  ARG  12           HB2      ARG  12  14.818  10.389  -8.555
   82    HB3  ARG  12           HB3      ARG  12  15.414  10.604 -10.201
   83    HG2  ARG  12           HG2      ARG  12  17.251  10.057  -7.832
   84    HG3  ARG  12           HG3      ARG  12  16.528   8.791  -8.831
   85    HD2  ARG  12           HD2      ARG  12  17.558   9.774 -10.856
   86    HD3  ARG  12           HD3      ARG  12  18.349  11.004  -9.880
   87    HE   ARG  12           HE       ARG  12  19.166   8.212 -10.197
   88   HH11  ARG  12          HH11      ARG  12  19.688  11.007  -8.093
   89   HH12  ARG  12          HH12      ARG  12  20.911  10.136  -7.205
   90   HH21  ARG  12          HH21      ARG  12  20.773   7.369  -9.234
   91   HH22  ARG  12          HH22      ARG  12  21.591   8.142  -7.874
   92    H    ALA  13           H        ALA  13  13.520  13.166  -8.188
   93    HA   ALA  13           HA       ALA  13  12.589  14.110 -10.710
   94    HB1  ALA  13           HB1      ALA  13  11.864  15.072  -7.919
   95    HB2  ALA  13           HB2      ALA  13  10.963  15.373  -9.420
   96    HB3  ALA  13           HB3      ALA  13  11.105  13.730  -8.799
   97    H    ARG  14           H        ARG  14  14.217  15.774  -7.995
   98    HA   ARG  14           HA       ARG  14  14.314  18.411  -9.185
   99    HB2  ARG  14           HB2      ARG  14  15.823  17.087  -6.891
  100    HB3  ARG  14           HB3      ARG  14  15.962  18.805  -7.283
  101    HG2  ARG  14           HG2      ARG  14  13.725  19.276  -6.675
  102    HG3  ARG  14           HG3      ARG  14  13.211  17.598  -6.841
  103    HD2  ARG  14           HD2      ARG  14  13.245  18.165  -4.514
  104    HD3  ARG  14           HD3      ARG  14  14.466  16.936  -4.870
  105    HE   ARG  14           HE       ARG  14  15.610  19.592  -4.916
  106   HH11  ARG  14          HH11      ARG  14  14.528  17.113  -2.669
  107   HH12  ARG  14          HH12      ARG  14  15.659  17.624  -1.441
  108   HH21  ARG  14          HH21      ARG  14  17.016  20.179  -3.283
  109   HH22  ARG  14          HH22      ARG  14  17.008  19.314  -1.778
  110    H    GLU  15           H        GLU  15  16.676  15.755  -9.052
  111    HA   GLU  15           HA       GLU  15  18.721  17.043 -10.629
  112    HB2  GLU  15           HB2      GLU  15  17.944  14.134 -10.234
  113    HB3  GLU  15           HB3      GLU  15  19.352  14.635 -11.180
  114    HG2  GLU  15           HG2      GLU  15  20.331  15.754  -9.237
  115    HG3  GLU  15           HG3      GLU  15  18.938  15.337  -8.244
  116    H    THR  16           H        THR  16  15.967  14.939 -11.666
  117    HA   THR  16           HA       THR  16  16.466  15.052 -14.452
  118    HB   THR  16           HB       THR  16  13.747  14.911 -13.092
  119    HG1  THR  16           HG1      THR  16  15.061  13.254 -12.426
  120   HG21  THR  16          HG21      THR  16  13.519  15.337 -15.523
  121   HG22  THR  16          HG22      THR  16  14.641  14.002 -15.863
  122   HG23  THR  16          HG23      THR  16  13.060  13.678 -15.124
  123    H    ALA  17           H        ALA  17  14.658  17.336 -12.397
  124    HA   ALA  17           HA       ALA  17  13.891  19.104 -14.505
  125    HB1  ALA  17           HB1      ALA  17  12.800  19.110 -12.335
  126    HB2  ALA  17           HB2      ALA  17  14.316  19.566 -11.524
  127    HB3  ALA  17           HB3      ALA  17  13.530  20.708 -12.625
  128    H    ALA  18           H        ALA  18  16.807  19.254 -12.357
  129    HA   ALA  18           HA       ALA  18  17.892  21.613 -13.576
  130    HB1  ALA  18           HB1      ALA  18  18.619  20.714 -11.396
  131    HB2  ALA  18           HB2      ALA  18  19.290  19.275 -12.194
  132    HB3  ALA  18           HB3      ALA  18  19.993  20.876 -12.507
  133    H    ARG  19           H        ARG  19  18.334  18.166 -14.307
  134    HA   ARG  19           HA       ARG  19  20.215  18.377 -16.473
  135    HB2  ARG  19           HB2      ARG  19  19.702  16.343 -15.121
  136    HB3  ARG  19           HB3      ARG  19  18.087  16.303 -15.807
  137    HG2  ARG  19           HG2      ARG  19  19.246  14.657 -16.882
  138    HG3  ARG  19           HG3      ARG  19  19.146  15.943 -18.085
  139    HD2  ARG  19           HD2      ARG  19  21.471  16.396 -17.922
  140    HD3  ARG  19           HD3      ARG  19  21.609  15.598 -16.348
  141    HE   ARG  19           HE       ARG  19  21.136  13.426 -17.498
  142   HH11  ARG  19          HH11      ARG  19  22.750  15.907 -19.456
  143   HH12  ARG  19          HH12      ARG  19  23.303  14.637 -20.559
  144   HH21  ARG  19          HH21      ARG  19  21.822  12.041 -19.085
  145   HH22  ARG  19          HH22      ARG  19  22.876  12.704 -20.343
  146    H    PHE  20           H        PHE  20  16.628  18.151 -16.522
  147    HA   PHE  20           HA       PHE  20  16.232  18.554 -19.302
  148    HB2  PHE  20           HB2      PHE  20  14.385  17.867 -17.929
  149    HB3  PHE  20           HB3      PHE  20  14.598  19.225 -16.845
  150    HD1  PHE  20           HD2      PHE  20  14.326  19.076 -20.630
  151    HD2  PHE  20           HD1      PHE  20  12.821  20.676 -16.926
  152    HE1  PHE  20           HE2      PHE  20  12.700  20.460 -21.871
  153    HE2  PHE  20           HE1      PHE  20  11.195  22.061 -18.182
  154    HZ   PHE  20           HZ       PHE  20  11.108  21.926 -20.674
  155    H    THR  21           H        THR  21  16.418  21.031 -16.662
  156    HA   THR  21           HA       THR  21  15.999  23.277 -18.333
  157    HB   THR  21           HB       THR  21  17.690  23.184 -15.804
  158    HG1  THR  21           HG1      THR  21  15.647  22.401 -15.416
  159   HG21  THR  21          HG21      THR  21  16.836  25.554 -15.538
  160   HG22  THR  21          HG22      THR  21  17.978  25.347 -16.866
  161   HG23  THR  21          HG23      THR  21  16.232  25.483 -17.199
  162    H    ALA  22           H        ALA  22  19.129  21.638 -17.551
  163    HA   ALA  22           HA       ALA  22  20.691  23.332 -19.255
  164    HB1  ALA  22           HB1      ALA  22  21.149  20.439 -18.391
  165    HB2  ALA  22           HB2      ALA  22  22.375  21.536 -19.061
  166    HB3  ALA  22           HB3      ALA  22  21.640  21.888 -17.485
  167    H    ALA  23           H        ALA  23  18.957  20.270 -19.993
  168    HA   ALA  23           HA       ALA  23  19.837  20.062 -22.716
  169    HB1  ALA  23           HB1      ALA  23  17.993  18.496 -22.962
  170    HB2  ALA  23           HB2      ALA  23  18.837  18.209 -21.427
  171    HB3  ALA  23           HB3      ALA  23  17.269  19.049 -21.440
  172    H    LEU  24           H        LEU  24  17.147  21.862 -21.246
  173    HA   LEU  24           HA       LEU  24  16.015  22.769 -23.737
  174    HB2  LEU  24           HB2      LEU  24  14.875  22.524 -21.477
  175    HB3  LEU  24           HB3      LEU  24  15.766  23.934 -20.945
  176    HG   LEU  24           HG       LEU  24  14.638  25.214 -22.887
  177   HD11  LEU  24          HD11      LEU  24  12.866  22.714 -22.867
  178   HD12  LEU  24          HD12      LEU  24  12.531  24.219 -23.737
  179   HD13  LEU  24          HD13      LEU  24  13.912  23.214 -24.207
  180   HD21  LEU  24          HD21      LEU  24  12.520  25.464 -21.650
  181   HD22  LEU  24          HD22      LEU  24  12.868  23.971 -20.746
  182   HD23  LEU  24          HD23      LEU  24  13.894  25.401 -20.530
  183    H    GLU  25           H        GLU  25  18.467  24.148 -21.497
  184    HA   GLU  25           HA       GLU  25  18.898  26.607 -22.909
  185    HB2  GLU  25           HB2      GLU  25  19.858  25.932 -20.635
  186    HB3  GLU  25           HB3      GLU  25  21.044  24.968 -21.504
  187    HG2  GLU  25           HG2      GLU  25  21.796  27.021 -22.716
  188    HG3  GLU  25           HG3      GLU  25  20.609  27.967 -21.817
  189    H    LEU  26           H        LEU  26  20.447  23.406 -23.268
  190    HA   LEU  26           HA       LEU  26  22.019  23.819 -25.578
  191    HB2  LEU  26           HB2      LEU  26  22.334  21.802 -24.458
  192    HB3  LEU  26           HB3      LEU  26  20.631  21.539 -24.227
  193    HG   LEU  26           HG       LEU  26  20.419  20.960 -26.696
  194   HD11  LEU  26          HD11      LEU  26  22.536  21.996 -27.475
  195   HD12  LEU  26          HD12      LEU  26  23.458  20.846 -26.481
  196   HD13  LEU  26          HD13      LEU  26  22.475  20.264 -27.843
  197   HD21  LEU  26          HD21      LEU  26  21.305  18.694 -26.346
  198   HD22  LEU  26          HD22      LEU  26  22.180  19.259 -24.902
  199   HD23  LEU  26          HD23      LEU  26  20.400  19.286 -24.946
  200    H    ALA  27           H        ALA  27  18.567  22.885 -25.409
  201    HA   ALA  27           HA       ALA  27  18.110  22.883 -28.205
  202    HB1  ALA  27           HB1      ALA  27  16.174  23.469 -25.925
  203    HB2  ALA  27           HB2      ALA  27  15.722  23.034 -27.577
  204    HB3  ALA  27           HB3      ALA  27  16.594  21.864 -26.559
  205    H    ILE  28           H        ILE  28  17.903  25.671 -25.928
  206    HA   ILE  28           HA       ILE  28  16.920  27.557 -27.890
  207    HB   ILE  28           HB       ILE  28  18.497  27.960 -25.317
  208   HG12  ILE  28          HG12      ILE  28  15.557  28.534 -25.853
  209   HG13  ILE  28          HG13      ILE  28  16.095  26.964 -25.284
  210   HG21  ILE  28          HG21      ILE  28  17.718  30.347 -25.448
  211   HG22  ILE  28          HG22      ILE  28  18.849  29.940 -26.729
  212   HG23  ILE  28          HG23      ILE  28  17.112  30.031 -27.088
  213   HD11  ILE  28          HD11      ILE  28  16.356  29.572 -23.789
  214   HD12  ILE  28          HD12      ILE  28  15.366  28.144 -23.403
  215   HD13  ILE  28          HD13      ILE  28  17.131  28.047 -23.290
  216    H    ASP  29           H        ASP  29  20.262  26.797 -26.779
  217    HA   ASP  29           HA       ASP  29  21.600  28.532 -28.608
  218    HB2  ASP  29           HB2      ASP  29  22.639  27.459 -26.632
  219    HB3  ASP  29           HB3      ASP  29  22.507  25.884 -27.413
  220    H    ARG  30           H        ARG  30  20.494  25.171 -28.994
  221    HA   ARG  30           HA       ARG  30  21.528  24.881 -31.670
  222    HB2  ARG  30           HB2      ARG  30  20.977  23.011 -30.083
  223    HB3  ARG  30           HB3      ARG  30  19.274  23.405 -30.213
  224    HG2  ARG  30           HG2      ARG  30  19.799  21.470 -31.538
  225    HG3  ARG  30           HG3      ARG  30  19.288  22.787 -32.598
  226    HD2  ARG  30           HD2      ARG  30  21.107  21.615 -33.618
  227    HD3  ARG  30           HD3      ARG  30  21.656  23.228 -33.185
  228    HE   ARG  30           HE       ARG  30  22.622  22.078 -31.072
  229   HH11  ARG  30          HH21      ARG  30  22.551  20.374 -34.185
  230   HH12  ARG  30          HH22      ARG  30  23.920  19.381 -33.669
  231   HH21  ARG  30          HH11      ARG  30  24.390  20.724 -30.664
  232   HH22  ARG  30          HH12      ARG  30  24.836  19.584 -31.936
  233    H    ALA  31           H        ALA  31  18.304  25.968 -30.493
  234    HA   ALA  31           HA       ALA  31  17.156  26.253 -33.103
  235    HB1  ALA  31           HB1      ALA  31  15.851  26.232 -30.985
  236    HB2  ALA  31           HB2      ALA  31  16.564  27.791 -30.529
  237    HB3  ALA  31           HB3      ALA  31  15.509  27.672 -31.954
  238    H    THR  32           H        THR  32  19.348  28.425 -31.283
  239    HA   THR  32           HA       THR  32  18.921  30.602 -33.184
  240    HB   THR  32           HB       THR  32  19.745  30.581 -30.624
  241    HG1  THR  32           HG1      THR  32  19.077  32.365 -31.408
  242   HG21  THR  32          HG21      THR  32  22.013  31.317 -30.396
  243   HG22  THR  32          HG22      THR  32  22.027  29.721 -31.151
  244   HG23  THR  32          HG23      THR  32  22.319  31.167 -32.139
  245    H    LEU  33           H        LEU  33  20.986  27.800 -33.139
  246    HA   LEU  33           HA       LEU  33  22.714  28.917 -35.214
  247    HB2  LEU  33           HB2      LEU  33  24.301  27.403 -34.610
  248    HB3  LEU  33           HB3      LEU  33  23.452  27.672 -33.098
  249    HG   LEU  33           HG       LEU  33  22.165  25.512 -33.615
  250   HD11  LEU  33          HD11      LEU  33  23.541  23.803 -34.838
  251   HD12  LEU  33          HD12      LEU  33  22.873  25.006 -35.920
  252   HD13  LEU  33          HD13      LEU  33  24.579  25.111 -35.440
  253   HD21  LEU  33          HD21      LEU  33  23.978  24.182 -32.574
  254   HD22  LEU  33          HD22      LEU  33  25.144  25.456 -32.991
  255   HD23  LEU  33          HD23      LEU  33  23.842  25.779 -31.828
  256    H    SER  34           H        SER  34  20.073  26.624 -34.985
  257    HA   SER  34           HA       SER  34  20.752  25.251 -37.468
  258    HB2  SER  34           HB2      SER  34  18.276  24.982 -35.735
  259    HB3  SER  34           HB3      SER  34  18.835  23.858 -36.996
  260    HG   SER  34           HG       SER  34  19.997  24.478 -34.504
  261    H    GLY  35           H        GLY  35  18.831  28.070 -36.891
  262    HA2  GLY  35           HA2      GLY  35  17.791  29.421 -38.469
  263    HA3  GLY  35           HA3      GLY  35  18.069  28.198 -39.707
  264    H    GLN  36           H        GLN  36  16.540  26.609 -37.262
  265    HA   GLN  36           HA       GLN  36  13.759  27.425 -37.735
  266    HB2  GLN  36           HB2      GLN  36  13.989  25.705 -39.411
  267    HB3  GLN  36           HB3      GLN  36  14.906  24.677 -38.347
  268    HG2  GLN  36           HG2      GLN  36  12.737  24.499 -36.914
  269    HG3  GLN  36           HG3      GLN  36  11.918  25.228 -38.292
  270   HE21  GLN  36          HE22      GLN  36  12.151  22.360 -36.854
  271   HE22  GLN  36          HE21      GLN  36  12.253  21.303 -38.254
  272    HA   PRO  37           HA       PRO  37  13.553  26.723 -33.260
  273    HB2  PRO  37           HB2      PRO  37  10.981  25.339 -34.089
  274    HB3  PRO  37           HB3      PRO  37  11.263  26.388 -32.667
  275    HG2  PRO  37           HG2      PRO  37  10.126  27.451 -34.848
  276    HG3  PRO  37           HG3      PRO  37  11.475  28.337 -34.060
  277    HD2  PRO  37           HD2      PRO  37  11.548  26.610 -36.527
  278    HD3  PRO  37           HD3      PRO  37  12.348  28.179 -36.221
  279    H    VAL  38           H        VAL  38  13.314  25.031 -31.666
  280    HA   VAL  38           HA       VAL  38  14.042  22.248 -32.549
  281    HB   VAL  38           HB       VAL  38  15.235  23.945 -30.325
  282   HG11  VAL  38          HG11      VAL  38  15.068  21.651 -29.441
  283   HG12  VAL  38          HG12      VAL  38  15.797  21.013 -30.933
  284   HG13  VAL  38          HG13      VAL  38  16.738  22.036 -29.846
  285   HG21  VAL  38          HG21      VAL  38  16.158  24.314 -32.618
  286   HG22  VAL  38          HG22      VAL  38  17.332  23.550 -31.546
  287   HG23  VAL  38          HG23      VAL  38  16.469  22.583 -32.765
  288    H    GLY  39           H        GLY  39  13.353  20.557 -30.895
  289    HA2  GLY  39           HA2      GLY  39  11.383  21.476 -28.906
  290    HA3  GLY  39           HA3      GLY  39  10.688  20.674 -30.304
  291    H    ILE  40           H        ILE  40   9.997  19.542 -28.169
  292    HA   ILE  40           HA       ILE  40  11.782  17.185 -27.710
  293    HB   ILE  40           HB       ILE  40  10.126  18.531 -25.564
  294   HG12  ILE  40          HG12      ILE  40  13.093  18.810 -26.207
  295   HG13  ILE  40          HG13      ILE  40  11.876  20.086 -26.224
  296   HG21  ILE  40          HG21      ILE  40  12.303  16.385 -25.430
  297   HG22  ILE  40          HG22      ILE  40  11.402  17.050 -24.052
  298   HG23  ILE  40          HG23      ILE  40  10.561  16.089 -25.254
  299   HD11  ILE  40          HD11      ILE  40  11.552  19.803 -23.777
  300   HD12  ILE  40          HD12      ILE  40  12.949  18.691 -23.764
  301   HD13  ILE  40          HD13      ILE  40  13.164  20.374 -24.264
  302    H    HIS  41           H        HIS  41  10.907  15.457 -28.439
  303    HA   HIS  41           HA       HIS  41   7.992  15.075 -28.763
  304    HB2  HIS  41           HB2      HIS  41   9.432  14.540 -30.637
  305    HB3  HIS  41           HB3      HIS  41  10.420  13.478 -29.643
  306    HD1  HIS  41           HD1      HIS  41   9.964  11.256 -30.954
  307    HD2  HIS  41           HD2      HIS  41   6.491  13.290 -29.740
  308    HE1  HIS  41           HE1      HIS  41   8.010   9.696 -31.436
  309    H    PHE  42           H        PHE  42   7.657  15.156 -26.442
  310    HA   PHE  42           HA       PHE  42   8.415  12.945 -24.719
  311    HB2  PHE  42           HB2      PHE  42   6.065  14.858 -24.708
  312    HB3  PHE  42           HB3      PHE  42   6.372  13.685 -23.445
  313    HD1  PHE  42           HD2      PHE  42   8.227  13.921 -21.870
  314    HD2  PHE  42           HD1      PHE  42   7.454  16.970 -24.837
  315    HE1  PHE  42           HE2      PHE  42   9.624  15.524 -20.597
  316    HE2  PHE  42           HE1      PHE  42   8.814  18.563 -23.528
  317    HZ   PHE  42           HZ       PHE  42   9.904  17.855 -21.416
  318    H    SER  43           H        SER  43   7.796  10.848 -24.949
  319    HA   SER  43           HA       SER  43   5.478  10.201 -26.703
  320    HB2  SER  43           HB2      SER  43   7.691  10.071 -27.806
  321    HB3  SER  43           HB3      SER  43   8.166   8.823 -26.638
  322    HG   SER  43           HG       SER  43   7.318   7.976 -28.619
  323    H    ASP  44           H        ASP  44   5.297   7.618 -26.593
  324    HA   ASP  44           HA       ASP  44   3.759   7.259 -24.235
  325    HB2  ASP  44           HB2      ASP  44   3.298   6.320 -26.490
  326    HB3  ASP  44           HB3      ASP  44   4.649   5.204 -26.291
  327    H    SER  45           H        SER  45   7.077   6.257 -24.829
  328    HA   SER  45           HA       SER  45   7.178   4.900 -22.147
  329    HB2  SER  45           HB2      SER  45   8.515   3.969 -24.712
  330    HB3  SER  45           HB3      SER  45   8.688   3.220 -23.115
  331    HG   SER  45           HG       SER  45   7.124   2.163 -24.413
  332    H    ALA  46           H        ALA  46   8.547   7.357 -24.016
  333    HA   ALA  46           HA       ALA  46  10.579   7.986 -22.091
  334    HB1  ALA  46           HB1      ALA  46  11.503   7.175 -24.901
  335    HB2  ALA  46           HB2      ALA  46  12.529   7.898 -23.643
  336    HB3  ALA  46           HB3      ALA  46  11.856   6.280 -23.408
  337    H    TRP  47           H        TRP  47  11.943   9.945 -23.281
  338    HA   TRP  47           HA       TRP  47  10.243  11.439 -25.187
  339    HB2  TRP  47           HB2      TRP  47  10.552  13.525 -23.946
  340    HB3  TRP  47           HB3      TRP  47   9.679  12.346 -22.971
  341    HD1  TRP  47           HD1      TRP  47  12.924  14.302 -23.095
  342    HE1  TRP  47           HE1      TRP  47  14.118  14.148 -20.833
  343    HE3  TRP  47           HE3      TRP  47   9.995  10.727 -20.878
  344    HZ2  TRP  47           HZ2      TRP  47  13.879  12.616 -18.395
  345    HZ3  TRP  47           HZ3      TRP  47  10.514   9.937 -18.578
  346    HH2  TRP  47           HH2      TRP  47  12.441  10.882 -17.331
  347    H    ARG  48           H        ARG  48  11.460  12.835 -26.564
  348    HA   ARG  48           HA       ARG  48  14.382  12.900 -26.119
  349    HB2  ARG  48           HB2      ARG  48  15.009  12.051 -28.213
  350    HB3  ARG  48           HB3      ARG  48  13.838  10.898 -27.583
  351    HG2  ARG  48           HG2      ARG  48  12.198  11.503 -29.176
  352    HG3  ARG  48           HG3      ARG  48  12.993  13.032 -29.567
  353    HD2  ARG  48           HD2      ARG  48  13.377  11.520 -31.378
  354    HD3  ARG  48           HD3      ARG  48  14.896  11.877 -30.566
  355    HE   ARG  48           HE       ARG  48  13.352   9.313 -30.447
  356   HH11  ARG  48          HH11      ARG  48  16.495  10.873 -29.749
  357   HH12  ARG  48          HH12      ARG  48  17.154   9.303 -29.329
  358   HH21  ARG  48          HH21      ARG  48  14.449   7.438 -29.953
  359   HH22  ARG  48          HH22      ARG  48  16.127   7.536 -29.479
  360    H    ILE  49           H        ILE  49  15.567  14.406 -27.158
  361    HA   ILE  49           HA       ILE  49  14.153  16.880 -27.923
  362    HB   ILE  49           HB       ILE  49  17.125  16.341 -28.167
  363   HG12  ILE  49          HG12      ILE  49  16.596  15.743 -25.856
  364   HG13  ILE  49          HG13      ILE  49  17.556  17.205 -25.967
  365   HG21  ILE  49          HG21      ILE  49  17.205  18.842 -27.748
  366   HG22  ILE  49          HG22      ILE  49  16.392  18.382 -29.251
  367   HG23  ILE  49          HG23      ILE  49  15.437  18.865 -27.840
  368   HD11  ILE  49          HD11      ILE  49  14.566  17.102 -25.406
  369   HD12  ILE  49          HD12      ILE  49  15.853  17.407 -24.229
  370   HD13  ILE  49          HD13      ILE  49  15.547  18.590 -25.502
  371    H    MET  50           H        MET  50  13.890  17.594 -30.010
  372    HA   MET  50           HA       MET  50  15.128  16.081 -32.247
  373    HB2  MET  50           HB2      MET  50  12.185  16.854 -32.081
  374    HB3  MET  50           HB3      MET  50  13.026  16.356 -33.555
  375    HG2  MET  50           HG2      MET  50  13.748  14.339 -31.845
  376    HG3  MET  50           HG3      MET  50  12.134  14.706 -31.255
  377    HE1  MET  50           HE1      MET  50   9.858  14.200 -32.769
  378    HE2  MET  50           HE2      MET  50  10.498  15.517 -33.780
  379    HE3  MET  50           HE3      MET  50   9.970  13.994 -34.525
  380    H    VAL  51           H        VAL  51  15.439  17.168 -34.112
  381    HA   VAL  51           HA       VAL  51  15.651  20.125 -33.945
  382    HB   VAL  51           HB       VAL  51  17.654  18.193 -33.439
  383   HG11  VAL  51          HG11      VAL  51  19.397  18.446 -35.010
  384   HG12  VAL  51          HG12      VAL  51  17.986  17.789 -35.846
  385   HG13  VAL  51          HG13      VAL  51  18.429  19.503 -36.047
  386   HG21  VAL  51          HG21      VAL  51  17.960  21.143 -34.022
  387   HG22  VAL  51          HG22      VAL  51  17.564  20.377 -32.472
  388   HG23  VAL  51          HG23      VAL  51  19.138  20.085 -33.241
  389    HA   PRO  52           HA       PRO  52  14.518  20.371 -38.225
  390    HB2  PRO  52           HB2      PRO  52  17.126  21.808 -38.744
  391    HB3  PRO  52           HB3      PRO  52  15.471  22.265 -39.252
  392    HG2  PRO  52           HG2      PRO  52  16.581  23.499 -37.127
  393    HG3  PRO  52           HG3      PRO  52  14.899  22.896 -36.979
  394    HD2  PRO  52           HD2      PRO  52  17.420  21.571 -36.042
  395    HD3  PRO  52           HD3      PRO  52  15.888  21.864 -35.148
  396    H    GLY  53           H        GLY  53  15.023  19.737 -40.436
  397    HA2  GLY  53           HA2      GLY  53  17.113  17.579 -40.652
  398    HA3  GLY  53           HA3      GLY  53  15.496  17.449 -41.313
  399    H    LYS  54           H        LYS  54  15.879  17.293 -43.436
  400    HA   LYS  54           HA       LYS  54  17.968  18.115 -44.988
  401    HB2  LYS  54           HB2      LYS  54  16.081  16.567 -45.588
  402    HB3  LYS  54           HB3      LYS  54  15.067  17.982 -45.896
  403    HG2  LYS  54           HG2      LYS  54  16.717  18.696 -47.684
  404    HG3  LYS  54           HG3      LYS  54  17.653  17.237 -47.341
  405    HD2  LYS  54           HD2      LYS  54  16.330  16.833 -49.295
  406    HD3  LYS  54           HD3      LYS  54  15.637  15.864 -47.986
  407    HE2  LYS  54           HE2      LYS  54  13.880  17.598 -47.641
  408    HE3  LYS  54           HE3      LYS  54  14.613  18.601 -48.895
  409    HZ1  LYS  54           HZ1      LYS  54  13.441  15.902 -49.348
  410    HZ2  LYS  54           HZ2      LYS  54  12.744  17.311 -49.769
  411    HZ3  LYS  54           HZ3      LYS  54  14.113  16.834 -50.506
  412    H    THR  55           H        THR  55  15.225  20.187 -44.194
  413    HA   THR  55           HA       THR  55  16.783  22.532 -45.040
  414    HB   THR  55           HB       THR  55  15.541  22.117 -47.046
  415    HG1  THR  55           HG1      THR  55  14.732  24.093 -47.202
  416   HG21  THR  55          HG21      THR  55  13.113  22.162 -47.196
  417   HG22  THR  55          HG22      THR  55  13.593  20.815 -46.153
  418   HG23  THR  55          HG23      THR  55  12.952  22.309 -45.438
  419    HA   PRO  56           HA       PRO  56  14.538  24.119 -41.417
  420    HB2  PRO  56           HB2      PRO  56  15.541  26.631 -41.303
  421    HB3  PRO  56           HB3      PRO  56  16.557  25.202 -40.942
  422    HG2  PRO  56           HG2      PRO  56  16.360  26.742 -43.554
  423    HG3  PRO  56           HG3      PRO  56  17.841  26.262 -42.664
  424    HD2  PRO  56           HD2      PRO  56  16.805  24.798 -44.751
  425    HD3  PRO  56           HD3      PRO  56  17.659  24.034 -43.379
  426    H    SER  57           H        SER  57  14.188  25.059 -44.709
  427    HA   SER  57           HA       SER  57  12.557  27.399 -44.455
  428    HB2  SER  57           HB2      SER  57  13.960  26.615 -46.428
  429    HB3  SER  57           HB3      SER  57  12.656  25.471 -46.800
  430    HG   SER  57           HG       SER  57  12.479  27.472 -47.938
  431    H    ALA  58           H        ALA  58  11.721  24.080 -44.015
  432    HA   ALA  58           HA       ALA  58   8.837  24.708 -43.860
  433    HB1  ALA  58           HB1      ALA  58   8.272  22.732 -45.241
  434    HB2  ALA  58           HB2      ALA  58   9.211  23.906 -46.179
  435    HB3  ALA  58           HB3      ALA  58   9.997  22.441 -45.549
  436    H    TRP  59           H        TRP  59   7.622  22.930 -42.814
  437    HA   TRP  59           HA       TRP  59   8.740  22.125 -40.334
  438    HB2  TRP  59           HB2      TRP  59   6.380  22.483 -40.641
  439    HB3  TRP  59           HB3      TRP  59   6.283  21.225 -41.863
  440    HD1  TRP  59           HD1      TRP  59   6.142  18.738 -41.093
  441    HE1  TRP  59           HE1      TRP  59   5.463  17.628 -38.883
  442    HE3  TRP  59           HE3      TRP  59   6.812  22.726 -37.933
  443    HZ2  TRP  59           HZ2      TRP  59   5.109  18.404 -36.141
  444    HZ3  TRP  59           HZ3      TRP  59   6.319  22.493 -35.509
  445    HH2  TRP  59           HH2      TRP  59   5.450  20.349 -34.600
  446    H    ARG  60           H        ARG  60  10.340  20.744 -40.069
  447    HA   ARG  60           HA       ARG  60  10.095  17.952 -40.908
  448    HB2  ARG  60           HB2      ARG  60  11.235  19.114 -42.842
  449    HB3  ARG  60           HB3      ARG  60  12.484  19.680 -41.751
  450    HG2  ARG  60           HG2      ARG  60  13.222  17.772 -43.077
  451    HG3  ARG  60           HG3      ARG  60  13.241  17.362 -41.361
  452    HD2  ARG  60           HD2      ARG  60  11.299  15.957 -41.567
  453    HD3  ARG  60           HD3      ARG  60  10.877  16.660 -43.126
  454    HE   ARG  60           HE       ARG  60  12.414  15.330 -44.216
  455   HH11  ARG  60          HH11      ARG  60  12.925  14.677 -40.740
  456   HH12  ARG  60          HH12      ARG  60  13.888  13.300 -41.136
  457   HH21  ARG  60          HH21      ARG  60  13.667  13.575 -44.518
  458   HH22  ARG  60          HH22      ARG  60  14.311  12.709 -43.161
  459    H    TRP  61           H        TRP  61  11.146  16.589 -39.507
  460    HA   TRP  61           HA       TRP  61  12.814  17.743 -37.323
  461    HB2  TRP  61           HB2      TRP  61  10.385  15.925 -37.067
  462    HB3  TRP  61           HB3      TRP  61  11.515  16.276 -35.763
  463    HD1  TRP  61           HD1      TRP  61   8.324  17.477 -37.059
  464    HE1  TRP  61           HE1      TRP  61   7.729  19.794 -36.134
  465    HE3  TRP  61           HE3      TRP  61  12.877  18.736 -35.128
  466    HZ2  TRP  61           HZ2      TRP  61   9.137  22.013 -34.867
  467    HZ3  TRP  61           HZ3      TRP  61  13.248  20.958 -34.103
  468    HH2  TRP  61           HH2      TRP  61  11.403  22.592 -33.949
  469    H    VAL  62           H        VAL  62  14.189  16.401 -36.284
  470    HA   VAL  62           HA       VAL  62  14.698  13.598 -37.134
  471    HB   VAL  62           HB       VAL  62  16.837  15.784 -36.988
  472   HG11  VAL  62          HG11      VAL  62  16.983  12.911 -37.997
  473   HG12  VAL  62          HG12      VAL  62  18.300  14.103 -38.047
  474   HG13  VAL  62          HG13      VAL  62  17.712  13.529 -36.495
  475   HG21  VAL  62          HG21      VAL  62  15.618  14.570 -39.493
  476   HG22  VAL  62          HG22      VAL  62  15.562  16.278 -38.979
  477   HG23  VAL  62          HG23      VAL  62  17.098  15.555 -39.438
  478    HA   PRO  63           HA       PRO  63  15.519  13.419 -32.594
  479    HB2  PRO  63           HB2      PRO  63  17.490  11.329 -33.566
  480    HB3  PRO  63           HB3      PRO  63  16.416  11.263 -32.142
  481    HG2  PRO  63           HG2      PRO  63  15.735   9.943 -34.395
  482    HG3  PRO  63           HG3      PRO  63  14.487  10.912 -33.545
  483    HD2  PRO  63           HD2      PRO  63  16.098  11.656 -35.995
  484    HD3  PRO  63           HD3      PRO  63  14.352  11.894 -35.673
  485    H    LEU  64           H        LEU  64  17.145  14.436 -31.285
  486    HA   LEU  64           HA       LEU  64  19.225  15.860 -32.616
  487    HB2  LEU  64           HB2      LEU  64  18.053  16.609 -30.584
  488    HB3  LEU  64           HB3      LEU  64  18.873  15.371 -29.634
  489    HG   LEU  64           HG       LEU  64  21.000  16.497 -29.846
  490   HD11  LEU  64          HD11      LEU  64  20.971  17.203 -32.187
  491   HD12  LEU  64          HD12      LEU  64  19.646  18.341 -31.847
  492   HD13  LEU  64          HD13      LEU  64  21.264  18.604 -31.155
  493   HD21  LEU  64          HD21      LEU  64  20.569  18.645 -28.852
  494   HD22  LEU  64          HD22      LEU  64  18.901  18.640 -29.453
  495   HD23  LEU  64          HD23      LEU  64  19.417  17.460 -28.218
  496    H    GLN  65           H        GLN  65  19.398  12.824 -32.773
  497    HA   GLN  65           HA       GLN  65  21.809  11.998 -31.355
  498    HB2  GLN  65           HB2      GLN  65  20.193  10.682 -33.572
  499    HB3  GLN  65           HB3      GLN  65  21.630   9.961 -32.831
  500    HG2  GLN  65           HG2      GLN  65  20.532  10.166 -30.575
  501    HG3  GLN  65           HG3      GLN  65  19.053  10.698 -31.386
  502   HE21  GLN  65          HE22      GLN  65  21.091   7.921 -30.608
  503   HE22  GLN  65          HE21      GLN  65  19.997   6.736 -31.312
  504    H    GLU  66           H        GLU  66  21.376  13.968 -34.052
  505    HA   GLU  66           HA       GLU  66  23.701  13.484 -35.612
  506    HB2  GLU  66           HB2      GLU  66  21.743  15.053 -36.065
  507    HB3  GLU  66           HB3      GLU  66  22.430  16.153 -34.876
  508    HG2  GLU  66           HG2      GLU  66  23.026  16.926 -37.059
  509    HG3  GLU  66           HG3      GLU  66  24.492  16.347 -36.294
  510    H    ASP  67           H        ASP  67  23.347  14.844 -32.390
  511    HA   ASP  67           HA       ASP  67  26.312  14.772 -32.092
  512    HB2  ASP  67           HB2      ASP  67  24.532  17.062 -31.156
  513    HB3  ASP  67           HB3      ASP  67  26.179  16.798 -30.597
  514    H    ALA  68           H        ALA  68  23.135  14.903 -30.400
  515    HA   ALA  68           HA       ALA  68  24.250  13.764 -27.940
  516    HB1  ALA  68           HB1      ALA  68  22.449  15.488 -27.940
  517    HB2  ALA  68           HB2      ALA  68  21.367  14.331 -28.752
  518    HB3  ALA  68           HB3      ALA  68  21.970  13.996 -27.118
  519    H    ALA  69           H        ALA  69  24.975  12.059 -29.874
  520    HA   ALA  69           HA       ALA  69  23.295  10.252 -31.037
  521    HB1  ALA  69           HB1      ALA  69  25.261   8.791 -31.238
  522    HB2  ALA  69           HB2      ALA  69  25.683  10.491 -31.514
  523    HB3  ALA  69           HB3      ALA  69  26.087   9.713 -29.964
  524    H    ASP  70           H        ASP  70  24.474   9.957 -27.719
  525    HA   ASP  70           HA       ASP  70  22.628   7.671 -27.210
  526    HB2  ASP  70           HB2      ASP  70  24.229   6.779 -25.707
  527    HB3  ASP  70           HB3      ASP  70  25.066   7.125 -27.212
  528    H    GLU  71           H        GLU  71  22.451  10.789 -26.826
  529    HA   GLU  71           HA       GLU  71  21.265  10.694 -24.071
  530    HB2  GLU  71           HB2      GLU  71  23.127  12.828 -25.191
  531    HB3  GLU  71           HB3      GLU  71  22.092  13.067 -23.783
  532    HG2  GLU  71           HG2      GLU  71  23.185  11.055 -22.713
  533    HG3  GLU  71           HG3      GLU  71  24.360  11.070 -24.032
  534    H    SER  72           H        SER  72  20.706  11.424 -27.350
  535    HA   SER  72           HA       SER  72  18.959  13.596 -27.294
  536    HB2  SER  72           HB2      SER  72  19.614  12.648 -29.382
  537    HB3  SER  72           HB3      SER  72  18.961  11.066 -28.945
  538    HG   SER  72           HG       SER  72  17.350  13.399 -29.295
  539    H    GLN  73           H        GLN  73  18.285  10.319 -26.192
  540    HA   GLN  73           HA       GLN  73  15.582  11.184 -25.333
  541    HB2  GLN  73           HB2      GLN  73  14.679   9.021 -25.678
  542    HB3  GLN  73           HB3      GLN  73  15.462   9.525 -27.163
  543    HG2  GLN  73           HG2      GLN  73  16.575   7.504 -25.178
  544    HG3  GLN  73           HG3      GLN  73  15.799   7.146 -26.710
  545   HE21  GLN  73          HE22      GLN  73  18.772   8.171 -25.197
  546   HE22  GLN  73          HE21      GLN  73  19.723   8.117 -26.685
  547    H    ASN  74           H        ASN  74  14.873  10.700 -23.365
  548    HA   ASN  74           HA       ASN  74  15.416  11.159 -21.172
  549    HB2  ASN  74           HB2      ASN  74  14.076   9.099 -21.413
  550    HB3  ASN  74           HB3      ASN  74  15.532   8.126 -21.229
  551   HD21  ASN  74          HD22      ASN  74  13.437   7.753 -19.422
  552   HD22  ASN  74          HD21      ASN  74  13.872   8.499 -17.873
  553    H    ASP  75           H        ASP  75  17.389   8.480 -20.339
  554    HA   ASP  75           HA       ASP  75  19.266   8.439 -19.135
  555    HB2  ASP  75           HB2      ASP  75  20.178   8.617 -21.481
  556    HB3  ASP  75           HB3      ASP  75  20.483  10.327 -21.173
  557    H    TRP  76           H        TRP  76  17.304  10.430 -18.371
  558    HA   TRP  76           HA       TRP  76  18.982  12.374 -16.830
  559    HB2  TRP  76           HB2      TRP  76  16.051  12.514 -17.598
  560    HB3  TRP  76           HB3      TRP  76  16.926  13.719 -16.678
  561    HD1  TRP  76           HD1      TRP  76  19.292  13.073 -19.287
  562    HE1  TRP  76           HE1      TRP  76  19.021  14.566 -21.325
  563    HE3  TRP  76           HE3      TRP  76  14.657  15.007 -18.258
  564    HZ2  TRP  76           HZ2      TRP  76  17.024  16.281 -22.451
  565    HZ3  TRP  76           HZ3      TRP  76  13.596  16.582 -19.861
  566    HH2  TRP  76           HH2      TRP  76  14.765  17.220 -21.961
  567    H    ASP  77           H        ASP  77  16.751   9.692 -16.481
  568    HA   ASP  77           HA       ASP  77  16.833   9.986 -13.521
  569    HB2  ASP  77           HB2      ASP  77  14.594  10.071 -13.248
  570    HB3  ASP  77           HB3      ASP  77  14.651  10.875 -14.807
  571    H    GLU  78           H        GLU  78  15.930   8.003 -12.391
  572    HA   GLU  78           HA       GLU  78  15.886   5.524 -13.970
  573    HB2  GLU  78           HB2      GLU  78  17.501   4.331 -12.696
  574    HB3  GLU  78           HB3      GLU  78  18.250   5.826 -13.241
  575    HG2  GLU  78           HG2      GLU  78  17.627   6.793 -10.914
  576    HG3  GLU  78           HG3      GLU  78  17.295   5.123 -10.445
  577    H    GLU  79           H        GLU  79  14.068   7.283 -12.055
  578    HA   GLU  79           HA       GLU  79  12.709   5.026 -10.733
  579    HB2  GLU  79           HB2      GLU  79  13.872   7.355  -9.143
  580    HB3  GLU  79           HB3      GLU  79  12.639   6.283  -8.507
  581    HG2  GLU  79           HG2      GLU  79  15.458   5.501  -9.248
  582    HG3  GLU  79           HG3      GLU  79  14.784   5.683  -7.642
  583    H    LEU  80           H        LEU  80  12.273   7.526 -12.722
  584    HA   LEU  80           HA       LEU  80   9.762   8.523 -11.429
  585    HB2  LEU  80           HB2      LEU  80  11.916   9.925 -13.048
  586    HB3  LEU  80           HB3      LEU  80  10.317  10.592 -12.893
  587    HG   LEU  80           HG       LEU  80  11.946  11.638 -11.417
  588   HD11  LEU  80          HD11      LEU  80   9.780  10.148  -9.869
  589   HD12  LEU  80          HD12      LEU  80  10.557  11.655  -9.387
  590   HD13  LEU  80          HD13      LEU  80   9.517  11.622 -10.824
  591   HD21  LEU  80          HD21      LEU  80  13.290   9.625 -10.806
  592   HD22  LEU  80          HD22      LEU  80  12.825  10.713  -9.477
  593   HD23  LEU  80          HD23      LEU  80  11.980   9.183  -9.673
  594    H    SER  81           H        SER  81   8.118   9.215 -12.764
  595    HA   SER  81           HA       SER  81   8.044   8.318 -15.622
  596    HB2  SER  81           HB2      SER  81   5.834   8.197 -13.524
  597    HB3  SER  81           HB3      SER  81   5.602   7.927 -15.264
  598    HG   SER  81           HG       SER  81   5.884   5.962 -14.141
  599    H    ILE  82           H        ILE  82   7.346   9.893 -17.034
  600    HA   ILE  82           HA       ILE  82   6.850  12.595 -15.881
  601    HB   ILE  82           HB       ILE  82   8.375  11.540 -18.223
  602   HG12  ILE  82          HG12      ILE  82   9.906  13.358 -17.665
  603   HG13  ILE  82          HG13      ILE  82   8.759  14.030 -16.509
  604   HG21  ILE  82          HG21      ILE  82   8.339  13.686 -19.413
  605   HG22  ILE  82          HG22      ILE  82   6.760  12.901 -19.445
  606   HG23  ILE  82          HG23      ILE  82   7.044  14.277 -18.353
  607   HD11  ILE  82          HD11      ILE  82  10.679  12.784 -15.485
  608   HD12  ILE  82          HD12      ILE  82   9.099  12.173 -14.987
  609   HD13  ILE  82          HD13      ILE  82  10.052  11.287 -16.205
  610    H    HIS  83           H        HIS  83   5.315  13.901 -16.622
  611    HA   HIS  83           HA       HIS  83   3.226  12.935 -18.498
  612    HB2  HIS  83           HB2      HIS  83   2.718  14.084 -15.727
  613    HB3  HIS  83           HB3      HIS  83   1.484  13.670 -16.911
  614    HD1  HIS  83           HD1      HIS  83   0.923  11.024 -17.163
  615    HD2  HIS  83           HD2      HIS  83   3.910  12.047 -14.379
  616    HE1  HIS  83           HE1      HIS  83   1.370   8.926 -15.789
  617    H    LEU  84           H        LEU  84   1.874  14.728 -19.252
  618    HA   LEU  84           HA       LEU  84   3.147  17.436 -19.092
  619    HB2  LEU  84           HB2      LEU  84   1.985  16.045 -21.537
  620    HB3  LEU  84           HB3      LEU  84   2.466  17.733 -21.471
  621    HG   LEU  84           HG       LEU  84   4.309  15.320 -21.319
  622   HD11  LEU  84          HD11      LEU  84   3.452  15.866 -23.561
  623   HD12  LEU  84          HD12      LEU  84   3.886  17.580 -23.337
  624   HD13  LEU  84          HD13      LEU  84   5.147  16.366 -23.433
  625   HD21  LEU  84          HD21      LEU  84   5.249  17.095 -19.882
  626   HD22  LEU  84          HD22      LEU  84   6.159  16.976 -21.384
  627   HD23  LEU  84          HD23      LEU  84   4.982  18.287 -21.178
  628    H    GLN  85           H        GLN  85   1.818  19.197 -19.579
  629    HA   GLN  85           HA       GLN  85  -1.135  18.942 -19.545
  630    HB2  GLN  85           HB2      GLN  85   0.503  20.669 -17.652
  631    HB3  GLN  85           HB3      GLN  85  -1.248  20.694 -17.781
  632    HG2  GLN  85           HG2      GLN  85  -1.478  18.587 -16.690
  633    HG3  GLN  85           HG3      GLN  85   0.225  18.179 -16.904
  634   HE21  GLN  85          HE22      GLN  85   1.874  19.567 -15.790
  635   HE22  GLN  85          HE21      GLN  85   1.410  20.096 -14.168
  636    HA   PRO  86           HA       PRO  86  -2.764  19.934 -20.570
  637    HB2  PRO  86           HB2      PRO  86  -3.939  21.018 -22.739
  638    HB3  PRO  86           HB3      PRO  86  -3.704  21.973 -21.245
  639    HG2  PRO  86           HG2      PRO  86  -1.943  21.949 -23.725
  640    HG3  PRO  86           HG3      PRO  86  -2.639  23.370 -22.880
  641    HD2  PRO  86           HD2      PRO  86  -0.094  22.453 -22.396
  642    HD3  PRO  86           HD3      PRO  86  -1.097  23.200 -21.122
  643    H    PHE  87           H        PHE  87  -0.094  19.802 -22.665
  644    HA   PHE  87           HA       PHE  87  -0.979  18.076 -24.784
  645    HB2  PHE  87           HB2      PHE  87   1.762  18.594 -23.563
  646    HB3  PHE  87           HB3      PHE  87   1.495  17.730 -25.065
  647    HD1  PHE  87           HD2      PHE  87   0.321  18.936 -27.007
  648    HD2  PHE  87           HD1      PHE  87   1.998  20.973 -23.593
  649    HE1  PHE  87           HE2      PHE  87   0.451  21.039 -28.321
  650    HE2  PHE  87           HE1      PHE  87   2.115  23.077 -24.909
  651    HZ   PHE  87           HZ       PHE  87   1.366  23.101 -27.282
  652    H    LYS  88           H        LYS  88   0.459  15.922 -25.005
  653    HA   LYS  88           HA       LYS  88   0.291  14.304 -22.538
  654    HB2  LYS  88           HB2      LYS  88  -0.994  12.570 -23.434
  655    HB3  LYS  88           HB3      LYS  88  -1.871  14.057 -23.707
  656    HG2  LYS  88           HG2      LYS  88  -0.389  12.403 -25.782
  657    HG3  LYS  88           HG3      LYS  88  -2.124  12.510 -25.545
  658    HD2  LYS  88           HD2      LYS  88  -1.827  15.044 -26.073
  659    HD3  LYS  88           HD3      LYS  88  -0.261  14.575 -26.761
  660    HE2  LYS  88           HE2      LYS  88  -2.940  13.340 -27.563
  661    HE3  LYS  88           HE3      LYS  88  -2.240  14.750 -28.350
  662    HZ1  LYS  88           HZ1      LYS  88  -1.642  12.861 -29.614
  663    HZ2  LYS  88           HZ2      LYS  88  -0.271  13.343 -28.885
  664    HZ3  LYS  88           HZ3      LYS  88  -1.078  12.001 -28.367
  665    HA   PRO  89           HA       PRO  89   4.117  12.634 -24.232
  666    HB2  PRO  89           HB2      PRO  89   4.637  10.674 -22.415
  667    HB3  PRO  89           HB3      PRO  89   4.764  12.411 -22.013
  668    HG2  PRO  89           HG2      PRO  89   2.452  10.532 -21.446
  669    HG3  PRO  89           HG3      PRO  89   3.247  11.682 -20.335
  670    HD2  PRO  89           HD2      PRO  89   0.933  12.266 -21.699
  671    HD3  PRO  89           HD3      PRO  89   2.149  13.515 -21.294
  672    H    ASP  90           H        ASP  90   3.575  11.769 -26.199
  673    HA   ASP  90           HA       ASP  90   2.577   8.998 -26.436
  674    HB2  ASP  90           HB2      ASP  90   0.558  10.345 -26.053
  675    HB3  ASP  90           HB3      ASP  90   1.053  11.474 -27.322
  676    H    ASP  91           H        ASP  91   2.625   8.242 -28.640
  677    HA   ASP  91           HA       ASP  91   5.067   9.114 -29.945
  678    HB2  ASP  91           HB2      ASP  91   4.511   6.757 -29.455
  679    HB3  ASP  91           HB3      ASP  91   3.146   6.843 -30.566
  680    H    SER  92           H        SER  92   3.640  11.255 -30.344
  681    HA   SER  92           HA       SER  92   1.976  11.365 -32.706
  682    HB2  SER  92           HB2      SER  92   2.107  13.764 -32.431
  683    HB3  SER  92           HB3      SER  92   1.915  13.025 -30.827
  684    HG   SER  92           HG       SER  92   3.597  14.656 -30.985
  685    H    ASN  93           H        ASN  93   5.369  11.110 -32.361
  686    HA   ASN  93           HA       ASN  93   7.142  11.233 -33.700
  687    HB2  ASN  93           HB2      ASN  93   5.434   9.883 -35.175
  688    HB3  ASN  93           HB3      ASN  93   5.462  11.313 -36.205
  689   HD21  ASN  93          HD22      ASN  93   7.914  12.076 -36.602
  690   HD22  ASN  93          HD21      ASN  93   8.973  10.747 -37.085
  691    H    GLN  94           H        GLN  94   5.834  13.693 -32.733
  692    HA   GLN  94           HA       GLN  94   7.598  15.554 -34.185
  693    HB2  GLN  94           HB2      GLN  94   5.922  17.298 -34.331
  694    HB3  GLN  94           HB3      GLN  94   5.369  15.905 -35.240
  695    HG2  GLN  94           HG2      GLN  94   3.676  15.412 -33.662
  696    HG3  GLN  94           HG3      GLN  94   4.454  16.332 -32.373
  697   HE21  GLN  94          HE22      GLN  94   4.262  18.620 -32.261
  698   HE22  GLN  94          HE21      GLN  94   3.045  19.439 -33.238
  699    HA   PRO  95           HA       PRO  95   8.177  16.947 -29.960
  700    HB2  PRO  95           HB2      PRO  95   8.480  19.665 -30.141
  701    HB3  PRO  95           HB3      PRO  95   9.727  18.462 -30.622
  702    HG2  PRO  95           HG2      PRO  95   7.748  19.884 -32.417
  703    HG3  PRO  95           HG3      PRO  95   9.524  19.706 -32.624
  704    HD2  PRO  95           HD2      PRO  95   7.797  18.043 -33.867
  705    HD3  PRO  95           HD3      PRO  95   9.320  17.419 -33.185
  706    H    GLN  96           H        GLN  96   6.873  17.449 -28.263
  707    HA   GLN  96           HA       GLN  96   4.137  18.545 -28.761
  708    HB2  GLN  96           HB2      GLN  96   5.095  17.798 -26.020
  709    HB3  GLN  96           HB3      GLN  96   3.487  17.711 -26.709
  710    HG2  GLN  96           HG2      GLN  96   5.796  15.777 -27.099
  711    HG3  GLN  96           HG3      GLN  96   4.322  15.512 -26.187
  712   HE21  GLN  96          HE22      GLN  96   4.711  13.496 -27.699
  713   HE22  GLN  96          HE21      GLN  96   3.938  13.591 -29.267
  714    H    VAL  97           H        VAL  97   7.242  19.366 -27.431
  715    HA   VAL  97           HA       VAL  97   6.327  22.087 -26.531
  716    HB   VAL  97           HB       VAL  97   8.499  20.246 -25.443
  717   HG11  VAL  97          HG11      VAL  97   7.782  23.042 -24.480
  718   HG12  VAL  97          HG12      VAL  97   8.929  21.926 -23.720
  719   HG13  VAL  97          HG13      VAL  97   9.287  22.589 -25.312
  720   HG21  VAL  97          HG21      VAL  97   5.947  21.305 -24.157
  721   HG22  VAL  97          HG22      VAL  97   6.230  19.630 -24.679
  722   HG23  VAL  97          HG23      VAL  97   7.181  20.305 -23.365
  723    H    VAL  98           H        VAL  98   7.461  23.809 -27.394
  724    HA   VAL  98           HA       VAL  98   9.746  23.191 -29.235
  725    HB   VAL  98           HB       VAL  98   7.287  24.811 -29.968
  726   HG11  VAL  98          HG11      VAL  98   9.243  25.825 -31.034
  727   HG12  VAL  98          HG12      VAL  98   9.790  24.226 -31.600
  728   HG13  VAL  98          HG13      VAL  98   8.296  24.948 -32.226
  729   HG21  VAL  98          HG21      VAL  98   6.856  22.392 -30.105
  730   HG22  VAL  98          HG22      VAL  98   6.999  23.069 -31.724
  731   HG23  VAL  98          HG23      VAL  98   8.359  22.161 -31.028
  732    H    ILE  99           H        ILE  99  11.190  24.724 -29.600
  733    HA   ILE  99           HA       ILE  99  11.402  27.023 -27.704
  734    HB   ILE  99           HB       ILE  99  13.549  25.055 -28.659
  735   HG12  ILE  99          HG12      ILE  99  13.740  24.669 -26.075
  736   HG13  ILE  99          HG13      ILE  99  12.070  25.208 -26.019
  737   HG21  ILE  99          HG21      ILE  99  14.435  27.327 -28.301
  738   HG22  ILE  99          HG22      ILE  99  13.698  27.372 -26.687
  739   HG23  ILE  99          HG23      ILE  99  14.998  26.218 -27.069
  740   HD11  ILE  99          HD11      ILE  99  11.408  23.290 -27.433
  741   HD12  ILE  99          HD12      ILE  99  13.119  22.860 -27.670
  742   HD13  ILE  99          HD13      ILE  99  12.367  22.724 -26.072
  743    H    LEU 100           H        LEU 100  11.624  28.906 -28.771
  744    HA   LEU 100           HA       LEU 100  12.354  28.944 -31.633
  745    HB2  LEU 100           HB2      LEU 100  11.730  31.343 -29.898
  746    HB3  LEU 100           HB3      LEU 100  11.719  31.234 -31.648
  747    HG   LEU 100           HG       LEU 100   9.666  30.238 -29.677
  748   HD11  LEU 100          HD11      LEU 100   9.533  32.539 -30.628
  749   HD12  LEU 100          HD12      LEU 100   9.437  31.846 -32.253
  750   HD13  LEU 100          HD13      LEU 100   8.148  31.530 -31.069
  751   HD21  LEU 100          HD21      LEU 100   8.430  29.181 -31.577
  752   HD22  LEU 100          HD22      LEU 100   9.835  29.448 -32.632
  753   HD23  LEU 100          HD23      LEU 100   9.938  28.327 -31.257
  754    H    ALA 101           H        ALA 101  13.811  30.587 -32.407
  755    HA   ALA 101           HA       ALA 101  16.458  30.104 -31.623
  756    HB1  ALA 101           HB1      ALA 101  15.709  30.676 -33.896
  757    HB2  ALA 101           HB2      ALA 101  15.286  32.320 -33.348
  758    HB3  ALA 101           HB3      ALA 101  16.979  31.795 -33.361
  759    H    ASP 102           H        ASP 102  14.392  32.493 -30.202
  760    HA   ASP 102           HA       ASP 102  16.732  33.933 -29.036
  761    HB2  ASP 102           HB2      ASP 102  15.470  35.906 -29.067
  762    HB3  ASP 102           HB3      ASP 102  15.245  35.184 -30.655
  763    H    GLY 103           H        GLY 103  14.858  31.516 -28.119
  764    HA2  GLY 103           HA2      GLY 103  14.806  30.680 -25.923
  765    HA3  GLY 103           HA3      GLY 103  15.030  32.292 -25.261
  766    H    GLN 104           H        GLN 104  12.435  32.182 -27.540
  767    HA   GLN 104           HA       GLN 104  10.363  32.287 -25.454
  768    HB2  GLN 104           HB2      GLN 104  10.261  32.287 -28.488
  769    HB3  GLN 104           HB3      GLN 104   8.832  32.377 -27.451
  770    HG2  GLN 104           HG2      GLN 104   9.600  34.492 -26.506
  771    HG3  GLN 104           HG3      GLN 104  11.115  34.383 -27.417
  772   HE21  GLN 104          HE22      GLN 104  11.127  34.762 -29.660
  773   HE22  GLN 104          HE21      GLN 104   9.740  35.507 -30.480
  774    H    ILE 105           H        ILE 105   9.027  30.622 -24.966
  775    HA   ILE 105           HA       ILE 105   9.507  27.941 -26.203
  776    HB   ILE 105           HB       ILE 105   9.052  28.230 -23.239
  777   HG12  ILE 105          HG12      ILE 105  11.062  29.574 -23.556
  778   HG13  ILE 105          HG13      ILE 105  11.345  28.117 -22.632
  779   HG21  ILE 105          HG21      ILE 105   8.767  26.012 -24.156
  780   HG22  ILE 105          HG22      ILE 105  10.305  26.126 -25.033
  781   HG23  ILE 105          HG23      ILE 105  10.293  26.021 -23.258
  782   HD11  ILE 105          HD11      ILE 105  12.494  27.076 -24.489
  783   HD12  ILE 105          HD12      ILE 105  12.043  28.426 -25.562
  784   HD13  ILE 105          HD13      ILE 105  13.160  28.699 -24.223
  785    H    THR 106           H        THR 106   7.670  26.610 -26.351
  786    HA   THR 106           HA       THR 106   5.054  27.686 -26.325
  787    HB   THR 106           HB       THR 106   4.405  25.200 -26.173
  788    HG1  THR 106           HG1      THR 106   6.370  24.640 -25.102
  789   HG21  THR 106          HG21      THR 106   6.378  26.091 -28.302
  790   HG22  THR 106          HG22      THR 106   5.300  24.677 -28.415
  791   HG23  THR 106          HG23      THR 106   4.617  26.312 -28.334
  792    HA   PRO 107           HA       PRO 107   4.429  27.598 -21.832
  793    HB2  PRO 107           HB2      PRO 107   1.822  28.419 -21.690
  794    HB3  PRO 107           HB3      PRO 107   3.210  29.507 -21.982
  795    HG2  PRO 107           HG2      PRO 107   1.309  28.331 -24.007
  796    HG3  PRO 107           HG3      PRO 107   1.942  30.008 -23.898
  797    HD2  PRO 107           HD2      PRO 107   2.975  28.109 -25.597
  798    HD3  PRO 107           HD3      PRO 107   3.975  29.405 -24.872
  799    H    PHE 108           H        PHE 108   4.183  25.800 -20.719
  800    HA   PHE 108           HA       PHE 108   1.916  24.014 -20.834
  801    HB2  PHE 108           HB2      PHE 108   2.890  22.119 -21.720
  802    HB3  PHE 108           HB3      PHE 108   3.507  23.340 -22.803
  803    HD1  PHE 108           HD1      PHE 108   5.895  24.392 -21.975
  804    HD2  PHE 108           HD2      PHE 108   4.365  20.512 -20.925
  805    HE1  PHE 108           HE1      PHE 108   8.191  23.629 -21.516
  806    HE2  PHE 108           HE2      PHE 108   6.676  19.733 -20.482
  807    HZ   PHE 108           HZ       PHE 108   8.597  21.290 -20.738
  808    H    SER 109           H        SER 109   2.522  21.992 -19.336
  809    HA   SER 109           HA       SER 109   4.515  22.783 -17.303
  810    HB2  SER 109           HB2      SER 109   1.767  21.911 -16.425
  811    HB3  SER 109           HB3      SER 109   3.114  22.459 -15.419
  812    HG   SER 109           HG       SER 109   2.826  24.427 -16.998
  813    H    LEU 110           H        LEU 110   5.905  21.282 -17.574
  814    HA   LEU 110           HA       LEU 110   5.624  18.438 -17.970
  815    HB2  LEU 110           HB2      LEU 110   7.683  19.444 -18.587
  816    HB3  LEU 110           HB3      LEU 110   7.727  20.467 -17.164
  817    HG   LEU 110           HG       LEU 110   8.391  18.620 -15.753
  818   HD11  LEU 110          HD11      LEU 110   9.086  16.443 -16.777
  819   HD12  LEU 110          HD12      LEU 110   7.352  16.674 -16.987
  820   HD13  LEU 110          HD13      LEU 110   8.446  16.970 -18.346
  821   HD21  LEU 110          HD21      LEU 110  10.062  18.868 -18.286
  822   HD22  LEU 110          HD22      LEU 110  10.088  19.967 -16.894
  823   HD23  LEU 110          HD23      LEU 110  10.642  18.297 -16.710
  824    H    LEU 111           H        LEU 111   5.042  16.942 -16.448
  825    HA   LEU 111           HA       LEU 111   5.369  17.579 -13.551
  826    HB2  LEU 111           HB2      LEU 111   3.058  17.827 -14.282
  827    HB3  LEU 111           HB3      LEU 111   3.029  16.210 -14.952
  828    HG   LEU 111           HG       LEU 111   3.775  16.520 -12.060
  829   HD11  LEU 111          HD11      LEU 111   1.402  16.567 -11.364
  830   HD12  LEU 111          HD12      LEU 111   1.868  18.032 -12.239
  831   HD13  LEU 111          HD13      LEU 111   0.912  16.778 -13.064
  832   HD21  LEU 111          HD21      LEU 111   3.622  14.238 -13.159
  833   HD22  LEU 111          HD22      LEU 111   2.529  14.437 -11.790
  834   HD23  LEU 111          HD23      LEU 111   1.901  14.544 -13.444
  835    H    MET 112           H        MET 112   5.890  15.839 -12.187
  836    HA   MET 112           HA       MET 112   6.939  13.362 -13.505
  837    HB2  MET 112           HB2      MET 112   8.330  14.986 -11.336
  838    HB3  MET 112           HB3      MET 112   8.927  13.519 -12.116
  839    HG2  MET 112           HG2      MET 112   9.031  14.749 -14.285
  840    HG3  MET 112           HG3      MET 112   8.525  16.221 -13.444
  841    HE1  MET 112           HE1      MET 112  12.212  17.127 -14.129
  842    HE2  MET 112           HE2      MET 112  11.071  16.289 -15.203
  843    HE3  MET 112           HE3      MET 112  10.516  17.650 -14.198
  844    H    ALA 113           H        ALA 113   6.752  11.508 -12.318
  845    HA   ALA 113           HA       ALA 113   5.602  11.597  -9.568
  846    HB1  ALA 113           HB1      ALA 113   4.002   9.831 -10.326
  847    HB2  ALA 113           HB2      ALA 113   3.771  11.348 -11.218
  848    HB3  ALA 113           HB3      ALA 113   4.626   9.989 -11.979
  849    H    ASN 114           H        ASN 114   6.020   9.780  -8.283
  850    HA   ASN 114           HA       ASN 114   8.584   8.444  -8.704
  851    HB2  ASN 114           HB2      ASN 114   7.843   9.037  -6.462
  852    HB3  ASN 114           HB3      ASN 114   6.325   8.165  -6.679
  853   HD21  ASN 114          HD22      ASN 114   6.800   7.028  -4.740
  854   HD22  ASN 114          HD21      ASN 114   7.982   5.717  -4.735
  855    H    ALA 115           H        ALA 115   8.925   6.651  -9.941
  856    HA   ALA 115           HA       ALA 115   6.796   5.190 -11.177
  857    HB1  ALA 115           HB1      ALA 115   9.046   5.462 -12.144
  858    HB2  ALA 115           HB2      ALA 115   9.734   4.463 -10.836
  859    HB3  ALA 115           HB3      ALA 115   8.599   3.753 -12.004
  860    H    GLY 116           H        GLY 116   8.237   4.844  -8.008
  861    HA2  GLY 116           HA2      GLY 116   7.540   2.077  -7.503
  862    HA3  GLY 116           HA3      GLY 116   7.926   3.320  -6.311
  863    H    THR 117           H        THR 117   6.034   5.081  -6.056
  864    HA   THR 117           HA       THR 117   3.638   3.587  -5.318
  865    HB   THR 117           HB       THR 117   2.927   5.812  -4.435
  866    HG1  THR 117           HG1      THR 117   4.410   7.471  -4.482
  867   HG21  THR 117          HG21      THR 117   5.732   5.040  -3.564
  868   HG22  THR 117          HG22      THR 117   4.547   5.972  -2.634
  869   HG23  THR 117          HG23      THR 117   4.235   4.267  -3.000
  870    H    GLY 118           H        GLY 118   4.506   5.766  -7.945
  871    HA2  GLY 118           HA2      GLY 118   3.284   6.296  -9.858
  872    HA3  GLY 118           HA3      GLY 118   1.809   5.633  -9.146
  873    H    GLU 119           H        GLU 119   3.234   7.621  -6.811
  874    HA   GLU 119           HA       GLU 119   1.165   9.658  -7.178
  875    HB2  GLU 119           HB2      GLU 119   3.334   9.257  -5.080
  876    HB3  GLU 119           HB3      GLU 119   2.152  10.572  -5.047
  877    HG2  GLU 119           HG2      GLU 119   0.303   8.886  -5.053
  878    HG3  GLU 119           HG3      GLU 119   1.500   7.597  -4.946
  879    HA   PRO 120           HA       PRO 120   3.769  12.688  -9.184
  880    HB2  PRO 120           HB2      PRO 120   2.538  15.036  -8.556
  881    HB3  PRO 120           HB3      PRO 120   1.852  13.835  -9.689
  882    HG2  PRO 120           HG2      PRO 120   1.193  14.182  -6.753
  883    HG3  PRO 120           HG3      PRO 120   0.063  14.026  -8.138
  884    HD2  PRO 120           HD2      PRO 120   0.742  11.897  -6.569
  885    HD3  PRO 120           HD3      PRO 120   0.474  11.709  -8.328
  886    H    LEU 121           H        LEU 121   5.413  14.081  -8.771
  887    HA   LEU 121           HA       LEU 121   6.328  14.399  -5.944
  888    HB2  LEU 121           HB2      LEU 121   7.355  12.957  -8.301
  889    HB3  LEU 121           HB3      LEU 121   8.498  14.179  -7.825
  890    HG   LEU 121           HG       LEU 121   9.010  12.051  -6.864
  891   HD11  LEU 121          HD11      LEU 121   9.404  12.764  -4.592
  892   HD12  LEU 121          HD12      LEU 121   9.472  14.222  -5.626
  893   HD13  LEU 121          HD13      LEU 121   8.047  13.901  -4.627
  894   HD21  LEU 121          HD21      LEU 121   7.656  10.985  -5.131
  895   HD22  LEU 121          HD22      LEU 121   6.416  12.238  -5.262
  896   HD23  LEU 121          HD23      LEU 121   6.697  11.143  -6.622
  897    H    LEU 122           H        LEU 122   6.633  15.728  -9.228
  898    HA   LEU 122           HA       LEU 122   7.285  18.449  -8.206
  899    HB2  LEU 122           HB2      LEU 122   9.387  16.863  -8.418
  900    HB3  LEU 122           HB3      LEU 122   9.091  16.966 -10.148
  901    HG   LEU 122           HG       LEU 122   9.223  19.573  -9.766
  902   HD11  LEU 122          HD11      LEU 122  10.657  20.222  -7.877
  903   HD12  LEU 122          HD12      LEU 122   9.201  19.436  -7.259
  904   HD13  LEU 122          HD13      LEU 122  10.727  18.541  -7.312
  905   HD21  LEU 122          HD21      LEU 122  10.880  18.134 -10.971
  906   HD22  LEU 122          HD22      LEU 122  11.576  19.517 -10.142
  907   HD23  LEU 122          HD23      LEU 122  11.726  17.894  -9.427
  908    H    THR 123           H        THR 123   7.122  20.050  -9.819
  909    HA   THR 123           HA       THR 123   6.282  19.278 -12.540
  910    HB   THR 123           HB       THR 123   4.620  21.174 -10.835
  911    HG1  THR 123           HG1      THR 123   4.557  18.458 -11.212
  912   HG21  THR 123          HG21      THR 123   2.996  21.154 -12.578
  913   HG22  THR 123          HG22      THR 123   4.528  21.575 -13.342
  914   HG23  THR 123          HG23      THR 123   3.881  19.921 -13.493
  915    H    LEU 124           H        LEU 124   6.910  20.713 -14.032
  916    HA   LEU 124           HA       LEU 124   8.197  23.262 -13.198
  917    HB2  LEU 124           HB2      LEU 124   9.174  21.079 -14.998
  918    HB3  LEU 124           HB3      LEU 124   9.344  22.721 -15.600
  919    HG   LEU 124           HG       LEU 124  10.523  23.378 -13.504
  920   HD11  LEU 124          HD11      LEU 124  11.509  21.619 -12.092
  921   HD12  LEU 124          HD12      LEU 124   9.757  21.587 -11.969
  922   HD13  LEU 124          HD13      LEU 124  10.579  20.372 -12.962
  923   HD21  LEU 124          HD21      LEU 124  11.794  21.044 -14.979
  924   HD22  LEU 124          HD22      LEU 124  11.718  22.714 -15.597
  925   HD23  LEU 124          HD23      LEU 124  12.642  22.360 -14.135
  926    H    VAL 125           H        VAL 125   7.380  24.970 -14.074
  927    HA   VAL 125           HA       VAL 125   5.130  24.733 -16.045
  928    HB   VAL 125           HB       VAL 125   5.556  26.711 -13.769
  929   HG11  VAL 125          HG11      VAL 125   3.143  26.293 -15.588
  930   HG12  VAL 125          HG12      VAL 125   3.182  27.326 -14.148
  931   HG13  VAL 125          HG13      VAL 125   4.188  27.733 -15.533
  932   HG21  VAL 125          HG21      VAL 125   5.039  24.475 -12.873
  933   HG22  VAL 125          HG22      VAL 125   3.660  25.549 -12.672
  934   HG23  VAL 125          HG23      VAL 125   3.647  24.340 -13.974
  935    H    CYS 126           H        CYS 126   4.969  26.070 -17.771
  936    HA   CYS 126           HA       CYS 126   7.077  28.146 -18.245
  937    HB2  CYS 126           HB2      CYS 126   7.294  26.040 -19.633
  938    HB3  CYS 126           HB3      CYS 126   5.672  26.302 -20.221
  939    HG   CYS 126           HG       CYS 126   7.077  27.044 -22.160
  940    H    SER 127           H        SER 127   6.424  30.076 -19.084
  941    HA   SER 127           HA       SER 127   3.511  30.560 -19.604
  942    HB2  SER 127           HB2      SER 127   5.455  32.380 -18.141
  943    HB3  SER 127           HB3      SER 127   3.742  32.708 -18.464
  944    HG   SER 127           HG       SER 127   4.096  31.883 -16.355
  945    H    GLY 128           H        GLY 128   6.187  30.330 -21.348
  946    HA2  GLY 128           HA2      GLY 128   5.689  31.161 -23.675
  947    HA3  GLY 128           HA3      GLY 128   5.695  32.786 -23.007
  948    H    SER 129           H        SER 129   8.161  31.554 -21.285
  949    HA   SER 129           HA       SER 129  10.277  31.671 -23.308
  950    HB2  SER 129           HB2      SER 129  11.314  33.718 -22.462
  951    HB3  SER 129           HB3      SER 129   9.716  34.037 -23.140
  952    HG   SER 129           HG       SER 129   8.875  34.144 -21.053
  953    H    TRP 130           H        TRP 130  12.381  31.463 -22.537
  954    HA   TRP 130           HA       TRP 130  12.873  29.507 -20.648
  955    HB2  TRP 130           HB2      TRP 130  14.329  29.907 -22.449
  956    HB3  TRP 130           HB3      TRP 130  14.491  31.612 -22.088
  957    HD1  TRP 130           HD1      TRP 130  16.449  32.411 -20.711
  958    HE1  TRP 130           HE1      TRP 130  18.408  31.323 -19.462
  959    HE3  TRP 130           HE3      TRP 130  14.974  27.519 -21.014
  960    HZ2  TRP 130           HZ2      TRP 130  19.261  28.650 -18.730
  961    HZ3  TRP 130           HZ3      TRP 130  16.355  25.741 -19.955
  962    HH2  TRP 130           HH2      TRP 130  18.487  26.300 -18.840
  963    HA   PRO 131           HA       PRO 131  13.563  28.442 -19.094
  964    HB2  PRO 131           HB2      PRO 131  14.409  27.633 -16.694
  965    HB3  PRO 131           HB3      PRO 131  15.536  28.445 -17.811
  966    HG2  PRO 131           HG2      PRO 131  14.068  29.642 -15.465
  967    HG3  PRO 131           HG3      PRO 131  15.795  29.800 -15.925
  968    HD2  PRO 131           HD2      PRO 131  13.788  31.653 -16.595
  969    HD3  PRO 131           HD3      PRO 131  15.309  31.440 -17.507
  970    H    LEU 132           H        LEU 132  12.443  26.677 -17.581
  971    HA   LEU 132           HA       LEU 132   9.769  27.577 -16.813
  972    HB2  LEU 132           HB2      LEU 132  11.174  24.867 -16.854
  973    HB3  LEU 132           HB3      LEU 132   9.633  25.115 -16.046
  974    HG   LEU 132           HG       LEU 132   8.853  26.194 -18.279
  975   HD11  LEU 132          HD11      LEU 132  10.967  26.159 -19.516
  976   HD12  LEU 132          HD12      LEU 132  11.079  24.396 -19.294
  977   HD13  LEU 132          HD13      LEU 132   9.789  25.104 -20.291
  978   HD21  LEU 132          HD21      LEU 132   8.041  24.010 -19.071
  979   HD22  LEU 132          HD22      LEU 132   9.215  23.181 -18.035
  980   HD23  LEU 132          HD23      LEU 132   7.899  24.144 -17.336
  981    H    ASP 133           H        ASP 133   8.861  26.947 -14.781
  982    HA   ASP 133           HA       ASP 133  10.640  27.599 -12.447
  983    HB2  ASP 133           HB2      ASP 133   9.082  29.394 -13.107
  984    HB3  ASP 133           HB3      ASP 133   7.720  28.280 -12.947
  985    H    GLN 134           H        GLN 134  10.666  26.254 -10.725
  986    HA   GLN 134           HA       GLN 134   9.363  23.657 -10.984
  987    HB2  GLN 134           HB2      GLN 134  11.801  23.932 -10.778
  988    HB3  GLN 134           HB3      GLN 134  11.600  24.801  -9.257
  989    HG2  GLN 134           HG2      GLN 134  10.740  22.744  -8.179
  990    HG3  GLN 134           HG3      GLN 134  10.872  21.881  -9.713
  991   HE21  GLN 134          HE22      GLN 134  12.816  20.697  -9.924
  992   HE22  GLN 134          HE21      GLN 134  14.302  21.140  -9.103
  993    H    THR 135           H        THR 135   8.051  22.726  -9.533
  994    HA   THR 135           HA       THR 135   7.696  23.752  -6.792
  995    HB   THR 135           HB       THR 135   5.961  24.913  -8.142
  996    HG1  THR 135           HG1      THR 135   5.456  24.485  -6.038
  997   HG21  THR 135          HG21      THR 135   4.831  22.139  -8.664
  998   HG22  THR 135          HG22      THR 135   4.016  23.683  -8.981
  999   HG23  THR 135          HG23      THR 135   5.476  23.271  -9.885
 1000    H    LEU 136           H        LEU 136   6.516  22.146  -5.424
 1001    HA   LEU 136           HA       LEU 136   7.029  19.334  -6.235
 1002    HB2  LEU 136           HB2      LEU 136   6.198  20.694  -3.655
 1003    HB3  LEU 136           HB3      LEU 136   5.903  18.978  -3.915
 1004    HG   LEU 136           HG       LEU 136   8.306  18.567  -4.306
 1005   HD11  LEU 136          HD11      LEU 136   9.966  20.282  -3.584
 1006   HD12  LEU 136          HD12      LEU 136   9.128  20.739  -5.064
 1007   HD13  LEU 136          HD13      LEU 136   8.664  21.490  -3.518
 1008   HD21  LEU 136          HD21      LEU 136   7.302  18.298  -2.070
 1009   HD22  LEU 136          HD22      LEU 136   8.987  18.828  -1.957
 1010   HD23  LEU 136          HD23      LEU 136   7.672  19.995  -1.691
 1011    H    ALA 137           H        ALA 137   5.464  17.979  -6.868
 1012    HA   ALA 137           HA       ALA 137   3.560  17.565  -8.174
 1013    HB1  ALA 137           HB1      ALA 137   2.661  17.635  -5.268
 1014    HB2  ALA 137           HB2      ALA 137   1.921  16.674  -6.566
 1015    HB3  ALA 137           HB3      ALA 137   3.584  16.334  -6.050
 1016    H    ARG 138           H        ARG 138   3.546  19.797  -9.131
 1017    HA   ARG 138           HA       ARG 138   2.727  21.835  -9.662
 1018    HB2  ARG 138           HB2      ARG 138   0.692  21.677 -10.841
 1019    HB3  ARG 138           HB3      ARG 138   1.610  20.198 -11.031
 1020    HG2  ARG 138           HG2      ARG 138   0.125  19.021  -9.460
 1021    HG3  ARG 138           HG3      ARG 138  -0.816  20.516  -9.225
 1022    HD2  ARG 138           HD2      ARG 138  -1.302  20.564 -11.662
 1023    HD3  ARG 138           HD3      ARG 138  -0.357  19.080 -11.878
 1024    HE   ARG 138           HE       ARG 138  -2.362  18.598  -9.911
 1025   HH11  ARG 138          HH11      ARG 138  -2.199  19.112 -13.394
 1026   HH12  ARG 138          HH12      ARG 138  -3.686  18.236 -13.653
 1027   HH21  ARG 138          HH21      ARG 138  -4.227  17.491 -10.356
 1028   HH22  ARG 138          HH22      ARG 138  -4.783  17.344 -11.993
 1029    H    ASP 139           H        ASP 139   2.680  21.733  -6.718
 1030    HA   ASP 139           HA       ASP 139   0.305  22.711  -5.656
 1031    HB2  ASP 139           HB2      ASP 139   2.226  21.874  -4.371
 1032    HB3  ASP 139           HB3      ASP 139   3.148  23.321  -4.784
 1033    H    THR 140           H        THR 140   2.723  24.676  -7.371
 1034    HA   THR 140           HA       THR 140   1.465  27.230  -6.680
 1035    HB   THR 140           HB       THR 140   2.951  28.132  -8.488
 1036    HG1  THR 140           HG1      THR 140   4.378  26.747  -9.448
 1037   HG21  THR 140          HG21      THR 140   4.331  26.374  -6.427
 1038   HG22  THR 140          HG22      THR 140   5.095  27.676  -7.365
 1039   HG23  THR 140          HG23      THR 140   3.805  28.053  -6.208
 1040    H    ARG 141           H        ARG 141   0.612  24.798  -8.972
 1041    HA   ARG 141           HA       ARG 141  -0.030  26.518 -11.178
 1042    HB2  ARG 141           HB2      ARG 141   0.638  24.032 -11.132
 1043    HB3  ARG 141           HB3      ARG 141  -1.076  23.691 -10.847
 1044    HG2  ARG 141           HG2      ARG 141  -1.638  24.878 -12.971
 1045    HG3  ARG 141           HG3      ARG 141   0.076  25.292 -13.175
 1046    HD2  ARG 141           HD2      ARG 141   0.543  22.764 -13.114
 1047    HD3  ARG 141           HD3      ARG 141  -1.197  22.528 -13.300
 1048    HE   ARG 141           HE       ARG 141   0.717  23.749 -15.251
 1049   HH11  ARG 141          HH11      ARG 141  -2.604  22.709 -14.783
 1050   HH12  ARG 141          HH12      ARG 141  -2.959  22.878 -16.477
 1051   HH21  ARG 141          HH21      ARG 141   0.252  23.872 -17.282
 1052   HH22  ARG 141          HH22      ARG 141  -1.367  23.569 -17.888
 1053    HA   PRO 142           HA       PRO 142  -4.734  25.817  -9.808
 1054    HB2  PRO 142           HB2      PRO 142  -4.158  26.404  -6.896
 1055    HB3  PRO 142           HB3      PRO 142  -5.541  25.519  -7.616
 1056    HG2  PRO 142           HG2      PRO 142  -3.466  24.141  -6.569
 1057    HG3  PRO 142           HG3      PRO 142  -4.146  23.644  -8.155
 1058    HD2  PRO 142           HD2      PRO 142  -1.670  25.276  -7.594
 1059    HD3  PRO 142           HD3      PRO 142  -1.908  23.946  -8.767
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1   0.539  -1.493   0.063
    2    H2   MET   1           H2       MET   1  -0.394  -0.796  -1.088
    3    H3   MET   1           H3       MET   1   0.323  -2.236  -1.375
    4    HA   MET   1           HA       MET   1   1.499  -0.514  -2.544
    5    HB2  MET   1           HB2      MET   1   0.869   1.336  -1.037
    6    HB3  MET   1           HB3      MET   1   1.915   0.695   0.228
    7    HG2  MET   1           HG2      MET   1   2.884   2.614  -1.040
    8    HG3  MET   1           HG3      MET   1   3.889   1.177  -1.027
    9    HE1  MET   1           HE1      MET   1   1.701   3.628  -3.166
   10    HE2  MET   1           HE2      MET   1   1.592   2.793  -4.730
   11    HE3  MET   1           HE3      MET   1   0.730   2.145  -3.323
   12    H    ALA   2           H        ALA   2   3.653  -0.847  -3.040
   13    HA   ALA   2           HA       ALA   2   5.175  -2.778  -1.336
   14    HB1  ALA   2           HB1      ALA   2   5.628  -4.057  -3.376
   15    HB2  ALA   2           HB2      ALA   2   3.882  -3.897  -3.136
   16    HB3  ALA   2           HB3      ALA   2   4.707  -2.887  -4.347
   17    H    TYR   3           H        TYR   3   5.496   0.242  -1.908
   18    HA   TYR   3           HA       TYR   3   8.375   0.207  -2.661
   19    HB2  TYR   3           HB2      TYR   3   6.236   2.049  -3.801
   20    HB3  TYR   3           HB3      TYR   3   7.964   2.275  -4.011
   21    HD1  TYR   3           HD1      TYR   3   9.323   0.637  -5.333
   22    HD2  TYR   3           HD2      TYR   3   5.019   0.423  -5.137
   23    HE1  TYR   3           HE1      TYR   3   9.302  -0.866  -7.324
   24    HE2  TYR   3           HE2      TYR   3   4.999  -1.083  -7.114
   25    HH   TYR   3           HH       TYR   3   6.258  -2.172  -8.690
   26    H    GLY   4           H        GLY   4   9.583   1.981  -1.897
   27    HA2  GLY   4           HA2      GLY   4   8.546   3.895   0.056
   28    HA3  GLY   4           HA3      GLY   4   9.348   2.498   0.786
   29    H    ARG   5           H        ARG   5  10.077   4.345  -2.171
   30    HA   ARG   5           HA       ARG   5  12.810   5.051  -1.167
   31    HB2  ARG   5           HB2      ARG   5  12.605   2.922  -2.602
   32    HB3  ARG   5           HB3      ARG   5  12.223   3.990  -3.955
   33    HG2  ARG   5           HG2      ARG   5  14.436   5.046  -3.758
   34    HG3  ARG   5           HG3      ARG   5  14.762   4.168  -2.259
   35    HD2  ARG   5           HD2      ARG   5  15.953   3.164  -4.137
   36    HD3  ARG   5           HD3      ARG   5  14.769   2.037  -3.483
   37    HE   ARG   5           HE       ARG   5  14.564   3.587  -6.058
   38   HH11  ARG   5          HH11      ARG   5  13.546   0.736  -4.261
   39   HH12  ARG   5          HH12      ARG   5  12.530   0.197  -5.563
   40   HH21  ARG   5          HH22      ARG   5  13.104   2.981  -7.509
   41   HH22  ARG   5          HH21      ARG   5  12.323   1.410  -7.401
   42    H    GLU   6           H        GLU   6  10.302   6.589  -1.440
   43    HA   GLU   6           HA       GLU   6  10.360   8.307  -3.692
   44    HB2  GLU   6           HB2      GLU   6   8.727   9.608  -2.576
   45    HB3  GLU   6           HB3      GLU   6   8.387   7.919  -2.262
   46    HG2  GLU   6           HG2      GLU   6   9.682   9.899  -0.333
   47    HG3  GLU   6           HG3      GLU   6   8.008   9.372  -0.303
   48    H    ASP   7           H        ASP   7  12.440   8.412  -0.910
   49    HA   ASP   7           HA       ASP   7  13.185  11.205  -1.096
   50    HB2  ASP   7           HB2      ASP   7  15.027  10.572   0.325
   51    HB3  ASP   7           HB3      ASP   7  13.538   9.861   0.933
   52    H    VAL   8           H        VAL   8  14.408   8.185  -2.547
   53    HA   VAL   8           HA       VAL   8  16.495   9.529  -4.102
   54    HB   VAL   8           HB       VAL   8  15.191   6.882  -4.821
   55   HG11  VAL   8          HG11      VAL   8  16.580   7.953  -6.625
   56   HG12  VAL   8          HG12      VAL   8  17.929   8.066  -5.483
   57   HG13  VAL   8          HG13      VAL   8  17.320   6.480  -5.999
   58   HG21  VAL   8          HG21      VAL   8  17.125   5.813  -3.672
   59   HG22  VAL   8          HG22      VAL   8  17.627   7.403  -3.055
   60   HG23  VAL   8          HG23      VAL   8  16.090   6.681  -2.533
   61    H    ALA   9           H        ALA   9  13.115   8.407  -4.819
   62    HA   ALA   9           HA       ALA   9  13.139   9.304  -7.500
   63    HB1  ALA   9           HB1      ALA   9  10.726   9.231  -5.658
   64    HB2  ALA   9           HB2      ALA   9  10.736   9.145  -7.431
   65    HB3  ALA   9           HB3      ALA   9  11.420   7.810  -6.486
   66    H    ASN  10           H        ASN  10  12.204  11.234  -4.576
   67    HA   ASN  10           HA       ASN  10  11.624  13.644  -6.013
   68    HB2  ASN  10           HB2      ASN  10  10.967  13.302  -3.668
   69    HB3  ASN  10           HB3      ASN  10  12.656  13.173  -3.177
   70   HD21  ASN  10          HD22      ASN  10  10.143  15.459  -4.284
   71   HD22  ASN  10          HD21      ASN  10  11.058  16.872  -3.812
   72    H    THR  11           H        THR  11  14.729  12.548  -4.534
   73    HA   THR  11           HA       THR  11  16.298  14.779  -5.360
   74    HB   THR  11           HB       THR  11  17.216  11.881  -5.109
   75    HG1  THR  11           HG1      THR  11  16.303  12.410  -3.208
   76   HG21  THR  11          HG21      THR  11  19.373  12.921  -4.448
   77   HG22  THR  11          HG22      THR  11  18.941  13.328  -6.114
   78   HG23  THR  11          HG23      THR  11  18.710  14.528  -4.822
   79    H    ARG  12           H        ARG  12  15.690  11.692  -7.035
   80    HA   ARG  12           HA       ARG  12  17.187  12.285  -9.382
   81    HB2  ARG  12           HB2      ARG  12  16.444  10.029  -8.345
   82    HB3  ARG  12           HB3      ARG  12  14.883  10.309  -9.102
   83    HG2  ARG  12           HG2      ARG  12  16.194   8.793 -10.406
   84    HG3  ARG  12           HG3      ARG  12  16.015  10.306 -11.317
   85    HD2  ARG  12           HD2      ARG  12  18.238   9.739 -11.680
   86    HD3  ARG  12           HD3      ARG  12  18.388  10.902 -10.378
   87    HE   ARG  12           HE       ARG  12  18.872   7.970 -10.291
   88   HH11  ARG  12          HH21      ARG  12  19.170  10.931  -8.373
   89   HH12  ARG  12          HH22      ARG  12  19.727  10.004  -7.014
   90   HH21  ARG  12          HH11      ARG  12  19.835   7.058  -8.756
   91   HH22  ARG  12          HH12      ARG  12  20.208   7.864  -7.234
   92    H    ALA  13           H        ALA  13  13.712  12.861  -8.664
   93    HA   ALA  13           HA       ALA  13  12.975  13.904 -11.206
   94    HB1  ALA  13           HB1      ALA  13  12.027  14.741  -8.441
   95    HB2  ALA  13           HB2      ALA  13  11.197  15.021  -9.981
   96    HB3  ALA  13           HB3      ALA  13  11.388  13.370  -9.371
   97    H    ARG  14           H        ARG  14  14.428  15.525  -8.360
   98    HA   ARG  14           HA       ARG  14  14.479  18.171  -9.525
   99    HB2  ARG  14           HB2      ARG  14  16.023  16.896  -7.223
  100    HB3  ARG  14           HB3      ARG  14  16.080  18.620  -7.602
  101    HG2  ARG  14           HG2      ARG  14  13.828  18.980  -6.995
  102    HG3  ARG  14           HG3      ARG  14  13.385  17.286  -7.205
  103    HD2  ARG  14           HD2      ARG  14  13.352  17.821  -4.875
  104    HD3  ARG  14           HD3      ARG  14  14.617  16.634  -5.221
  105    HE   ARG  14           HE       ARG  14  15.733  19.283  -5.209
  106   HH11  ARG  14          HH11      ARG  14  14.483  16.870  -2.976
  107   HH12  ARG  14          HH12      ARG  14  15.530  17.410  -1.686
  108   HH21  ARG  14          HH21      ARG  14  17.023  19.912  -3.495
  109   HH22  ARG  14          HH22      ARG  14  16.906  19.088  -1.973
  110    H    GLU  15           H        GLU  15  16.883  15.575  -9.447
  111    HA   GLU  15           HA       GLU  15  18.922  16.946 -10.986
  112    HB2  GLU  15           HB2      GLU  15  18.197  14.014 -10.620
  113    HB3  GLU  15           HB3      GLU  15  19.603  14.547 -11.552
  114    HG2  GLU  15           HG2      GLU  15  20.566  15.635  -9.592
  115    HG3  GLU  15           HG3      GLU  15  19.164  15.216  -8.611
  116    H    THR  16           H        THR  16  16.258  14.761 -12.021
  117    HA   THR  16           HA       THR  16  16.740  14.902 -14.818
  118    HB   THR  16           HB       THR  16  14.099  14.482 -13.363
  119    HG1  THR  16           HG1      THR  16  15.584  12.977 -12.760
  120   HG21  THR  16          HG21      THR  16  13.469  13.153 -15.343
  121   HG22  THR  16          HG22      THR  16  13.693  14.857 -15.775
  122   HG23  THR  16          HG23      THR  16  14.958  13.665 -16.169
  123    H    ALA  17           H        ALA  17  14.885  17.075 -12.717
  124    HA   ALA  17           HA       ALA  17  13.929  18.813 -14.780
  125    HB1  ALA  17           HB1      ALA  17  14.452  19.318 -11.818
  126    HB2  ALA  17           HB2      ALA  17  13.432  20.305 -12.876
  127    HB3  ALA  17           HB3      ALA  17  12.978  18.622 -12.512
  128    H    ALA  18           H        ALA  18  16.884  19.035 -12.698
  129    HA   ALA  18           HA       ALA  18  17.879  21.449 -13.866
  130    HB1  ALA  18           HB1      ALA  18  20.037  20.719 -12.930
  131    HB2  ALA  18           HB2      ALA  18  18.724  20.469 -11.763
  132    HB3  ALA  18           HB3      ALA  18  19.393  19.087 -12.658
  133    H    ARG  19           H        ARG  19  18.389  18.021 -14.777
  134    HA   ARG  19           HA       ARG  19  20.001  18.464 -17.111
  135    HB2  ARG  19           HB2      ARG  19  19.923  16.279 -16.174
  136    HB3  ARG  19           HB3      ARG  19  18.166  16.228 -16.207
  137    HG2  ARG  19           HG2      ARG  19  19.080  14.764 -17.907
  138    HG3  ARG  19           HG3      ARG  19  18.122  16.054 -18.612
  139    HD2  ARG  19           HD2      ARG  19  19.915  15.827 -20.049
  140    HD3  ARG  19           HD3      ARG  19  20.336  17.265 -19.116
  141    HE   ARG  19           HE       ARG  19  21.565  15.203 -17.730
  142   HH11  ARG  19          HH11      ARG  19  21.773  16.256 -21.103
  143   HH12  ARG  19          HH12      ARG  19  23.348  15.466 -21.263
  144   HH21  ARG  19          HH21      ARG  19  23.625  14.290 -18.172
  145   HH22  ARG  19          HH22      ARG  19  24.261  14.492 -19.807
  146    H    PHE  20           H        PHE  20  16.401  18.101 -16.908
  147    HA   PHE  20           HA       PHE  20  15.885  18.643 -19.633
  148    HB2  PHE  20           HB2      PHE  20  14.140  17.840 -18.145
  149    HB3  PHE  20           HB3      PHE  20  14.264  19.274 -17.145
  150    HD1  PHE  20           HD1      PHE  20  13.511  18.286 -20.730
  151    HD2  PHE  20           HD2      PHE  20  12.944  21.168 -17.573
  152    HE1  PHE  20           HE1      PHE  20  11.731  19.393 -22.047
  153    HE2  PHE  20           HE2      PHE  20  11.243  22.336 -18.948
  154    HZ   PHE  20           HZ       PHE  20  10.619  21.441 -21.185
  155    H    THR  21           H        THR  21  16.200  21.010 -16.931
  156    HA   THR  21           HA       THR  21  15.676  23.326 -18.510
  157    HB   THR  21           HB       THR  21  17.458  23.176 -16.046
  158    HG1  THR  21           HG1      THR  21  15.480  22.299 -15.577
  159   HG21  THR  21          HG21      THR  21  15.852  25.458 -17.303
  160   HG22  THR  21          HG22      THR  21  16.524  25.504 -15.665
  161   HG23  THR  21          HG23      THR  21  17.613  25.382 -17.047
  162    H    ALA  22           H        ALA  22  18.838  21.697 -17.818
  163    HA   ALA  22           HA       ALA  22  20.374  23.447 -19.486
  164    HB1  ALA  22           HB1      ALA  22  21.341  21.953 -17.768
  165    HB2  ALA  22           HB2      ALA  22  20.848  20.531 -18.714
  166    HB3  ALA  22           HB3      ALA  22  22.063  21.653 -19.361
  167    H    ALA  23           H        ALA  23  18.637  20.420 -20.278
  168    HA   ALA  23           HA       ALA  23  19.474  20.261 -23.003
  169    HB1  ALA  23           HB1      ALA  23  17.647  18.681 -23.254
  170    HB2  ALA  23           HB2      ALA  23  18.483  18.390 -21.719
  171    HB3  ALA  23           HB3      ALA  23  16.911  19.223 -21.735
  172    H    LEU  24           H        LEU  24  16.770  22.001 -21.481
  173    HA   LEU  24           HA       LEU  24  15.634  23.001 -23.932
  174    HB2  LEU  24           HB2      LEU  24  14.576  22.702 -21.595
  175    HB3  LEU  24           HB3      LEU  24  15.430  24.160 -21.135
  176    HG   LEU  24           HG       LEU  24  14.185  25.307 -23.111
  177   HD11  LEU  24          HD11      LEU  24  12.069  24.183 -23.783
  178   HD12  LEU  24          HD12      LEU  24  13.467  23.200 -24.255
  179   HD13  LEU  24          HD13      LEU  24  12.510  22.752 -22.835
  180   HD21  LEU  24          HD21      LEU  24  12.129  25.562 -21.756
  181   HD22  LEU  24          HD22      LEU  24  12.592  24.140 -20.790
  182   HD23  LEU  24          HD23      LEU  24  13.572  25.620 -20.729
  183    H    GLU  25           H        GLU  25  18.126  24.271 -21.684
  184    HA   GLU  25           HA       GLU  25  18.580  26.764 -23.034
  185    HB2  GLU  25           HB2      GLU  25  19.550  26.012 -20.777
  186    HB3  GLU  25           HB3      GLU  25  20.729  25.081 -21.689
  187    HG2  GLU  25           HG2      GLU  25  21.464  27.170 -22.843
  188    HG3  GLU  25           HG3      GLU  25  20.285  28.086 -21.904
  189    H    LEU  26           H        LEU  26  20.064  23.542 -23.487
  190    HA   LEU  26           HA       LEU  26  21.645  23.954 -25.778
  191    HB2  LEU  26           HB2      LEU  26  21.929  21.867 -24.885
  192    HB3  LEU  26           HB3      LEU  26  20.272  21.728 -24.403
  193    HG   LEU  26           HG       LEU  26  19.691  21.239 -26.875
  194   HD11  LEU  26          HD11      LEU  26  21.507  20.280 -28.199
  195   HD12  LEU  26          HD12      LEU  26  21.862  21.978 -27.836
  196   HD13  LEU  26          HD13      LEU  26  22.685  20.687 -26.932
  197   HD21  LEU  26          HD21      LEU  26  19.562  19.546 -25.168
  198   HD22  LEU  26          HD22      LEU  26  20.315  18.867 -26.610
  199   HD23  LEU  26          HD23      LEU  26  21.326  19.302 -25.211
  200    H    ALA  27           H        ALA  27  18.139  23.272 -25.646
  201    HA   ALA  27           HA       ALA  27  17.732  23.325 -28.453
  202    HB1  ALA  27           HB1      ALA  27  16.123  22.375 -26.871
  203    HB2  ALA  27           HB2      ALA  27  15.792  23.982 -26.198
  204    HB3  ALA  27           HB3      ALA  27  15.355  23.627 -27.876
  205    H    ILE  28           H        ILE  28  17.475  26.057 -26.105
  206    HA   ILE  28           HA       ILE  28  16.766  28.067 -28.038
  207    HB   ILE  28           HB       ILE  28  18.313  28.351 -25.425
  208   HG12  ILE  28          HG12      ILE  28  15.355  28.881 -25.923
  209   HG13  ILE  28          HG13      ILE  28  15.953  27.346 -25.311
  210   HG21  ILE  28          HG21      ILE  28  17.553  30.737 -25.500
  211   HG22  ILE  28          HG22      ILE  28  18.628  30.355 -26.833
  212   HG23  ILE  28          HG23      ILE  28  16.878  30.455 -27.118
  213   HD11  ILE  28          HD11      ILE  28  16.987  28.524 -23.372
  214   HD12  ILE  28          HD12      ILE  28  16.126  29.996 -23.891
  215   HD13  ILE  28          HD13      ILE  28  15.218  28.530 -23.454
  216    H    ASP  29           H        ASP  29  19.956  27.065 -26.751
  217    HA   ASP  29           HA       ASP  29  21.558  28.818 -28.294
  218    HB2  ASP  29           HB2      ASP  29  22.269  27.574 -26.268
  219    HB3  ASP  29           HB3      ASP  29  22.203  26.063 -27.174
  220    H    ARG  30           H        ARG  30  20.148  25.695 -29.178
  221    HA   ARG  30           HA       ARG  30  21.664  25.560 -31.705
  222    HB2  ARG  30           HB2      ARG  30  21.037  23.597 -30.255
  223    HB3  ARG  30           HB3      ARG  30  19.353  23.820 -30.743
  224    HG2  ARG  30           HG2      ARG  30  20.018  23.422 -33.122
  225    HG3  ARG  30           HG3      ARG  30  21.718  23.302 -32.612
  226    HD2  ARG  30           HD2      ARG  30  20.972  21.427 -31.041
  227    HD3  ARG  30           HD3      ARG  30  19.424  21.443 -31.882
  228    HE   ARG  30           HE       ARG  30  20.744  20.982 -34.005
  229   HH11  ARG  30          HH11      ARG  30  22.186  20.001 -30.955
  230   HH12  ARG  30          HH12      ARG  30  23.036  18.659 -31.694
  231   HH21  ARG  30          HH21      ARG  30  21.940  19.293 -34.864
  232   HH22  ARG  30          HH22      ARG  30  22.937  18.321 -33.796
  233    H    ALA  31           H        ALA  31  18.328  26.426 -30.775
  234    HA   ALA  31           HA       ALA  31  17.189  26.467 -33.360
  235    HB1  ALA  31           HB1      ALA  31  16.542  28.152 -30.894
  236    HB2  ALA  31           HB2      ALA  31  15.480  27.944 -32.304
  237    HB3  ALA  31           HB3      ALA  31  15.877  26.555 -31.279
  238    H    THR  32           H        THR  32  19.132  28.982 -31.777
  239    HA   THR  32           HA       THR  32  18.650  30.964 -33.867
  240    HB   THR  32           HB       THR  32  19.288  31.421 -31.453
  241    HG1  THR  32           HG1      THR  32  20.368  33.272 -32.069
  242   HG21  THR  32          HG21      THR  32  21.649  31.634 -30.911
  243   HG22  THR  32          HG22      THR  32  21.296  29.951 -31.325
  244   HG23  THR  32          HG23      THR  32  22.119  31.001 -32.503
  245    H    LEU  33           H        LEU  33  20.599  28.153 -33.821
  246    HA   LEU  33           HA       LEU  33  22.518  29.230 -35.778
  247    HB2  LEU  33           HB2      LEU  33  22.625  26.779 -33.991
  248    HB3  LEU  33           HB3      LEU  33  23.890  27.260 -35.123
  249    HG   LEU  33           HG       LEU  33  22.999  28.787 -32.650
  250   HD11  LEU  33          HD11      LEU  33  25.233  28.212 -31.806
  251   HD12  LEU  33          HD12      LEU  33  24.321  26.751 -32.205
  252   HD13  LEU  33          HD13      LEU  33  25.593  27.326 -33.307
  253   HD21  LEU  33          HD21      LEU  33  25.202  29.441 -34.660
  254   HD22  LEU  33          HD22      LEU  33  23.741  30.405 -34.348
  255   HD23  LEU  33          HD23      LEU  33  24.971  30.249 -33.093
  256    H    SER  34           H        SER  34  20.208  26.586 -35.268
  257    HA   SER  34           HA       SER  34  20.897  25.017 -37.557
  258    HB2  SER  34           HB2      SER  34  18.795  23.857 -37.076
  259    HB3  SER  34           HB3      SER  34  19.683  24.175 -35.570
  260    HG   SER  34           HG       SER  34  17.436  24.765 -35.428
  261    H    GLY  35           H        GLY  35  18.579  27.631 -37.113
  262    HA2  GLY  35           HA2      GLY  35  17.834  29.055 -38.931
  263    HA3  GLY  35           HA3      GLY  35  17.955  27.697 -40.046
  264    H    GLN  36           H        GLN  36  16.526  26.505 -37.226
  265    HA   GLN  36           HA       GLN  36  13.765  27.408 -37.801
  266    HB2  GLN  36           HB2      GLN  36  14.180  25.302 -39.182
  267    HB3  GLN  36           HB3      GLN  36  14.554  24.467 -37.674
  268    HG2  GLN  36           HG2      GLN  36  12.170  25.090 -36.898
  269    HG3  GLN  36           HG3      GLN  36  11.869  25.568 -38.566
  270   HE21  GLN  36          HE22      GLN  36  12.542  22.876 -36.320
  271   HE22  GLN  36          HE21      GLN  36  12.028  21.618 -37.462
  272    HA   PRO  37           HA       PRO  37  13.472  27.116 -33.261
  273    HB2  PRO  37           HB2      PRO  37  10.758  26.021 -34.081
  274    HB3  PRO  37           HB3      PRO  37  11.146  27.089 -32.698
  275    HG2  PRO  37           HG2      PRO  37  10.175  28.182 -34.955
  276    HG3  PRO  37           HG3      PRO  37  11.599  28.940 -34.168
  277    HD2  PRO  37           HD2      PRO  37  11.519  27.156 -36.588
  278    HD3  PRO  37           HD3      PRO  37  12.526  28.598 -36.278
  279    H    VAL  38           H        VAL  38  13.386  25.463 -31.671
  280    HA   VAL  38           HA       VAL  38  13.897  22.671 -32.679
  281    HB   VAL  38           HB       VAL  38  15.224  24.244 -30.445
  282   HG11  VAL  38          HG11      VAL  38  15.045  21.935 -29.622
  283   HG12  VAL  38          HG12      VAL  38  15.655  21.317 -31.175
  284   HG13  VAL  38          HG13      VAL  38  16.701  22.266 -30.123
  285   HG21  VAL  38          HG21      VAL  38  17.256  23.881 -31.778
  286   HG22  VAL  38          HG22      VAL  38  16.354  22.903 -32.956
  287   HG23  VAL  38          HG23      VAL  38  16.035  24.633 -32.805
  288    H    GLY  39           H        GLY  39  13.309  20.928 -31.047
  289    HA2  GLY  39           HA2      GLY  39  11.208  21.771 -29.123
  290    HA3  GLY  39           HA3      GLY  39  10.702  20.791 -30.489
  291    H    ILE  40           H        ILE  40  10.092  19.824 -28.183
  292    HA   ILE  40           HA       ILE  40  11.911  17.498 -27.828
  293    HB   ILE  40           HB       ILE  40  10.629  18.937 -25.479
  294   HG12  ILE  40          HG12      ILE  40  13.544  18.930 -26.381
  295   HG13  ILE  40          HG13      ILE  40  12.461  20.316 -26.421
  296   HG21  ILE  40          HG21      ILE  40  10.901  16.463 -25.230
  297   HG22  ILE  40          HG22      ILE  40  12.625  16.630 -25.596
  298   HG23  ILE  40          HG23      ILE  40  11.938  17.347 -24.126
  299   HD11  ILE  40          HD11      ILE  40  13.947  20.547 -24.564
  300   HD12  ILE  40          HD12      ILE  40  12.282  20.337 -23.995
  301   HD13  ILE  40          HD13      ILE  40  13.453  18.989 -23.888
  302    H    HIS  41           H        HIS  41  10.918  15.666 -27.956
  303    HA   HIS  41           HA       HIS  41   7.945  15.501 -28.128
  304    HB2  HIS  41           HB2      HIS  41   9.125  14.786 -30.119
  305    HB3  HIS  41           HB3      HIS  41  10.222  13.780 -29.180
  306    HD1  HIS  41           HD1      HIS  41   9.617  11.365 -29.878
  307    HD2  HIS  41           HD2      HIS  41   6.281  13.835 -29.237
  308    HE1  HIS  41           HE1      HIS  41   7.564   9.893 -30.205
  309    H    PHE  42           H        PHE  42   6.894  14.499 -26.576
  310    HA   PHE  42           HA       PHE  42   8.280  12.655 -24.664
  311    HB2  PHE  42           HB2      PHE  42   5.978  14.620 -24.295
  312    HB3  PHE  42           HB3      PHE  42   6.407  13.382 -23.129
  313    HD1  PHE  42           HD2      PHE  42   7.577  16.598 -24.698
  314    HD2  PHE  42           HD1      PHE  42   8.311  13.585 -21.678
  315    HE1  PHE  42           HE2      PHE  42   9.206  18.086 -23.582
  316    HE2  PHE  42           HE1      PHE  42   9.945  15.090 -20.582
  317    HZ   PHE  42           HZ       PHE  42  10.384  17.347 -21.523
  318    H    SER  43           H        SER  43   7.632  10.585 -24.860
  319    HA   SER  43           HA       SER  43   5.196  10.018 -26.458
  320    HB2  SER  43           HB2      SER  43   6.296   8.365 -27.579
  321    HB3  SER  43           HB3      SER  43   7.576   9.565 -27.374
  322    HG   SER  43           HG       SER  43   8.287   7.469 -26.844
  323    H    ASP  44           H        ASP  44   4.739   7.464 -26.212
  324    HA   ASP  44           HA       ASP  44   3.631   7.068 -23.579
  325    HB2  ASP  44           HB2      ASP  44   2.663   6.236 -25.724
  326    HB3  ASP  44           HB3      ASP  44   4.024   5.127 -25.889
  327    H    SER  45           H        SER  45   6.828   6.545 -24.765
  328    HA   SER  45           HA       SER  45   7.467   4.652 -22.519
  329    HB2  SER  45           HB2      SER  45   8.387   4.393 -25.404
  330    HB3  SER  45           HB3      SER  45   8.854   3.339 -24.062
  331    HG   SER  45           HG       SER  45   6.668   2.718 -23.863
  332    H    ALA  46           H        ALA  46   8.591   7.404 -24.414
  333    HA   ALA  46           HA       ALA  46  10.882   7.747 -22.629
  334    HB1  ALA  46           HB1      ALA  46  11.303   7.298 -25.634
  335    HB2  ALA  46           HB2      ALA  46  12.565   7.732 -24.468
  336    HB3  ALA  46           HB3      ALA  46  11.778   6.162 -24.356
  337    H    TRP  47           H        TRP  47  12.262   9.724 -23.828
  338    HA   TRP  47           HA       TRP  47  10.541  11.535 -25.303
  339    HB2  TRP  47           HB2      TRP  47  10.840  13.467 -23.872
  340    HB3  TRP  47           HB3      TRP  47   9.980  12.200 -23.024
  341    HD1  TRP  47           HD1      TRP  47  13.542  13.701 -23.203
  342    HE1  TRP  47           HE1      TRP  47  14.552  13.698 -20.857
  343    HE3  TRP  47           HE3      TRP  47   9.845  11.153 -20.741
  344    HZ2  TRP  47           HZ2      TRP  47  13.857  12.708 -18.231
  345    HZ3  TRP  47           HZ3      TRP  47  10.034  10.735 -18.307
  346    HH2  TRP  47           HH2      TRP  47  12.006  11.550 -17.029
  347    H    ARG  48           H        ARG  48  11.699  13.116 -26.438
  348    HA   ARG  48           HA       ARG  48  14.685  12.891 -26.569
  349    HB2  ARG  48           HB2      ARG  48  12.676  12.294 -28.813
  350    HB3  ARG  48           HB3      ARG  48  14.391  12.594 -29.082
  351    HG2  ARG  48           HG2      ARG  48  14.985  10.598 -27.776
  352    HG3  ARG  48           HG3      ARG  48  13.267  10.236 -27.508
  353    HD2  ARG  48           HD2      ARG  48  12.843   9.878 -29.818
  354    HD3  ARG  48           HD3      ARG  48  14.328  10.675 -30.321
  355    HE   ARG  48           HE       ARG  48  14.020   7.895 -29.596
  356   HH11  ARG  48          HH11      ARG  48  16.439  10.473 -29.629
  357   HH12  ARG  48          HH12      ARG  48  17.733   9.296 -29.710
  358   HH21  ARG  48          HH21      ARG  48  15.805   6.541 -29.840
  359   HH22  ARG  48          HH22      ARG  48  17.401   7.258 -29.892
  360    H    ILE  49           H        ILE  49  15.692  14.558 -27.474
  361    HA   ILE  49           HA       ILE  49  14.257  17.081 -27.974
  362    HB   ILE  49           HB       ILE  49  17.158  16.434 -28.568
  363   HG12  ILE  49          HG12      ILE  49  16.881  15.763 -26.268
  364   HG13  ILE  49          HG13      ILE  49  17.835  17.231 -26.383
  365   HG21  ILE  49          HG21      ILE  49  16.431  18.546 -29.516
  366   HG22  ILE  49          HG22      ILE  49  15.704  19.045 -27.976
  367   HG23  ILE  49          HG23      ILE  49  17.466  18.883 -28.127
  368   HD11  ILE  49          HD11      ILE  49  15.913  18.585 -25.631
  369   HD12  ILE  49          HD12      ILE  49  14.894  17.122 -25.591
  370   HD13  ILE  49          HD13      ILE  49  16.260  17.278 -24.487
  371    H    MET  50           H        MET  50  14.001  18.021 -30.083
  372    HA   MET  50           HA       MET  50  14.642  16.314 -32.436
  373    HB2  MET  50           HB2      MET  50  11.898  17.462 -31.779
  374    HB3  MET  50           HB3      MET  50  12.377  16.865 -33.373
  375    HG2  MET  50           HG2      MET  50  12.991  14.667 -32.263
  376    HG3  MET  50           HG3      MET  50  12.226  15.268 -30.799
  377    HE1  MET  50           HE1      MET  50  10.059  14.328 -34.792
  378    HE2  MET  50           HE2      MET  50  11.660  15.074 -34.621
  379    HE3  MET  50           HE3      MET  50  11.455  13.349 -34.267
  380    H    VAL  51           H        VAL  51  14.946  17.327 -34.330
  381    HA   VAL  51           HA       VAL  51  15.284  20.305 -34.338
  382    HB   VAL  51           HB       VAL  51  17.596  19.838 -35.298
  383   HG11  VAL  51          HG11      VAL  51  17.139  18.847 -32.462
  384   HG12  VAL  51          HG12      VAL  51  18.643  19.481 -33.144
  385   HG13  VAL  51          HG13      VAL  51  17.230  20.546 -32.963
  386   HG21  VAL  51          HG21      VAL  51  17.246  17.025 -34.215
  387   HG22  VAL  51          HG22      VAL  51  17.227  17.451 -35.938
  388   HG23  VAL  51          HG23      VAL  51  18.680  17.739 -34.976
  389    HA   PRO  52           HA       PRO  52  14.055  20.253 -38.613
  390    HB2  PRO  52           HB2      PRO  52  16.028  21.742 -39.921
  391    HB3  PRO  52           HB3      PRO  52  14.648  22.410 -39.007
  392    HG2  PRO  52           HG2      PRO  52  17.482  21.905 -38.057
  393    HG3  PRO  52           HG3      PRO  52  16.498  23.380 -37.829
  394    HD2  PRO  52           HD2      PRO  52  16.688  21.614 -35.843
  395    HD3  PRO  52           HD3      PRO  52  15.080  22.268 -36.238
  396    H    GLY  53           H        GLY  53  17.405  19.356 -38.032
  397    HA2  GLY  53           HA2      GLY  53  18.896  17.928 -38.989
  398    HA3  GLY  53           HA3      GLY  53  17.514  16.863 -39.133
  399    H    LYS  54           H        LYS  54  16.290  16.935 -41.189
  400    HA   LYS  54           HA       LYS  54  18.049  16.730 -43.462
  401    HB2  LYS  54           HB2      LYS  54  16.064  15.311 -43.060
  402    HB3  LYS  54           HB3      LYS  54  14.996  16.681 -43.350
  403    HG2  LYS  54           HG2      LYS  54  17.026  15.928 -45.466
  404    HG3  LYS  54           HG3      LYS  54  15.629  14.882 -45.236
  405    HD2  LYS  54           HD2      LYS  54  14.067  16.618 -45.772
  406    HD3  LYS  54           HD3      LYS  54  15.325  17.866 -45.766
  407    HE2  LYS  54           HE2      LYS  54  16.456  16.841 -47.661
  408    HE3  LYS  54           HE3      LYS  54  15.316  15.488 -47.661
  409    HZ1  LYS  54           HZ1      LYS  54  14.717  17.134 -49.336
  410    HZ2  LYS  54           HZ2      LYS  54  13.540  17.076 -48.216
  411    HZ3  LYS  54           HZ3      LYS  54  14.601  18.321 -48.232
  412    H    THR  55           H        THR  55  15.765  19.266 -42.475
  413    HA   THR  55           HA       THR  55  17.214  21.181 -44.088
  414    HB   THR  55           HB       THR  55  15.888  20.342 -45.899
  415    HG1  THR  55           HG1      THR  55  15.112  22.283 -46.529
  416   HG21  THR  55          HG21      THR  55  13.859  19.516 -44.629
  417   HG22  THR  55          HG22      THR  55  13.354  21.209 -44.445
  418   HG23  THR  55          HG23      THR  55  13.493  20.495 -46.059
  419    HA   PRO  56           HA       PRO  56  15.024  23.801 -41.062
  420    HB2  PRO  56           HB2      PRO  56  16.549  26.011 -41.204
  421    HB3  PRO  56           HB3      PRO  56  17.216  24.484 -40.544
  422    HG2  PRO  56           HG2      PRO  56  17.527  25.597 -43.360
  423    HG3  PRO  56           HG3      PRO  56  18.811  24.986 -42.269
  424    HD2  PRO  56           HD2      PRO  56  17.581  23.443 -44.222
  425    HD3  PRO  56           HD3      PRO  56  18.256  22.760 -42.713
  426    H    SER  57           H        SER  57  15.295  24.217 -44.506
  427    HA   SER  57           HA       SER  57  14.312  26.872 -44.799
  428    HB2  SER  57           HB2      SER  57  14.277  24.565 -46.780
  429    HB3  SER  57           HB3      SER  57  14.090  26.285 -47.173
  430    HG   SER  57           HG       SER  57  16.249  25.558 -47.450
  431    H    ALA  58           H        ALA  58  12.561  24.018 -44.091
  432    HA   ALA  58           HA       ALA  58  10.036  25.471 -44.035
  433    HB1  ALA  58           HB1      ALA  58  10.340  22.887 -45.650
  434    HB2  ALA  58           HB2      ALA  58   8.807  23.708 -45.285
  435    HB3  ALA  58           HB3      ALA  58  10.003  24.497 -46.326
  436    H    TRP  59           H        TRP  59   8.399  24.131 -42.817
  437    HA   TRP  59           HA       TRP  59   9.301  23.176 -40.352
  438    HB2  TRP  59           HB2      TRP  59   7.044  23.896 -40.680
  439    HB3  TRP  59           HB3      TRP  59   6.750  22.664 -41.896
  440    HD1  TRP  59           HD1      TRP  59   6.284  20.196 -41.107
  441    HE1  TRP  59           HE1      TRP  59   5.324  19.240 -38.931
  442    HE3  TRP  59           HE3      TRP  59   7.240  24.152 -37.984
  443    HZ2  TRP  59           HZ2      TRP  59   4.911  20.113 -36.215
  444    HZ3  TRP  59           HZ3      TRP  59   6.568  24.045 -35.595
  445    HH2  TRP  59           HH2      TRP  59   5.388  22.049 -34.703
  446    H    ARG  60           H        ARG  60  10.590  21.550 -39.915
  447    HA   ARG  60           HA       ARG  60   9.990  18.810 -40.884
  448    HB2  ARG  60           HB2      ARG  60  11.670  20.020 -42.427
  449    HB3  ARG  60           HB3      ARG  60  12.741  20.132 -41.037
  450    HG2  ARG  60           HG2      ARG  60  13.455  18.310 -42.415
  451    HG3  ARG  60           HG3      ARG  60  12.812  17.621 -40.928
  452    HD2  ARG  60           HD2      ARG  60  10.641  17.165 -42.150
  453    HD3  ARG  60           HD3      ARG  60  11.385  17.824 -43.614
  454    HE   ARG  60           HE       ARG  60  12.773  15.575 -42.253
  455   HH11  ARG  60          HH21      ARG  60  10.636  16.421 -44.898
  456   HH12  ARG  60          HH22      ARG  60  10.958  14.935 -45.741
  457   HH21  ARG  60          HH11      ARG  60  13.135  13.709 -43.396
  458   HH22  ARG  60          HH12      ARG  60  12.333  13.456 -44.912
  459    H    TRP  61           H        TRP  61  10.778  17.173 -39.517
  460    HA   TRP  61           HA       TRP  61  12.221  17.958 -37.056
  461    HB2  TRP  61           HB2      TRP  61   9.545  16.521 -37.115
  462    HB3  TRP  61           HB3      TRP  61  10.605  16.595 -35.714
  463    HD1  TRP  61           HD1      TRP  61   7.696  18.218 -36.895
  464    HE1  TRP  61           HE1      TRP  61   7.385  20.587 -35.910
  465    HE3  TRP  61           HE3      TRP  61  12.385  18.914 -35.005
  466    HZ2  TRP  61           HZ2      TRP  61   8.943  22.453 -34.334
  467    HZ3  TRP  61           HZ3      TRP  61  12.946  20.971 -33.747
  468    HH2  TRP  61           HH2      TRP  61  11.245  22.720 -33.376
  469    H    VAL  62           H        VAL  62  13.642  16.589 -36.384
  470    HA   VAL  62           HA       VAL  62  13.663  13.720 -37.185
  471    HB   VAL  62           HB       VAL  62  16.060  15.613 -37.225
  472   HG11  VAL  62          HG11      VAL  62  16.655  13.252 -36.779
  473   HG12  VAL  62          HG12      VAL  62  15.765  12.754 -38.239
  474   HG13  VAL  62          HG13      VAL  62  17.215  13.770 -38.365
  475   HG21  VAL  62          HG21      VAL  62  14.395  14.566 -39.546
  476   HG22  VAL  62          HG22      VAL  62  14.713  16.266 -39.109
  477   HG23  VAL  62          HG23      VAL  62  16.019  15.250 -39.728
  478    HA   PRO  63           HA       PRO  63  14.543  13.530 -32.721
  479    HB2  PRO  63           HB2      PRO  63  15.322  10.920 -32.471
  480    HB3  PRO  63           HB3      PRO  63  13.619  11.428 -32.692
  481    HG2  PRO  63           HG2      PRO  63  15.567  10.447 -34.799
  482    HG3  PRO  63           HG3      PRO  63  13.868   9.941 -34.539
  483    HD2  PRO  63           HD2      PRO  63  14.561  11.783 -36.417
  484    HD3  PRO  63           HD3      PRO  63  13.035  11.926 -35.498
  485    H    LEU  64           H        LEU  64  16.294  13.990 -31.481
  486    HA   LEU  64           HA       LEU  64  18.815  14.222 -32.957
  487    HB2  LEU  64           HB2      LEU  64  17.764  16.199 -31.892
  488    HB3  LEU  64           HB3      LEU  64  17.908  15.404 -30.325
  489    HG   LEU  64           HG       LEU  64  20.392  15.437 -30.530
  490   HD11  LEU  64          HD11      LEU  64  20.609  15.501 -33.014
  491   HD12  LEU  64          HD12      LEU  64  19.887  17.125 -33.019
  492   HD13  LEU  64          HD13      LEU  64  21.456  16.833 -32.240
  493   HD21  LEU  64          HD21      LEU  64  19.232  17.257 -29.358
  494   HD22  LEU  64          HD22      LEU  64  20.665  17.855 -30.193
  495   HD23  LEU  64          HD23      LEU  64  19.054  18.152 -30.886
  496    H    GLN  65           H        GLN  65  20.525  12.963 -32.591
  497    HA   GLN  65           HA       GLN  65  21.344  12.250 -29.930
  498    HB2  GLN  65           HB2      GLN  65  19.733  10.277 -31.185
  499    HB3  GLN  65           HB3      GLN  65  21.385   9.693 -31.379
  500    HG2  GLN  65           HG2      GLN  65  21.753  10.057 -28.911
  501    HG3  GLN  65           HG3      GLN  65  20.063  10.564 -28.773
  502   HE21  GLN  65          HE22      GLN  65  22.197   7.809 -28.820
  503   HE22  GLN  65          HE21      GLN  65  20.917   6.603 -28.804
  504    H    GLU  66           H        GLU  66  22.008  12.239 -33.379
  505    HA   GLU  66           HA       GLU  66  24.474  10.980 -33.468
  506    HB2  GLU  66           HB2      GLU  66  23.505  13.332 -35.140
  507    HB3  GLU  66           HB3      GLU  66  24.834  12.261 -35.576
  508    HG2  GLU  66           HG2      GLU  66  21.920  11.429 -35.248
  509    HG3  GLU  66           HG3      GLU  66  22.754  11.703 -36.768
  510    H    ASP  67           H        ASP  67  23.964  14.121 -32.106
  511    HA   ASP  67           HA       ASP  67  26.900  14.360 -31.624
  512    HB2  ASP  67           HB2      ASP  67  26.723  16.798 -31.776
  513    HB3  ASP  67           HB3      ASP  67  26.355  15.983 -33.284
  514    H    ALA  68           H        ALA  68  24.453  13.299 -30.103
  515    HA   ALA  68           HA       ALA  68  25.199  14.485 -27.467
  516    HB1  ALA  68           HB1      ALA  68  22.855  14.313 -26.766
  517    HB2  ALA  68           HB2      ALA  68  22.993  15.355 -28.193
  518    HB3  ALA  68           HB3      ALA  68  22.396  13.688 -28.363
  519    H    ALA  69           H        ALA  69  25.425  11.835 -29.299
  520    HA   ALA  69           HA       ALA  69  25.763   9.668 -29.163
  521    HB1  ALA  69           HB1      ALA  69  26.689  10.312 -26.346
  522    HB2  ALA  69           HB2      ALA  69  27.088   8.852 -27.275
  523    HB3  ALA  69           HB3      ALA  69  27.649  10.439 -27.835
  524    H    ASP  70           H        ASP  70  24.395  10.219 -25.935
  525    HA   ASP  70           HA       ASP  70  22.153   8.365 -26.417
  526    HB2  ASP  70           HB2      ASP  70  24.202   6.980 -25.801
  527    HB3  ASP  70           HB3      ASP  70  24.201   7.792 -24.239
  528    H    GLU  71           H        GLU  71  23.095  11.241 -25.212
  529    HA   GLU  71           HA       GLU  71  21.861  11.268 -22.572
  530    HB2  GLU  71           HB2      GLU  71  22.994  13.492 -24.318
  531    HB3  GLU  71           HB3      GLU  71  22.437  13.684 -22.651
  532    HG2  GLU  71           HG2      GLU  71  24.100  11.996 -21.896
  533    HG3  GLU  71           HG3      GLU  71  24.732  11.892 -23.539
  534    H    SER  72           H        SER  72  20.000  10.395 -24.385
  535    HA   SER  72           HA       SER  72  17.821  12.420 -24.405
  536    HB2  SER  72           HB2      SER  72  19.090  12.514 -26.583
  537    HB3  SER  72           HB3      SER  72  18.653  10.819 -26.856
  538    HG   SER  72           HG       SER  72  17.278  12.448 -27.836
  539    H    GLN  73           H        GLN  73  16.059  10.695 -25.866
  540    HA   GLN  73           HA       GLN  73  14.513   9.067 -25.427
  541    HB2  GLN  73           HB2      GLN  73  15.334   6.859 -25.893
  542    HB3  GLN  73           HB3      GLN  73  16.053   8.066 -26.945
  543    HG2  GLN  73           HG2      GLN  73  18.183   7.941 -25.822
  544    HG3  GLN  73           HG3      GLN  73  17.515   6.991 -24.491
  545   HE21  GLN  73          HE22      GLN  73  18.503   6.884 -27.901
  546   HE22  GLN  73          HE21      GLN  73  18.445   5.123 -28.004
  547    H    ASN  74           H        ASN  74  14.757  10.242 -23.014
  548    HA   ASN  74           HA       ASN  74  14.494  10.036 -20.772
  549    HB2  ASN  74           HB2      ASN  74  12.444   9.029 -21.438
  550    HB3  ASN  74           HB3      ASN  74  13.197   7.450 -21.689
  551   HD21  ASN  74          HD22      ASN  74  12.682   9.868 -19.047
  552   HD22  ASN  74          HD21      ASN  74  12.735   8.666 -17.779
  553    H    ASP  75           H        ASP  75  17.168   8.912 -21.868
  554    HA   ASP  75           HA       ASP  75  18.103   6.987 -19.974
  555    HB2  ASP  75           HB2      ASP  75  19.246   7.646 -22.077
  556    HB3  ASP  75           HB3      ASP  75  19.606   9.228 -21.376
  557    H    TRP  76           H        TRP  76  17.209  10.253 -19.444
  558    HA   TRP  76           HA       TRP  76  19.113  11.164 -17.600
  559    HB2  TRP  76           HB2      TRP  76  16.195  11.957 -17.869
  560    HB3  TRP  76           HB3      TRP  76  17.459  12.917 -17.130
  561    HD1  TRP  76           HD1      TRP  76  19.262  11.850 -20.019
  562    HE1  TRP  76           HE1      TRP  76  19.020  13.435 -22.025
  563    HE3  TRP  76           HE3      TRP  76  15.255  14.604 -18.401
  564    HZ2  TRP  76           HZ2      TRP  76  17.285  15.571 -22.845
  565    HZ3  TRP  76           HZ3      TRP  76  14.300  16.368 -19.842
  566    HH2  TRP  76           HH2      TRP  76  15.306  16.879 -22.061
  567    H    ASP  77           H        ASP  77  16.562   8.884 -16.870
  568    HA   ASP  77           HA       ASP  77  17.039   9.272 -13.960
  569    HB2  ASP  77           HB2      ASP  77  14.897   9.718 -13.397
  570    HB3  ASP  77           HB3      ASP  77  14.938  10.533 -14.950
  571    H    GLU  78           H        GLU  78  15.903   7.600 -12.608
  572    HA   GLU  78           HA       GLU  78  15.541   4.951 -13.863
  573    HB2  GLU  78           HB2      GLU  78  17.114   3.839 -12.445
  574    HB3  GLU  78           HB3      GLU  78  17.953   5.190 -13.205
  575    HG2  GLU  78           HG2      GLU  78  17.380   6.517 -11.034
  576    HG3  GLU  78           HG3      GLU  78  17.003   4.944 -10.328
  577    H    GLU  79           H        GLU  79  13.830   7.046 -12.419
  578    HA   GLU  79           HA       GLU  79  12.565   5.328 -10.336
  579    HB2  GLU  79           HB2      GLU  79  13.678   8.111  -9.772
  580    HB3  GLU  79           HB3      GLU  79  12.635   7.225  -8.676
  581    HG2  GLU  79           HG2      GLU  79  15.439   6.391  -9.455
  582    HG3  GLU  79           HG3      GLU  79  14.956   7.226  -7.994
  583    H    LEU  80           H        LEU  80  12.086   7.463 -12.905
  584    HA   LEU  80           HA       LEU  80   9.586   8.602 -11.733
  585    HB2  LEU  80           HB2      LEU  80  11.258   9.680 -14.009
  586    HB3  LEU  80           HB3      LEU  80   9.977  10.507 -13.142
  587    HG   LEU  80           HG       LEU  80  12.714   9.805 -11.963
  588   HD11  LEU  80          HD11      LEU  80  12.684  11.512 -13.778
  589   HD12  LEU  80          HD12      LEU  80  11.592  12.491 -12.775
  590   HD13  LEU  80          HD13      LEU  80  13.237  12.074 -12.211
  591   HD21  LEU  80          HD21      LEU  80  12.051  11.235 -10.114
  592   HD22  LEU  80          HD22      LEU  80  10.437  11.471 -10.825
  593   HD23  LEU  80          HD23      LEU  80  10.938   9.872 -10.232
  594    H    SER  81           H        SER  81   7.910   9.119 -13.039
  595    HA   SER  81           HA       SER  81   7.638   8.101 -15.812
  596    HB2  SER  81           HB2      SER  81   6.483   6.510 -14.253
  597    HB3  SER  81           HB3      SER  81   5.518   7.866 -13.627
  598    HG   SER  81           HG       SER  81   4.467   6.692 -15.330
  599    H    ILE  82           H        ILE  82   6.777   9.731 -17.101
  600    HA   ILE  82           HA       ILE  82   6.321  12.334 -15.726
  601    HB   ILE  82           HB       ILE  82   7.851  11.485 -18.127
  602   HG12  ILE  82          HG12      ILE  82   9.327  13.327 -17.438
  603   HG13  ILE  82          HG13      ILE  82   8.163  13.850 -16.230
  604   HG21  ILE  82          HG21      ILE  82   6.241  12.881 -19.284
  605   HG22  ILE  82          HG22      ILE  82   6.484  14.200 -18.107
  606   HG23  ILE  82          HG23      ILE  82   7.799  13.697 -19.184
  607   HD11  ILE  82          HD11      ILE  82   8.608  11.931 -14.845
  608   HD12  ILE  82          HD12      ILE  82   9.522  11.122 -16.136
  609   HD13  ILE  82          HD13      ILE  82  10.174  12.575 -15.363
  610    H    HIS  83           H        HIS  83   4.806  13.722 -16.328
  611    HA   HIS  83           HA       HIS  83   2.661  12.916 -18.232
  612    HB2  HIS  83           HB2      HIS  83   2.237  14.020 -15.425
  613    HB3  HIS  83           HB3      HIS  83   0.975  13.704 -16.610
  614    HD1  HIS  83           HD1      HIS  83   0.250  11.112 -16.912
  615    HD2  HIS  83           HD2      HIS  83   3.340  11.880 -14.159
  616    HE1  HIS  83           HE1      HIS  83   0.580   8.960 -15.589
  617    H    LEU  84           H        LEU  84   1.425  14.799 -19.011
  618    HA   LEU  84           HA       LEU  84   2.809  17.425 -18.735
  619    HB2  LEU  84           HB2      LEU  84   2.223  15.995 -21.367
  620    HB3  LEU  84           HB3      LEU  84   2.587  17.701 -21.212
  621    HG   LEU  84           HG       LEU  84   4.785  16.825 -19.975
  622   HD11  LEU  84          HD11      LEU  84   4.214  14.378 -20.206
  623   HD12  LEU  84          HD12      LEU  84   4.167  14.583 -21.966
  624   HD13  LEU  84          HD13      LEU  84   5.683  14.821 -21.072
  625   HD21  LEU  84          HD21      LEU  84   4.417  16.779 -23.002
  626   HD22  LEU  84          HD22      LEU  84   4.692  18.230 -22.013
  627   HD23  LEU  84          HD23      LEU  84   5.946  16.994 -22.119
  628    H    GLN  85           H        GLN  85   1.625  19.215 -19.578
  629    HA   GLN  85           HA       GLN  85  -1.094  18.953 -20.489
  630    HB2  GLN  85           HB2      GLN  85  -2.082  20.438 -18.766
  631    HB3  GLN  85           HB3      GLN  85  -1.723  18.825 -18.193
  632    HG2  GLN  85           HG2      GLN  85   0.260  21.058 -17.662
  633    HG3  GLN  85           HG3      GLN  85  -1.219  20.960 -16.729
  634   HE21  GLN  85          HE22      GLN  85   1.924  19.348 -17.256
  635   HE22  GLN  85          HE21      GLN  85   1.728  18.309 -15.847
  636    HA   PRO  86           HA       PRO  86  -2.664  20.324 -21.431
  637    HB2  PRO  86           HB2      PRO  86  -3.204  21.586 -23.767
  638    HB3  PRO  86           HB3      PRO  86  -3.340  22.420 -22.190
  639    HG2  PRO  86           HG2      PRO  86  -1.000  22.487 -24.127
  640    HG3  PRO  86           HG3      PRO  86  -1.843  23.876 -23.366
  641    HD2  PRO  86           HD2      PRO  86   0.459  22.812 -22.340
  642    HD3  PRO  86           HD3      PRO  86  -0.822  23.474 -21.286
  643    H    PHE  87           H        PHE  87   0.415  20.144 -22.950
  644    HA   PHE  87           HA       PHE  87  -0.130  18.309 -25.103
  645    HB2  PHE  87           HB2      PHE  87   2.381  18.645 -23.422
  646    HB3  PHE  87           HB3      PHE  87   2.286  17.910 -25.015
  647    HD1  PHE  87           HD2      PHE  87   0.520  19.968 -26.430
  648    HD2  PHE  87           HD1      PHE  87   3.948  20.372 -23.835
  649    HE1  PHE  87           HE2      PHE  87   1.041  22.162 -27.454
  650    HE2  PHE  87           HE1      PHE  87   4.481  22.553 -24.892
  651    HZ   PHE  87           HZ       PHE  87   3.015  23.459 -26.687
  652    H    LYS  88           H        LYS  88   1.062  16.082 -24.961
  653    HA   LYS  88           HA       LYS  88   0.337  14.617 -22.502
  654    HB2  LYS  88           HB2      LYS  88  -0.993  12.959 -23.979
  655    HB3  LYS  88           HB3      LYS  88  -1.717  14.443 -23.409
  656    HG2  LYS  88           HG2      LYS  88  -2.486  14.126 -25.598
  657    HG3  LYS  88           HG3      LYS  88  -1.396  15.499 -25.662
  658    HD2  LYS  88           HD2      LYS  88   0.367  14.049 -26.642
  659    HD3  LYS  88           HD3      LYS  88  -0.729  12.651 -26.444
  660    HE2  LYS  88           HE2      LYS  88  -2.328  13.728 -28.011
  661    HE3  LYS  88           HE3      LYS  88  -1.194  15.064 -28.237
  662    HZ1  LYS  88           HZ1      LYS  88  -0.655  12.207 -28.952
  663    HZ2  LYS  88           HZ2      LYS  88  -0.971  13.415 -30.005
  664    HZ3  LYS  88           HZ3      LYS  88   0.419  13.423 -29.152
  665    HA   PRO  89           HA       PRO  89   3.899  12.202 -23.702
  666    HB2  PRO  89           HB2      PRO  89   3.818  10.199 -21.870
  667    HB3  PRO  89           HB3      PRO  89   4.164  11.895 -21.423
  668    HG2  PRO  89           HG2      PRO  89   1.512  10.429 -21.242
  669    HG3  PRO  89           HG3      PRO  89   2.306  11.437 -19.998
  670    HD2  PRO  89           HD2      PRO  89   0.355  12.395 -21.678
  671    HD3  PRO  89           HD3      PRO  89   1.692  13.421 -21.077
  672    H    ASP  90           H        ASP  90   3.284  11.591 -25.782
  673    HA   ASP  90           HA       ASP  90   2.162   8.881 -26.234
  674    HB2  ASP  90           HB2      ASP  90   0.184  10.373 -25.976
  675    HB3  ASP  90           HB3      ASP  90   0.923  11.491 -27.138
  676    H    ASP  91           H        ASP  91   2.878   8.062 -28.201
  677    HA   ASP  91           HA       ASP  91   5.066   9.310 -29.569
  678    HB2  ASP  91           HB2      ASP  91   4.880   6.903 -29.371
  679    HB3  ASP  91           HB3      ASP  91   3.360   6.902 -30.271
  680    H    SER  92           H        SER  92   4.408  11.304 -30.204
  681    HA   SER  92           HA       SER  92   2.080  11.690 -31.970
  682    HB2  SER  92           HB2      SER  92   3.979  13.680 -30.675
  683    HB3  SER  92           HB3      SER  92   2.448  14.065 -31.483
  684    HG   SER  92           HG       SER  92   2.730  12.343 -29.219
  685    H    ASN  93           H        ASN  93   5.243  10.945 -32.605
  686    HA   ASN  93           HA       ASN  93   6.713  11.155 -34.278
  687    HB2  ASN  93           HB2      ASN  93   4.449  10.309 -35.359
  688    HB3  ASN  93           HB3      ASN  93   4.515  11.840 -36.225
  689   HD21  ASN  93          HD22      ASN  93   6.935  12.209 -37.157
  690   HD22  ASN  93          HD21      ASN  93   7.538  10.797 -38.031
  691    H    GLN  94           H        GLN  94   5.934  13.706 -32.840
  692    HA   GLN  94           HA       GLN  94   7.723  15.487 -34.254
  693    HB2  GLN  94           HB2      GLN  94   6.187  17.358 -34.475
  694    HB3  GLN  94           HB3      GLN  94   5.543  16.018 -35.389
  695    HG2  GLN  94           HG2      GLN  94   3.774  15.659 -33.832
  696    HG3  GLN  94           HG3      GLN  94   4.562  16.567 -32.549
  697   HE21  GLN  94          HE22      GLN  94   4.581  18.878 -32.586
  698   HE22  GLN  94          HE21      GLN  94   3.443  19.740 -33.623
  699    HA   PRO  95           HA       PRO  95   8.072  16.752 -29.912
  700    HB2  PRO  95           HB2      PRO  95   8.793  19.367 -30.012
  701    HB3  PRO  95           HB3      PRO  95   9.913  18.036 -30.463
  702    HG2  PRO  95           HG2      PRO  95   8.230  19.759 -32.303
  703    HG3  PRO  95           HG3      PRO  95   9.974  19.355 -32.441
  704    HD2  PRO  95           HD2      PRO  95   8.053  18.003 -33.806
  705    HD3  PRO  95           HD3      PRO  95   9.498  17.174 -33.181
  706    H    GLN  96           H        GLN  96   6.803  17.792 -28.323
  707    HA   GLN  96           HA       GLN  96   4.382  19.266 -29.335
  708    HB2  GLN  96           HB2      GLN  96   4.694  18.052 -26.570
  709    HB3  GLN  96           HB3      GLN  96   3.278  18.764 -27.322
  710    HG2  GLN  96           HG2      GLN  96   2.711  16.610 -27.663
  711    HG3  GLN  96           HG3      GLN  96   3.631  16.827 -29.144
  712   HE21  GLN  96          HE22      GLN  96   3.252  14.242 -28.248
  713   HE22  GLN  96          HE21      GLN  96   4.628  13.638 -27.346
  714    H    VAL  97           H        VAL  97   6.994  19.333 -26.883
  715    HA   VAL  97           HA       VAL  97   6.545  22.164 -26.193
  716    HB   VAL  97           HB       VAL  97   8.894  20.297 -25.662
  717   HG11  VAL  97          HG11      VAL  97   9.514  21.877 -23.869
  718   HG12  VAL  97          HG12      VAL  97   9.582  22.661 -25.447
  719   HG13  VAL  97          HG13      VAL  97   8.205  22.966 -24.365
  720   HG21  VAL  97          HG21      VAL  97   7.967  20.132 -23.363
  721   HG22  VAL  97          HG22      VAL  97   6.543  21.055 -23.883
  722   HG23  VAL  97          HG23      VAL  97   6.871  19.445 -24.560
  723    H    VAL  98           H        VAL  98   7.473  23.901 -27.204
  724    HA   VAL  98           HA       VAL  98   9.614  23.411 -29.241
  725    HB   VAL  98           HB       VAL  98   7.035  24.904 -29.782
  726   HG11  VAL  98          HG11      VAL  98   7.956  25.268 -32.068
  727   HG12  VAL  98          HG12      VAL  98   8.856  26.157 -30.848
  728   HG13  VAL  98          HG13      VAL  98   9.528  24.651 -31.523
  729   HG21  VAL  98          HG21      VAL  98   6.815  22.474 -30.068
  730   HG22  VAL  98          HG22      VAL  98   6.822  23.266 -31.641
  731   HG23  VAL  98          HG23      VAL  98   8.285  22.436 -31.065
  732    H    ILE  99           H        ILE  99  11.009  24.998 -29.605
  733    HA   ILE  99           HA       ILE  99  11.198  27.244 -27.644
  734    HB   ILE  99           HB       ILE  99  13.386  25.338 -28.623
  735   HG12  ILE  99          HG12      ILE  99  13.506  24.869 -26.028
  736   HG13  ILE  99          HG13      ILE  99  11.814  25.330 -26.039
  737   HG21  ILE  99          HG21      ILE  99  13.446  27.606 -26.592
  738   HG22  ILE  99          HG22      ILE  99  14.765  26.466 -26.933
  739   HG23  ILE  99          HG23      ILE  99  14.247  27.586 -28.176
  740   HD11  ILE  99          HD11      ILE  99  12.238  22.857 -26.194
  741   HD12  ILE  99          HD12      ILE  99  11.305  23.449 -27.557
  742   HD13  ILE  99          HD13      ILE  99  13.037  23.112 -27.754
  743    H    LEU 100           H        LEU 100  11.464  29.152 -28.629
  744    HA   LEU 100           HA       LEU 100  12.329  29.297 -31.465
  745    HB2  LEU 100           HB2      LEU 100  11.565  31.612 -29.661
  746    HB3  LEU 100           HB3      LEU 100  11.703  31.598 -31.411
  747    HG   LEU 100           HG       LEU 100   9.495  30.493 -29.676
  748   HD11  LEU 100          HD11      LEU 100   8.099  31.862 -31.131
  749   HD12  LEU 100          HD12      LEU 100   9.428  32.847 -30.506
  750   HD13  LEU 100          HD13      LEU 100   9.490  32.245 -32.169
  751   HD21  LEU 100          HD21      LEU 100   9.956  29.861 -32.634
  752   HD22  LEU 100          HD22      LEU 100   9.900  28.674 -31.310
  753   HD23  LEU 100          HD23      LEU 100   8.441  29.557 -31.755
  754    H    ALA 101           H        ALA 101  13.920  30.800 -32.120
  755    HA   ALA 101           HA       ALA 101  16.471  30.519 -30.928
  756    HB1  ALA 101           HB1      ALA 101  15.428  32.564 -32.940
  757    HB2  ALA 101           HB2      ALA 101  17.135  32.221 -32.627
  758    HB3  ALA 101           HB3      ALA 101  16.092  30.956 -33.315
  759    H    ASP 102           H        ASP 102  14.062  33.011 -30.343
  760    HA   ASP 102           HA       ASP 102  15.899  34.843 -28.980
  761    HB2  ASP 102           HB2      ASP 102  13.950  35.531 -30.410
  762    HB3  ASP 102           HB3      ASP 102  12.864  34.844 -29.203
  763    H    GLY 103           H        GLY 103  14.513  31.944 -27.978
  764    HA2  GLY 103           HA2      GLY 103  14.553  31.016 -25.852
  765    HA3  GLY 103           HA3      GLY 103  14.754  32.603 -25.109
  766    H    GLN 104           H        GLN 104  12.134  32.416 -27.378
  767    HA   GLN 104           HA       GLN 104  10.072  32.457 -25.277
  768    HB2  GLN 104           HB2      GLN 104   9.891  32.458 -28.309
  769    HB3  GLN 104           HB3      GLN 104   8.519  32.624 -27.209
  770    HG2  GLN 104           HG2      GLN 104   9.410  34.729 -26.343
  771    HG3  GLN 104           HG3      GLN 104  10.885  34.537 -27.302
  772   HE21  GLN 104          HE22      GLN 104  10.917  35.158 -29.441
  773   HE22  GLN 104          HE21      GLN 104   9.521  35.848 -30.257
  774    H    ILE 105           H        ILE 105   8.768  30.756 -24.816
  775    HA   ILE 105           HA       ILE 105   9.339  28.098 -26.064
  776    HB   ILE 105           HB       ILE 105   8.867  28.358 -23.096
  777   HG12  ILE 105          HG12      ILE 105  10.834  29.783 -23.419
  778   HG13  ILE 105          HG13      ILE 105  11.168  28.338 -22.493
  779   HG21  ILE 105          HG21      ILE 105   8.687  26.127 -24.005
  780   HG22  ILE 105          HG22      ILE 105  10.206  26.319 -24.904
  781   HG23  ILE 105          HG23      ILE 105  10.220  26.209 -23.130
  782   HD11  ILE 105          HD11      ILE 105  12.343  27.329 -24.360
  783   HD12  ILE 105          HD12      ILE 105  11.851  28.669 -25.425
  784   HD13  ILE 105          HD13      ILE 105  12.962  28.969 -24.087
  785    H    THR 106           H        THR 106   7.582  26.625 -26.066
  786    HA   THR 106           HA       THR 106   4.918  27.512 -26.138
  787    HB   THR 106           HB       THR 106   4.462  24.996 -25.631
  788    HG1  THR 106           HG1      THR 106   6.536  24.685 -24.674
  789   HG21  THR 106          HG21      THR 106   6.176  25.888 -27.967
  790   HG22  THR 106          HG22      THR 106   5.282  24.346 -27.885
  791   HG23  THR 106          HG23      THR 106   4.402  25.886 -27.890
  792    HA   PRO 107           HA       PRO 107   4.248  27.914 -21.671
  793    HB2  PRO 107           HB2      PRO 107   1.705  28.890 -21.646
  794    HB3  PRO 107           HB3      PRO 107   3.146  29.856 -22.073
  795    HG2  PRO 107           HG2      PRO 107   1.180  28.529 -23.941
  796    HG3  PRO 107           HG3      PRO 107   1.887  30.177 -24.033
  797    HD2  PRO 107           HD2      PRO 107   2.833  28.029 -25.478
  798    HD3  PRO 107           HD3      PRO 107   3.877  29.378 -24.936
  799    H    PHE 108           H        PHE 108   4.440  25.730 -21.235
  800    HA   PHE 108           HA       PHE 108   1.915  24.190 -20.839
  801    HB2  PHE 108           HB2      PHE 108   2.728  22.339 -21.885
  802    HB3  PHE 108           HB3      PHE 108   3.494  23.555 -22.874
  803    HD1  PHE 108           HD1      PHE 108   5.989  24.240 -22.092
  804    HD2  PHE 108           HD2      PHE 108   3.990  20.603 -20.930
  805    HE1  PHE 108           HE1      PHE 108   8.173  23.217 -21.542
  806    HE2  PHE 108           HE2      PHE 108   6.174  19.567 -20.449
  807    HZ   PHE 108           HZ       PHE 108   8.271  20.877 -20.694
  808    H    SER 109           H        SER 109   2.552  22.115 -19.463
  809    HA   SER 109           HA       SER 109   4.672  22.700 -17.514
  810    HB2  SER 109           HB2      SER 109   1.946  21.840 -16.499
  811    HB3  SER 109           HB3      SER 109   3.350  22.336 -15.555
  812    HG   SER 109           HG       SER 109   2.972  24.374 -17.036
  813    H    LEU 110           H        LEU 110   5.534  20.923 -16.542
  814    HA   LEU 110           HA       LEU 110   4.820  18.207 -17.587
  815    HB2  LEU 110           HB2      LEU 110   6.721  18.283 -18.742
  816    HB3  LEU 110           HB3      LEU 110   7.144  19.844 -18.079
  817    HG   LEU 110           HG       LEU 110   8.217  18.597 -16.109
  818   HD11  LEU 110          HD11      LEU 110   8.958  16.292 -16.592
  819   HD12  LEU 110          HD12      LEU 110   7.195  16.322 -16.552
  820   HD13  LEU 110          HD13      LEU 110   8.035  16.284 -18.108
  821   HD21  LEU 110          HD21      LEU 110   9.483  19.678 -17.913
  822   HD22  LEU 110          HD22      LEU 110  10.257  18.170 -17.411
  823   HD23  LEU 110          HD23      LEU 110   9.320  18.226 -18.920
  824    H    LEU 111           H        LEU 111   4.713  16.621 -16.056
  825    HA   LEU 111           HA       LEU 111   5.446  17.293 -13.240
  826    HB2  LEU 111           HB2      LEU 111   3.054  17.516 -13.661
  827    HB3  LEU 111           HB3      LEU 111   2.962  15.905 -14.346
  828    HG   LEU 111           HG       LEU 111   4.038  16.204 -11.555
  829   HD11  LEU 111          HD11      LEU 111   1.080  16.318 -12.220
  830   HD12  LEU 111          HD12      LEU 111   1.780  16.173 -10.591
  831   HD13  LEU 111          HD13      LEU 111   2.055  17.642 -11.538
  832   HD21  LEU 111          HD21      LEU 111   2.916  14.069 -11.175
  833   HD22  LEU 111          HD22      LEU 111   2.087  14.169 -12.742
  834   HD23  LEU 111          HD23      LEU 111   3.834  13.915 -12.670
  835    H    MET 112           H        MET 112   6.226  15.636 -11.968
  836    HA   MET 112           HA       MET 112   7.075  13.121 -13.369
  837    HB2  MET 112           HB2      MET 112   8.622  14.690 -11.263
  838    HB3  MET 112           HB3      MET 112   9.152  13.235 -12.113
  839    HG2  MET 112           HG2      MET 112   9.100  14.515 -14.260
  840    HG3  MET 112           HG3      MET 112   8.659  15.968 -13.361
  841    HE1  MET 112           HE1      MET 112  12.318  16.773 -14.435
  842    HE2  MET 112           HE2      MET 112  11.126  15.854 -15.379
  843    HE3  MET 112           HE3      MET 112  10.620  17.294 -14.463
  844    H    ALA 113           H        ALA 113   6.451  11.306 -12.399
  845    HA   ALA 113           HA       ALA 113   5.614  11.295  -9.533
  846    HB1  ALA 113           HB1      ALA 113   3.676  11.305 -11.033
  847    HB2  ALA 113           HB2      ALA 113   4.334   9.904 -11.910
  848    HB3  ALA 113           HB3      ALA 113   3.836   9.739 -10.212
  849    H    ASN 114           H        ASN 114   6.242   9.552  -8.299
  850    HA   ASN 114           HA       ASN 114   8.506   8.029  -8.868
  851    HB2  ASN 114           HB2      ASN 114   7.427   8.447  -6.640
  852    HB3  ASN 114           HB3      ASN 114   6.162   7.308  -7.049
  853   HD21  ASN 114          HD22      ASN 114   8.651   7.463  -5.069
  854   HD22  ASN 114          HD21      ASN 114   9.237   5.811  -5.204
  855    H    ALA 115           H        ALA 115   8.907   6.346 -10.214
  856    HA   ALA 115           HA       ALA 115   7.039   5.217 -11.975
  857    HB1  ALA 115           HB1      ALA 115   8.898   3.694 -12.565
  858    HB2  ALA 115           HB2      ALA 115   9.458   5.361 -12.372
  859    HB3  ALA 115           HB3      ALA 115   9.762   4.171 -11.086
  860    H    GLY 116           H        GLY 116   7.652   4.164  -8.693
  861    HA2  GLY 116           HA2      GLY 116   6.208   1.562  -9.153
  862    HA3  GLY 116           HA3      GLY 116   7.334   1.914  -7.845
  863    H    THR 117           H        THR 117   6.484   4.265  -6.741
  864    HA   THR 117           HA       THR 117   4.130   3.469  -5.294
  865    HB   THR 117           HB       THR 117   5.321   6.251  -5.250
  866    HG1  THR 117           HG1      THR 117   6.754   5.404  -3.700
  867   HG21  THR 117          HG21      THR 117   3.336   5.902  -3.800
  868   HG22  THR 117          HG22      THR 117   4.137   4.497  -3.057
  869   HG23  THR 117          HG23      THR 117   4.802   6.129  -2.844
  870    H    GLY 118           H        GLY 118   4.532   5.391  -8.204
  871    HA2  GLY 118           HA2      GLY 118   3.006   6.273  -9.630
  872    HA3  GLY 118           HA3      GLY 118   1.726   5.454  -8.724
  873    H    GLU 119           H        GLU 119   3.979   7.941  -7.489
  874    HA   GLU 119           HA       GLU 119   1.701   9.770  -6.928
  875    HB2  GLU 119           HB2      GLU 119   2.206   8.328  -5.027
  876    HB3  GLU 119           HB3      GLU 119   3.914   8.791  -5.083
  877    HG2  GLU 119           HG2      GLU 119   3.350  11.097  -4.568
  878    HG3  GLU 119           HG3      GLU 119   1.622  10.738  -4.663
  879    HA   PRO 120           HA       PRO 120   4.415  12.845  -8.814
  880    HB2  PRO 120           HB2      PRO 120   2.940  14.687  -6.945
  881    HB3  PRO 120           HB3      PRO 120   3.340  14.916  -8.676
  882    HG2  PRO 120           HG2      PRO 120   0.851  14.146  -7.934
  883    HG3  PRO 120           HG3      PRO 120   1.644  13.358  -9.336
  884    HD2  PRO 120           HD2      PRO 120   1.385  12.335  -6.508
  885    HD3  PRO 120           HD3      PRO 120   1.181  11.469  -8.063
  886    H    LEU 121           H        LEU 121   6.345  13.815  -8.377
  887    HA   LEU 121           HA       LEU 121   7.142  14.352  -5.523
  888    HB2  LEU 121           HB2      LEU 121   9.281  14.164  -7.610
  889    HB3  LEU 121           HB3      LEU 121   9.340  13.881  -5.900
  890    HG   LEU 121           HG       LEU 121   9.927  11.906  -7.021
  891   HD11  LEU 121          HD11      LEU 121   8.484  11.648  -5.007
  892   HD12  LEU 121          HD12      LEU 121   7.096  11.406  -6.090
  893   HD13  LEU 121          HD13      LEU 121   8.474  10.283  -6.127
  894   HD21  LEU 121          HD21      LEU 121   8.836  12.548  -9.172
  895   HD22  LEU 121          HD22      LEU 121   8.832  10.824  -8.728
  896   HD23  LEU 121          HD23      LEU 121   7.364  11.800  -8.517
  897    H    LEU 122           H        LEU 122   7.051  15.509  -8.858
  898    HA   LEU 122           HA       LEU 122   7.749  18.272  -8.056
  899    HB2  LEU 122           HB2      LEU 122   9.836  16.705  -8.498
  900    HB3  LEU 122           HB3      LEU 122   9.314  16.732 -10.164
  901    HG   LEU 122           HG       LEU 122   9.484  19.341  -9.972
  902   HD11  LEU 122          HD11      LEU 122  10.921  20.216  -8.242
  903   HD12  LEU 122          HD12      LEU 122   9.647  19.316  -7.424
  904   HD13  LEU 122          HD13      LEU 122  11.242  18.584  -7.595
  905   HD21  LEU 122          HD21      LEU 122  11.070  17.908 -11.199
  906   HD22  LEU 122          HD22      LEU 122  11.874  19.270 -10.417
  907   HD23  LEU 122          HD23      LEU 122  11.987  17.642  -9.702
  908    H    THR 123           H        THR 123   7.368  19.811  -9.689
  909    HA   THR 123           HA       THR 123   6.311  19.000 -12.316
  910    HB   THR 123           HB       THR 123   4.854  21.103 -10.662
  911    HG1  THR 123           HG1      THR 123   4.573  18.347 -10.750
  912   HG21  THR 123          HG21      THR 123   3.116  20.923 -12.291
  913   HG22  THR 123          HG22      THR 123   4.596  21.191 -13.176
  914   HG23  THR 123          HG23      THR 123   3.914  19.550 -13.091
  915    H    LEU 124           H        LEU 124   6.702  20.521 -13.895
  916    HA   LEU 124           HA       LEU 124   8.211  22.985 -13.176
  917    HB2  LEU 124           HB2      LEU 124   8.596  21.080 -15.527
  918    HB3  LEU 124           HB3      LEU 124   9.206  22.727 -15.505
  919    HG   LEU 124           HG       LEU 124  10.629  22.211 -13.534
  920   HD11  LEU 124          HD11      LEU 124  11.109  19.696 -13.208
  921   HD12  LEU 124          HD12      LEU 124   9.676  20.337 -12.433
  922   HD13  LEU 124          HD13      LEU 124   9.526  19.406 -13.947
  923   HD21  LEU 124          HD21      LEU 124  12.278  20.950 -14.835
  924   HD22  LEU 124          HD22      LEU 124  11.007  20.382 -15.941
  925   HD23  LEU 124          HD23      LEU 124  11.442  22.107 -15.870
  926    H    VAL 125           H        VAL 125   7.622  24.837 -14.263
  927    HA   VAL 125           HA       VAL 125   5.083  24.715 -15.861
  928    HB   VAL 125           HB       VAL 125   5.577  26.550 -13.487
  929   HG11  VAL 125          HG11      VAL 125   4.071  27.564 -15.154
  930   HG12  VAL 125          HG12      VAL 125   3.063  26.098 -15.148
  931   HG13  VAL 125          HG13      VAL 125   3.191  27.117 -13.698
  932   HG21  VAL 125          HG21      VAL 125   3.767  24.105 -13.664
  933   HG22  VAL 125          HG22      VAL 125   5.202  24.289 -12.626
  934   HG23  VAL 125          HG23      VAL 125   3.788  25.286 -12.330
  935    H    CYS 126           H        CYS 126   4.923  26.075 -17.548
  936    HA   CYS 126           HA       CYS 126   7.079  28.100 -17.966
  937    HB2  CYS 126           HB2      CYS 126   6.728  26.084 -19.533
  938    HB3  CYS 126           HB3      CYS 126   5.195  26.828 -19.966
  939    HG   CYS 126           HG       CYS 126   6.849  27.301 -21.884
  940    H    SER 127           H        SER 127   6.531  30.070 -19.020
  941    HA   SER 127           HA       SER 127   3.713  31.051 -18.809
  942    HB2  SER 127           HB2      SER 127   4.623  33.170 -17.935
  943    HB3  SER 127           HB3      SER 127   5.011  31.803 -16.876
  944    HG   SER 127           HG       SER 127   6.832  33.152 -17.260
  945    H    GLY 128           H        GLY 128   6.040  30.386 -21.016
  946    HA2  GLY 128           HA2      GLY 128   5.491  31.053 -23.330
  947    HA3  GLY 128           HA3      GLY 128   5.391  32.723 -22.788
  948    H    SER 129           H        SER 129   7.969  31.701 -21.065
  949    HA   SER 129           HA       SER 129  10.037  31.885 -23.148
  950    HB2  SER 129           HB2      SER 129  11.006  33.951 -22.271
  951    HB3  SER 129           HB3      SER 129   9.369  34.217 -22.885
  952    HG   SER 129           HG       SER 129   9.699  35.225 -20.855
  953    H    TRP 130           H        TRP 130  12.162  31.718 -22.427
  954    HA   TRP 130           HA       TRP 130  12.735  29.710 -20.634
  955    HB2  TRP 130           HB2      TRP 130  14.145  30.240 -22.449
  956    HB3  TRP 130           HB3      TRP 130  14.305  31.917 -21.973
  957    HD1  TRP 130           HD1      TRP 130  16.306  32.618 -20.614
  958    HE1  TRP 130           HE1      TRP 130  18.253  31.455 -19.416
  959    HE3  TRP 130           HE3      TRP 130  14.773  27.758 -21.124
  960    HZ2  TRP 130           HZ2      TRP 130  19.047  28.754 -18.754
  961    HZ3  TRP 130           HZ3      TRP 130  16.120  25.925 -20.119
  962    HH2  TRP 130           HH2      TRP 130  18.242  26.413 -18.953
  963    HA   PRO 131           HA       PRO 131  13.423  28.589 -19.135
  964    HB2  PRO 131           HB2      PRO 131  14.295  27.684 -16.783
  965    HB3  PRO 131           HB3      PRO 131  15.412  28.555 -17.865
  966    HG2  PRO 131           HG2      PRO 131  13.937  29.634 -15.465
  967    HG3  PRO 131           HG3      PRO 131  15.664  29.824 -15.912
  968    HD2  PRO 131           HD2      PRO 131  13.656  31.696 -16.503
  969    HD3  PRO 131           HD3      PRO 131  15.172  31.523 -17.431
  970    H    LEU 132           H        LEU 132  12.272  26.758 -17.794
  971    HA   LEU 132           HA       LEU 132   9.640  27.627 -16.866
  972    HB2  LEU 132           HB2      LEU 132  11.047  24.938 -17.137
  973    HB3  LEU 132           HB3      LEU 132   9.620  25.115 -16.131
  974    HG   LEU 132           HG       LEU 132   8.443  26.163 -18.128
  975   HD11  LEU 132          HD11      LEU 132  10.352  26.551 -19.621
  976   HD12  LEU 132          HD12      LEU 132  10.696  24.804 -19.636
  977   HD13  LEU 132          HD13      LEU 132   9.202  25.436 -20.357
  978   HD21  LEU 132          HD21      LEU 132   9.236  23.231 -18.240
  979   HD22  LEU 132          HD22      LEU 132   7.914  23.932 -17.286
  980   HD23  LEU 132          HD23      LEU 132   7.830  23.962 -19.043
  981    H    ASP 133           H        ASP 133   8.830  27.170 -14.829
  982    HA   ASP 133           HA       ASP 133  10.601  27.701 -12.510
  983    HB2  ASP 133           HB2      ASP 133   8.456  28.926 -12.751
  984    HB3  ASP 133           HB3      ASP 133   7.585  27.394 -12.827
  985    H    GLN 134           H        GLN 134  10.120  26.223 -10.573
  986    HA   GLN 134           HA       GLN 134   9.606  23.385 -11.242
  987    HB2  GLN 134           HB2      GLN 134  11.999  23.817 -11.688
  988    HB3  GLN 134           HB3      GLN 134  12.209  24.434 -10.043
  989    HG2  GLN 134           HG2      GLN 134  11.627  22.225  -9.127
  990    HG3  GLN 134           HG3      GLN 134  11.350  21.594 -10.757
  991   HE21  GLN 134          HE22      GLN 134  13.245  20.469  -8.859
  992   HE22  GLN 134          HE21      GLN 134  14.836  20.704  -9.577
  993    H    THR 135           H        THR 135   8.493  22.417  -9.638
  994    HA   THR 135           HA       THR 135   8.463  23.463  -6.852
  995    HB   THR 135           HB       THR 135   6.867  24.795  -8.213
  996    HG1  THR 135           HG1      THR 135   6.438  24.503  -6.053
  997   HG21  THR 135          HG21      THR 135   4.724  23.841  -8.916
  998   HG22  THR 135          HG22      THR 135   6.052  23.134  -9.838
  999   HG23  THR 135          HG23      THR 135   5.287  22.209  -8.519
 1000    H    LEU 136           H        LEU 136   7.100  22.091  -5.407
 1001    HA   LEU 136           HA       LEU 136   7.206  19.205  -6.118
 1002    HB2  LEU 136           HB2      LEU 136   6.609  20.765  -3.579
 1003    HB3  LEU 136           HB3      LEU 136   6.159  19.074  -3.755
 1004    HG   LEU 136           HG       LEU 136   8.498  18.420  -4.126
 1005   HD11  LEU 136          HD11      LEU 136   9.154  21.343  -3.576
 1006   HD12  LEU 136          HD12      LEU 136  10.331  20.011  -3.542
 1007   HD13  LEU 136          HD13      LEU 136   9.526  20.422  -5.054
 1008   HD21  LEU 136          HD21      LEU 136   7.514  18.417  -1.865
 1009   HD22  LEU 136          HD22      LEU 136   9.247  18.772  -1.816
 1010   HD23  LEU 136          HD23      LEU 136   8.068  20.089  -1.618
 1011    H    ALA 137           H        ALA 137   5.451  18.135  -6.839
 1012    HA   ALA 137           HA       ALA 137   3.380  17.893  -7.852
 1013    HB1  ALA 137           HB1      ALA 137   3.473  16.755  -5.671
 1014    HB2  ALA 137           HB2      ALA 137   2.761  18.182  -4.889
 1015    HB3  ALA 137           HB3      ALA 137   1.820  17.254  -6.079
 1016    H    ARG 138           H        ARG 138   3.561  20.078  -8.902
 1017    HA   ARG 138           HA       ARG 138   2.763  22.036  -9.685
 1018    HB2  ARG 138           HB2      ARG 138   0.035  21.140  -8.716
 1019    HB3  ARG 138           HB3      ARG 138   0.432  22.184 -10.070
 1020    HG2  ARG 138           HG2      ARG 138   1.617  20.062 -11.065
 1021    HG3  ARG 138           HG3      ARG 138   0.655  19.173  -9.880
 1022    HD2  ARG 138           HD2      ARG 138  -1.407  20.287 -10.781
 1023    HD3  ARG 138           HD3      ARG 138  -0.398  21.175 -11.922
 1024    HE   ARG 138           HE       ARG 138  -0.310  19.360 -13.327
 1025   HH11  ARG 138          HH11      ARG 138  -1.583  18.133 -10.289
 1026   HH12  ARG 138          HH12      ARG 138  -2.164  16.683 -11.051
 1027   HH21  ARG 138          HH21      ARG 138  -1.108  17.611 -14.197
 1028   HH22  ARG 138          HH22      ARG 138  -1.880  16.368 -13.230
 1029    H    ASP 139           H        ASP 139   3.243  22.137  -6.513
 1030    HA   ASP 139           HA       ASP 139   1.298  23.754  -5.418
 1031    HB2  ASP 139           HB2      ASP 139   3.027  22.579  -4.164
 1032    HB3  ASP 139           HB3      ASP 139   4.242  23.727  -4.718
 1033    H    THR 140           H        THR 140   4.031  25.070  -7.319
 1034    HA   THR 140           HA       THR 140   3.247  27.850  -6.778
 1035    HB   THR 140           HB       THR 140   4.831  28.436  -8.593
 1036    HG1  THR 140           HG1      THR 140   5.979  26.911  -9.582
 1037   HG21  THR 140          HG21      THR 140   5.736  28.285  -6.369
 1038   HG22  THR 140          HG22      THR 140   5.921  26.529  -6.501
 1039   HG23  THR 140          HG23      THR 140   6.900  27.603  -7.522
 1040    H    ARG 141           H        ARG 141   1.933  25.506  -8.937
 1041    HA   ARG 141           HA       ARG 141   1.679  27.098 -11.280
 1042    HB2  ARG 141           HB2      ARG 141   1.596  24.550 -11.000
 1043    HB3  ARG 141           HB3      ARG 141  -0.105  24.742 -10.549
 1044    HG2  ARG 141           HG2      ARG 141  -0.550  25.813 -12.757
 1045    HG3  ARG 141           HG3      ARG 141   1.177  25.698 -13.147
 1046    HD2  ARG 141           HD2      ARG 141   0.954  23.172 -12.827
 1047    HD3  ARG 141           HD3      ARG 141  -0.797  23.412 -12.803
 1048    HE   ARG 141           HE       ARG 141   1.089  23.867 -15.082
 1049   HH11  ARG 141          HH21      ARG 141  -2.297  23.917 -14.139
 1050   HH12  ARG 141          HH22      ARG 141  -2.813  24.007 -15.796
 1051   HH21  ARG 141          HH11      ARG 141   0.401  23.997 -17.050
 1052   HH22  ARG 141          HH12      ARG 141  -1.308  24.073 -17.438
 1053    HA   PRO 142           HA       PRO 142  -1.808  29.674 -10.096
 1054    HB2  PRO 142           HB2      PRO 142  -2.586  30.648 -12.550
 1055    HB3  PRO 142           HB3      PRO 142  -1.135  31.197 -11.659
 1056    HG2  PRO 142           HG2      PRO 142  -1.289  29.141 -13.881
 1057    HG3  PRO 142           HG3      PRO 142  -0.143  30.509 -13.712
 1058    HD2  PRO 142           HD2      PRO 142   0.529  27.990 -12.977
 1059    HD3  PRO 142           HD3      PRO 142   1.077  29.397 -12.022
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1  10.004   2.147   4.806
    2    H2   MET   1           H2       MET   1   8.594   1.945   5.608
    3    H3   MET   1           H3       MET   1   9.777   0.821   5.731
    4    HA   MET   1           HA       MET   1   9.574   0.251   3.404
    5    HB2  MET   1           HB2      MET   1   8.212  -0.928   5.178
    6    HB3  MET   1           HB3      MET   1   6.850   0.108   4.780
    7    HG2  MET   1           HG2      MET   1   8.284  -1.774   2.858
    8    HG3  MET   1           HG3      MET   1   6.836  -2.182   3.757
    9    HE1  MET   1           HE1      MET   1   4.028  -0.090   2.014
   10    HE2  MET   1           HE2      MET   1   4.414  -1.284   3.272
   11    HE3  MET   1           HE3      MET   1   4.930   0.410   3.456
   12    H    ALA   2           H        ALA   2   9.217   1.045   1.411
   13    HA   ALA   2           HA       ALA   2   6.823   2.665   0.867
   14    HB1  ALA   2           HB1      ALA   2   8.114   4.374  -0.372
   15    HB2  ALA   2           HB2      ALA   2   8.567   4.362   1.341
   16    HB3  ALA   2           HB3      ALA   2   9.636   3.611   0.135
   17    H    TYR   3           H        TYR   3   6.048   2.391  -1.200
   18    HA   TYR   3           HA       TYR   3   6.755   0.014  -2.599
   19    HB2  TYR   3           HB2      TYR   3   5.061   2.322  -3.591
   20    HB3  TYR   3           HB3      TYR   3   5.000   0.656  -4.147
   21    HD1  TYR   3           HD2      TYR   3   4.398  -1.167  -2.361
   22    HD2  TYR   3           HD1      TYR   3   3.603   3.047  -1.871
   23    HE1  TYR   3           HE2      TYR   3   2.688  -1.693  -0.629
   24    HE2  TYR   3           HE1      TYR   3   1.895   2.518  -0.134
   25    HH   TYR   3           HH       TYR   3   1.141  -0.847   0.835
   26    H    GLY   4           H        GLY   4   8.039   3.196  -2.936
   27    HA2  GLY   4           HA2      GLY   4   9.975   2.284  -4.911
   28    HA3  GLY   4           HA3      GLY   4   9.014   3.672  -5.441
   29    H    ARG   5           H        ARG   5  11.791   3.795  -5.020
   30    HA   ARG   5           HA       ARG   5  12.547   4.468  -2.292
   31    HB2  ARG   5           HB2      ARG   5  14.115   4.875  -4.853
   32    HB3  ARG   5           HB3      ARG   5  14.760   4.838  -3.212
   33    HG2  ARG   5           HG2      ARG   5  14.128   2.437  -3.042
   34    HG3  ARG   5           HG3      ARG   5  13.475   2.504  -4.693
   35    HD2  ARG   5           HD2      ARG   5  15.770   3.273  -5.481
   36    HD3  ARG   5           HD3      ARG   5  16.365   2.936  -3.857
   37    HE   ARG   5           HE       ARG   5  16.232   0.645  -4.262
   38   HH11  ARG   5          HH22      ARG   5  14.656   2.274  -6.998
   39   HH12  ARG   5          HH21      ARG   5  14.609   0.781  -7.900
   40   HH21  ARG   5          HH11      ARG   5  16.104  -1.161  -5.519
   41   HH22  ARG   5          HH12      ARG   5  15.392  -1.081  -7.100
   42    H    GLU   6           H        GLU   6  11.042   6.210  -1.858
   43    HA   GLU   6           HA       GLU   6  10.773   8.556  -3.243
   44    HB2  GLU   6           HB2      GLU   6   9.942   9.596  -1.228
   45    HB3  GLU   6           HB3      GLU   6   9.366   7.938  -1.376
   46    HG2  GLU   6           HG2      GLU   6  11.047   7.190   0.290
   47    HG3  GLU   6           HG3      GLU   6  11.653   8.841   0.432
   48    H    ASP   7           H        ASP   7  13.574   7.951  -1.104
   49    HA   ASP   7           HA       ASP   7  14.517  10.699  -1.207
   50    HB2  ASP   7           HB2      ASP   7  16.483   9.843  -0.120
   51    HB3  ASP   7           HB3      ASP   7  15.047   9.185   0.653
   52    H    VAL   8           H        VAL   8  15.163   7.764  -3.084
   53    HA   VAL   8           HA       VAL   8  17.188   8.986  -4.814
   54    HB   VAL   8           HB       VAL   8  15.455   6.544  -5.319
   55   HG11  VAL   8          HG11      VAL   8  16.364   7.418  -7.430
   56   HG12  VAL   8          HG12      VAL   8  17.988   7.505  -6.715
   57   HG13  VAL   8          HG13      VAL   8  17.199   5.934  -6.978
   58   HG21  VAL   8          HG21      VAL   8  17.485   5.252  -4.712
   59   HG22  VAL   8          HG22      VAL   8  18.310   6.762  -4.274
   60   HG23  VAL   8          HG23      VAL   8  16.900   6.207  -3.347
   61    H    ALA   9           H        ALA   9  13.614   8.534  -4.958
   62    HA   ALA   9           HA       ALA   9  13.268   9.790  -7.489
   63    HB1  ALA   9           HB1      ALA   9  10.944  10.004  -6.868
   64    HB2  ALA   9           HB2      ALA   9  11.544   8.436  -6.304
   65    HB3  ALA   9           HB3      ALA   9  11.323   9.771  -5.150
   66    H    ASN  10           H        ASN  10  13.246  11.337  -4.180
   67    HA   ASN  10           HA       ASN  10  12.948  14.021  -5.124
   68    HB2  ASN  10           HB2      ASN  10  14.116  12.734  -2.646
   69    HB3  ASN  10           HB3      ASN  10  14.488  14.422  -2.958
   70   HD21  ASN  10          HD22      ASN  10  12.569  15.908  -3.420
   71   HD22  ASN  10          HD21      ASN  10  11.138  15.580  -2.466
   72    H    THR  11           H        THR  11  15.939  12.135  -4.662
   73    HA   THR  11           HA       THR  11  17.754  14.158  -5.524
   74    HB   THR  11           HB       THR  11  18.028  11.134  -5.796
   75    HG1  THR  11           HG1      THR  11  17.651  11.606  -3.691
   76   HG21  THR  11          HG21      THR  11  20.127  13.344  -5.631
   77   HG22  THR  11          HG22      THR  11  20.461  11.599  -5.561
   78   HG23  THR  11          HG23      THR  11  19.801  12.308  -7.040
   79    H    ARG  12           H        ARG  12  16.440  11.408  -7.444
   80    HA   ARG  12           HA       ARG  12  17.525  12.268  -9.952
   81    HB2  ARG  12           HB2      ARG  12  15.288  10.340  -9.164
   82    HB3  ARG  12           HB3      ARG  12  15.628  10.687 -10.848
   83    HG2  ARG  12           HG2      ARG  12  17.683   9.539  -8.911
   84    HG3  ARG  12           HG3      ARG  12  16.721   8.620 -10.083
   85    HD2  ARG  12           HD2      ARG  12  17.676  10.140 -11.902
   86    HD3  ARG  12           HD3      ARG  12  18.800  10.758 -10.680
   87    HE   ARG  12           HE       ARG  12  18.979   7.888 -10.753
   88   HH11  ARG  12          HH11      ARG  12  19.979  10.700 -12.653
   89   HH12  ARG  12          HH12      ARG  12  21.261   9.774 -13.406
   90   HH21  ARG  12          HH21      ARG  12  20.535   6.878 -11.680
   91   HH22  ARG  12          HH22      ARG  12  21.604   7.637 -12.864
   92    H    ALA  13           H        ALA  13  14.341  13.070  -8.466
   93    HA   ALA  13           HA       ALA  13  13.225  14.252 -10.791
   94    HB1  ALA  13           HB1      ALA  13  11.927  13.736  -8.793
   95    HB2  ALA  13           HB2      ALA  13  12.823  14.963  -7.862
   96    HB3  ALA  13           HB3      ALA  13  11.788  15.436  -9.229
   97    H    ARG  14           H        ARG  14  15.081  15.844  -8.157
   98    HA   ARG  14           HA       ARG  14  15.186  18.440  -9.420
   99    HB2  ARG  14           HB2      ARG  14  16.977  17.156  -7.302
  100    HB3  ARG  14           HB3      ARG  14  16.980  18.873  -7.738
  101    HG2  ARG  14           HG2      ARG  14  14.615  19.080  -7.040
  102    HG3  ARG  14           HG3      ARG  14  14.561  17.357  -6.648
  103    HD2  ARG  14           HD2      ARG  14  14.830  18.614  -4.600
  104    HD3  ARG  14           HD3      ARG  14  16.273  17.656  -4.913
  105    HE   ARG  14           HE       ARG  14  17.532  19.592  -5.184
  106   HH11  ARG  14          HH11      ARG  14  14.170  20.582  -5.048
  107   HH12  ARG  14          HH12      ARG  14  14.588  22.267  -4.936
  108   HH21  ARG  14          HH21      ARG  14  17.973  21.753  -5.043
  109   HH22  ARG  14          HH22      ARG  14  16.677  22.902  -4.929
  110    H    GLU  15           H        GLU  15  17.469  15.730  -9.410
  111    HA   GLU  15           HA       GLU  15  19.509  16.897 -11.020
  112    HB2  GLU  15           HB2      GLU  15  19.705  14.911  -9.585
  113    HB3  GLU  15           HB3      GLU  15  18.562  14.028 -10.582
  114    HG2  GLU  15           HG2      GLU  15  21.280  14.949 -11.564
  115    HG3  GLU  15           HG3      GLU  15  20.963  13.406 -10.749
  116    H    THR  16           H        THR  16  16.848  14.729 -12.069
  117    HA   THR  16           HA       THR  16  17.379  14.878 -14.856
  118    HB   THR  16           HB       THR  16  14.765  14.352 -13.386
  119    HG1  THR  16           HG1      THR  16  16.192  12.885 -12.803
  120   HG21  THR  16          HG21      THR  16  14.182  12.964 -15.354
  121   HG22  THR  16          HG22      THR  16  14.205  14.704 -15.702
  122   HG23  THR  16          HG23      THR  16  15.559  13.685 -16.241
  123    H    ALA  17           H        ALA  17  15.383  16.972 -12.767
  124    HA   ALA  17           HA       ALA  17  14.394  18.621 -14.871
  125    HB1  ALA  17           HB1      ALA  17  13.890  20.214 -13.037
  126    HB2  ALA  17           HB2      ALA  17  13.381  18.557 -12.644
  127    HB3  ALA  17           HB3      ALA  17  14.860  19.228 -11.926
  128    H    ALA  18           H        ALA  18  17.344  19.035 -12.821
  129    HA   ALA  18           HA       ALA  18  18.254  21.416 -14.128
  130    HB1  ALA  18           HB1      ALA  18  20.427  20.829 -13.132
  131    HB2  ALA  18           HB2      ALA  18  19.114  20.598 -11.959
  132    HB3  ALA  18           HB3      ALA  18  19.844  19.193 -12.767
  133    H    ARG  19           H        ARG  19  18.864  17.955 -14.842
  134    HA   ARG  19           HA       ARG  19  20.624  18.316 -17.048
  135    HB2  ARG  19           HB2      ARG  19  19.770  16.164 -15.643
  136    HB3  ARG  19           HB3      ARG  19  18.701  15.990 -17.030
  137    HG2  ARG  19           HG2      ARG  19  20.931  16.271 -18.428
  138    HG3  ARG  19           HG3      ARG  19  21.735  15.965 -16.886
  139    HD2  ARG  19           HD2      ARG  19  19.961  14.141 -18.513
  140    HD3  ARG  19           HD3      ARG  19  21.633  13.877 -18.014
  141    HE   ARG  19           HE       ARG  19  20.363  13.945 -15.583
  142   HH11  ARG  19          HH11      ARG  19  19.663  12.003 -18.456
  143   HH12  ARG  19          HH12      ARG  19  18.771  10.852 -17.469
  144   HH21  ARG  19          HH21      ARG  19  19.251  12.390 -14.505
  145   HH22  ARG  19          HH22      ARG  19  18.467  11.104 -15.431
  146    H    PHE  20           H        PHE  20  17.050  17.927 -17.066
  147    HA   PHE  20           HA       PHE  20  16.710  18.359 -19.868
  148    HB2  PHE  20           HB2      PHE  20  14.931  17.406 -18.578
  149    HB3  PHE  20           HB3      PHE  20  14.893  18.787 -17.486
  150    HD1  PHE  20           HD2      PHE  20  14.900  18.620 -21.284
  151    HD2  PHE  20           HD1      PHE  20  12.821  19.839 -17.698
  152    HE1  PHE  20           HE2      PHE  20  13.205  19.789 -22.650
  153    HE2  PHE  20           HE1      PHE  20  11.110  20.981 -19.086
  154    HZ   PHE  20           HZ       PHE  20  11.301  20.961 -21.567
  155    H    THR  21           H        THR  21  16.772  20.746 -17.155
  156    HA   THR  21           HA       THR  21  16.250  23.039 -18.756
  157    HB   THR  21           HB       THR  21  17.991  22.922 -16.264
  158    HG1  THR  21           HG1      THR  21  15.971  22.074 -15.859
  159   HG21  THR  21          HG21      THR  21  16.441  25.208 -17.576
  160   HG22  THR  21          HG22      THR  21  17.100  25.263 -15.932
  161   HG23  THR  21          HG23      THR  21  18.198  25.111 -17.305
  162    H    ALA  22           H        ALA  22  19.437  21.454 -18.073
  163    HA   ALA  22           HA       ALA  22  20.942  23.251 -19.717
  164    HB1  ALA  22           HB1      ALA  22  21.936  21.736 -18.036
  165    HB2  ALA  22           HB2      ALA  22  21.472  20.329 -19.018
  166    HB3  ALA  22           HB3      ALA  22  22.662  21.492 -19.637
  167    H    ALA  23           H        ALA  23  19.273  20.200 -20.571
  168    HA   ALA  23           HA       ALA  23  20.067  20.184 -23.331
  169    HB1  ALA  23           HB1      ALA  23  18.285  18.551 -23.614
  170    HB2  ALA  23           HB2      ALA  23  19.177  18.227 -22.115
  171    HB3  ALA  23           HB3      ALA  23  17.574  19.003 -22.052
  172    H    LEU  24           H        LEU  24  17.373  21.834 -21.683
  173    HA   LEU  24           HA       LEU  24  16.154  22.851 -24.087
  174    HB2  LEU  24           HB2      LEU  24  15.010  22.554 -21.912
  175    HB3  LEU  24           HB3      LEU  24  16.037  23.781 -21.198
  176    HG   LEU  24           HG       LEU  24  15.051  25.473 -22.804
  177   HD11  LEU  24          HD11      LEU  24  12.924  24.865 -23.931
  178   HD12  LEU  24          HD12      LEU  24  14.279  23.929 -24.575
  179   HD13  LEU  24          HD13      LEU  24  13.140  23.172 -23.441
  180   HD21  LEU  24          HD21      LEU  24  12.891  25.622 -21.629
  181   HD22  LEU  24          HD22      LEU  24  13.071  23.942 -21.071
  182   HD23  LEU  24          HD23      LEU  24  14.189  25.198 -20.497
  183    H    GLU  25           H        GLU  25  18.733  24.118 -21.932
  184    HA   GLU  25           HA       GLU  25  19.104  26.625 -23.280
  185    HB2  GLU  25           HB2      GLU  25  20.164  25.857 -21.070
  186    HB3  GLU  25           HB3      GLU  25  21.324  24.959 -22.039
  187    HG2  GLU  25           HG2      GLU  25  21.983  27.073 -23.189
  188    HG3  GLU  25           HG3      GLU  25  20.820  27.958 -22.200
  189    H    LEU  26           H        LEU  26  20.626  23.430 -23.836
  190    HA   LEU  26           HA       LEU  26  22.098  23.970 -26.194
  191    HB2  LEU  26           HB2      LEU  26  22.398  21.918 -25.031
  192    HB3  LEU  26           HB3      LEU  26  20.688  21.577 -25.028
  193    HG   LEU  26           HG       LEU  26  20.787  21.196 -27.534
  194   HD11  LEU  26          HD11      LEU  26  23.780  21.267 -26.956
  195   HD12  LEU  26          HD12      LEU  26  23.034  20.645 -28.439
  196   HD13  LEU  26          HD13      LEU  26  22.886  22.367 -28.032
  197   HD21  LEU  26          HD21      LEU  26  20.666  19.403 -25.902
  198   HD22  LEU  26          HD22      LEU  26  21.718  18.945 -27.252
  199   HD23  LEU  26          HD23      LEU  26  22.435  19.429 -25.697
  200    H    ALA  27           H        ALA  27  18.689  22.926 -25.918
  201    HA   ALA  27           HA       ALA  27  18.050  23.015 -28.654
  202    HB1  ALA  27           HB1      ALA  27  15.707  23.229 -27.890
  203    HB2  ALA  27           HB2      ALA  27  16.602  22.017 -26.945
  204    HB3  ALA  27           HB3      ALA  27  16.265  23.621 -26.262
  205    H    ILE  28           H        ILE  28  17.856  25.759 -26.313
  206    HA   ILE  28           HA       ILE  28  16.954  27.723 -28.225
  207    HB   ILE  28           HB       ILE  28  18.535  28.004 -25.641
  208   HG12  ILE  28          HG12      ILE  28  15.607  28.697 -26.072
  209   HG13  ILE  28          HG13      ILE  28  16.079  27.050 -25.670
  210   HG21  ILE  28          HG21      ILE  28  17.172  30.153 -27.332
  211   HG22  ILE  28          HG22      ILE  28  17.766  30.403 -25.678
  212   HG23  ILE  28          HG23      ILE  28  18.905  30.032 -26.964
  213   HD11  ILE  28          HD11      ILE  28  17.218  27.880 -23.617
  214   HD12  ILE  28          HD12      ILE  28  16.560  29.498 -23.958
  215   HD13  ILE  28          HD13      ILE  28  15.466  28.125 -23.662
  216    H    ASP  29           H        ASP  29  20.261  26.833 -27.146
  217    HA   ASP  29           HA       ASP  29  21.672  28.636 -28.812
  218    HB2  ASP  29           HB2      ASP  29  22.616  27.375 -26.895
  219    HB3  ASP  29           HB3      ASP  29  22.505  25.882 -27.825
  220    H    ARG  30           H        ARG  30  20.308  25.460 -29.595
  221    HA   ARG  30           HA       ARG  30  21.398  25.460 -32.341
  222    HB2  ARG  30           HB2      ARG  30  19.446  23.709 -30.790
  223    HB3  ARG  30           HB3      ARG  30  19.685  23.518 -32.537
  224    HG2  ARG  30           HG2      ARG  30  22.077  23.140 -32.227
  225    HG3  ARG  30           HG3      ARG  30  21.933  23.374 -30.476
  226    HD2  ARG  30           HD2      ARG  30  20.593  21.402 -30.221
  227    HD3  ARG  30           HD3      ARG  30  20.339  21.250 -31.958
  228    HE   ARG  30           HE       ARG  30  22.784  20.531 -30.449
  229   HH11  ARG  30          HH11      ARG  30  21.418  20.869 -33.706
  230   HH12  ARG  30          HH12      ARG  30  22.698  19.835 -34.351
  231   HH21  ARG  30          HH21      ARG  30  24.358  19.278 -31.531
  232   HH22  ARG  30          HH22      ARG  30  24.154  19.068 -33.272
  233    H    ALA  31           H        ALA  31  18.266  26.386 -30.903
  234    HA   ALA  31           HA       ALA  31  16.869  26.552 -33.393
  235    HB1  ALA  31           HB1      ALA  31  15.182  27.796 -32.083
  236    HB2  ALA  31           HB2      ALA  31  15.769  26.403 -31.163
  237    HB3  ALA  31           HB3      ALA  31  16.350  28.033 -30.765
  238    H    THR  32           H        THR  32  18.851  29.017 -31.736
  239    HA   THR  32           HA       THR  32  18.101  31.139 -33.581
  240    HB   THR  32           HB       THR  32  19.011  31.484 -31.280
  241    HG1  THR  32           HG1      THR  32  20.087  33.324 -31.899
  242   HG21  THR  32          HG21      THR  32  21.725  31.031 -32.591
  243   HG22  THR  32          HG22      THR  32  21.411  31.572 -30.928
  244   HG23  THR  32          HG23      THR  32  20.970  29.930 -31.411
  245    H    LEU  33           H        LEU  33  20.270  28.438 -33.872
  246    HA   LEU  33           HA       LEU  33  21.797  29.673 -36.053
  247    HB2  LEU  33           HB2      LEU  33  22.147  27.099 -34.481
  248    HB3  LEU  33           HB3      LEU  33  23.252  27.665 -35.737
  249    HG   LEU  33           HG       LEU  33  22.702  28.995 -33.062
  250   HD11  LEU  33          HD11      LEU  33  25.199  27.651 -34.188
  251   HD12  LEU  33          HD12      LEU  33  25.039  28.406 -32.584
  252   HD13  LEU  33          HD13      LEU  33  24.100  26.959 -32.973
  253   HD21  LEU  33          HD21      LEU  33  24.591  29.854 -35.301
  254   HD22  LEU  33          HD22      LEU  33  23.185  30.762 -34.699
  255   HD23  LEU  33          HD23      LEU  33  24.586  30.524 -33.655
  256    H    SER  34           H        SER  34  19.516  27.041 -35.508
  257    HA   SER  34           HA       SER  34  20.154  25.615 -37.938
  258    HB2  SER  34           HB2      SER  34  17.776  25.258 -36.081
  259    HB3  SER  34           HB3      SER  34  18.377  24.102 -37.291
  260    HG   SER  34           HG       SER  34  19.692  25.021 -34.953
  261    H    GLY  35           H        GLY  35  18.000  28.274 -37.460
  262    HA2  GLY  35           HA2      GLY  35  16.899  29.468 -39.138
  263    HA3  GLY  35           HA3      GLY  35  17.211  28.165 -40.284
  264    H    GLN  36           H        GLN  36  15.861  26.639 -37.758
  265    HA   GLN  36           HA       GLN  36  13.023  27.311 -38.074
  266    HB2  GLN  36           HB2      GLN  36  13.280  25.518 -39.691
  267    HB3  GLN  36           HB3      GLN  36  14.252  24.579 -38.591
  268    HG2  GLN  36           HG2      GLN  36  12.132  24.408 -37.103
  269    HG3  GLN  36           HG3      GLN  36  11.254  25.061 -38.487
  270   HE21  GLN  36          HE22      GLN  36  12.109  22.212 -36.911
  271   HE22  GLN  36          HE21      GLN  36  12.022  21.133 -38.301
  272    HA   PRO  37           HA       PRO  37  13.158  26.787 -33.568
  273    HB2  PRO  37           HB2      PRO  37  10.665  25.161 -34.188
  274    HB3  PRO  37           HB3      PRO  37  10.944  26.273 -32.814
  275    HG2  PRO  37           HG2      PRO  37   9.596  27.190 -34.932
  276    HG3  PRO  37           HG3      PRO  37  10.940  28.184 -34.271
  277    HD2  PRO  37           HD2      PRO  37  10.952  26.390 -36.681
  278    HD3  PRO  37           HD3      PRO  37  11.660  28.019 -36.480
  279    H    VAL  38           H        VAL  38  13.130  25.141 -31.883
  280    HA   VAL  38           HA       VAL  38  13.891  22.349 -32.699
  281    HB   VAL  38           HB       VAL  38  15.183  24.093 -30.564
  282   HG11  VAL  38          HG11      VAL  38  15.133  21.818 -29.678
  283   HG12  VAL  38          HG12      VAL  38  15.683  21.164 -31.233
  284   HG13  VAL  38          HG13      VAL  38  16.761  22.163 -30.256
  285   HG21  VAL  38          HG21      VAL  38  16.347  22.793 -33.074
  286   HG22  VAL  38          HG22      VAL  38  15.985  24.514 -32.898
  287   HG23  VAL  38          HG23      VAL  38  17.229  23.782 -31.889
  288    H    GLY  39           H        GLY  39  13.322  20.712 -30.884
  289    HA2  GLY  39           HA2      GLY  39  11.539  21.699 -28.777
  290    HA3  GLY  39           HA3      GLY  39  10.680  20.958 -30.110
  291    H    ILE  40           H        ILE  40  10.046  19.753 -28.025
  292    HA   ILE  40           HA       ILE  40  11.796  17.341 -27.679
  293    HB   ILE  40           HB       ILE  40  10.123  18.585 -25.477
  294   HG12  ILE  40          HG12      ILE  40  12.705  18.818 -24.592
  295   HG13  ILE  40          HG13      ILE  40  12.956  19.124 -26.299
  296   HG21  ILE  40          HG21      ILE  40  11.370  17.027 -24.025
  297   HG22  ILE  40          HG22      ILE  40  10.484  16.140 -25.257
  298   HG23  ILE  40          HG23      ILE  40  12.239  16.386 -25.428
  299   HD11  ILE  40          HD11      ILE  40  11.034  20.615 -24.453
  300   HD12  ILE  40          HD12      ILE  40  12.599  21.202 -25.038
  301   HD13  ILE  40          HD13      ILE  40  11.260  20.975 -26.181
  302    H    HIS  41           H        HIS  41  10.901  15.528 -28.215
  303    HA   HIS  41           HA       HIS  41   8.032  15.279 -28.819
  304    HB2  HIS  41           HB2      HIS  41   9.701  14.524 -30.406
  305    HB3  HIS  41           HB3      HIS  41  10.440  13.467 -29.210
  306    HD1  HIS  41           HD1      HIS  41  10.043  11.245 -30.541
  307    HD2  HIS  41           HD2      HIS  41   6.568  13.509 -29.846
  308    HE1  HIS  41           HE1      HIS  41   8.080   9.782 -31.245
  309    H    PHE  42           H        PHE  42   7.611  15.663 -26.425
  310    HA   PHE  42           HA       PHE  42   7.874  13.511 -24.529
  311    HB2  PHE  42           HB2      PHE  42   5.874  15.778 -24.848
  312    HB3  PHE  42           HB3      PHE  42   5.777  14.603 -23.551
  313    HD1  PHE  42           HD2      PHE  42   7.512  14.442 -21.804
  314    HD2  PHE  42           HD1      PHE  42   7.583  17.583 -24.767
  315    HE1  PHE  42           HE2      PHE  42   9.062  15.747 -20.385
  316    HE2  PHE  42           HE1      PHE  42   9.114  18.894 -23.321
  317    HZ   PHE  42           HZ       PHE  42   9.868  17.979 -21.142
  318    H    SER  43           H        SER  43   7.114  11.504 -24.703
  319    HA   SER  43           HA       SER  43   4.604  10.948 -26.220
  320    HB2  SER  43           HB2      SER  43   5.726   9.238 -27.483
  321    HB3  SER  43           HB3      SER  43   6.595  10.767 -27.677
  322    HG   SER  43           HG       SER  43   8.016   9.991 -25.967
  323    H    ASP  44           H        ASP  44   5.555  10.721 -23.272
  324    HA   ASP  44           HA       ASP  44   5.236   9.510 -21.430
  325    HB2  ASP  44           HB2      ASP  44   2.938   9.287 -22.237
  326    HB3  ASP  44           HB3      ASP  44   3.358   7.805 -23.090
  327    H    SER  45           H        SER  45   5.731   7.164 -24.116
  328    HA   SER  45           HA       SER  45   7.267   5.276 -22.536
  329    HB2  SER  45           HB2      SER  45   7.248   5.785 -25.540
  330    HB3  SER  45           HB3      SER  45   7.936   4.366 -24.727
  331    HG   SER  45           HG       SER  45   5.814   3.979 -25.507
  332    H    ALA  46           H        ALA  46   8.054   8.263 -24.188
  333    HA   ALA  46           HA       ALA  46  10.769   8.359 -23.103
  334    HB1  ALA  46           HB1      ALA  46  11.128   7.067 -25.170
  335    HB2  ALA  46           HB2      ALA  46  10.191   8.249 -26.110
  336    HB3  ALA  46           HB3      ALA  46  11.740   8.723 -25.394
  337    H    TRP  47           H        TRP  47  11.796  10.508 -23.621
  338    HA   TRP  47           HA       TRP  47  10.130  12.541 -24.889
  339    HB2  TRP  47           HB2      TRP  47  10.139  14.088 -23.008
  340    HB3  TRP  47           HB3      TRP  47   9.064  12.716 -22.804
  341    HD1  TRP  47           HD1      TRP  47  10.107  10.682 -21.136
  342    HE1  TRP  47           HE1      TRP  47  11.328  10.915 -18.902
  343    HE3  TRP  47           HE3      TRP  47  11.585  15.564 -21.564
  344    HZ2  TRP  47           HZ2      TRP  47  12.463  13.087 -17.330
  345    HZ3  TRP  47           HZ3      TRP  47  12.680  16.709 -19.659
  346    HH2  TRP  47           HH2      TRP  47  13.120  15.496 -17.545
  347    H    ARG  48           H        ARG  48  11.655  13.103 -26.303
  348    HA   ARG  48           HA       ARG  48  14.286  14.115 -25.304
  349    HB2  ARG  48           HB2      ARG  48  13.857  11.866 -27.310
  350    HB3  ARG  48           HB3      ARG  48  15.404  12.689 -27.123
  351    HG2  ARG  48           HG2      ARG  48  13.992  11.087 -24.952
  352    HG3  ARG  48           HG3      ARG  48  15.336  10.536 -25.934
  353    HD2  ARG  48           HD2      ARG  48  16.783  12.306 -25.035
  354    HD3  ARG  48           HD3      ARG  48  15.470  12.870 -23.997
  355    HE   ARG  48           HE       ARG  48  15.462  10.515 -23.017
  356   HH11  ARG  48          HH21      ARG  48  18.514  11.808 -24.295
  357   HH12  ARG  48          HH22      ARG  48  19.418  10.749 -23.207
  358   HH21  ARG  48          HH11      ARG  48  16.847   9.372 -21.610
  359   HH22  ARG  48          HH12      ARG  48  18.587   9.546 -21.885
  360    H    ILE  49           H        ILE  49  15.638  15.070 -26.913
  361    HA   ILE  49           HA       ILE  49  14.143  17.206 -28.091
  362    HB   ILE  49           HB       ILE  49  17.093  16.695 -28.495
  363   HG12  ILE  49          HG12      ILE  49  16.860  16.441 -26.121
  364   HG13  ILE  49          HG13      ILE  49  17.604  17.984 -26.471
  365   HG21  ILE  49          HG21      ILE  49  16.254  18.576 -29.789
  366   HG22  ILE  49          HG22      ILE  49  15.425  19.247 -28.374
  367   HG23  ILE  49          HG23      ILE  49  17.193  19.214 -28.442
  368   HD11  ILE  49          HD11      ILE  49  14.696  17.568 -25.661
  369   HD12  ILE  49          HD12      ILE  49  15.999  18.184 -24.638
  370   HD13  ILE  49          HD13      ILE  49  15.448  19.145 -26.019
  371    H    MET  50           H        MET  50  13.816  17.791 -30.179
  372    HA   MET  50           HA       MET  50  14.908  16.146 -32.409
  373    HB2  MET  50           HB2      MET  50  12.044  17.159 -32.137
  374    HB3  MET  50           HB3      MET  50  12.768  16.594 -33.648
  375    HG2  MET  50           HG2      MET  50  13.256  14.394 -32.528
  376    HG3  MET  50           HG3      MET  50  12.350  14.962 -31.127
  377    HE1  MET  50           HE1      MET  50  12.167  14.756 -35.002
  378    HE2  MET  50           HE2      MET  50  12.006  13.046 -34.565
  379    HE3  MET  50           HE3      MET  50  10.633  13.911 -35.302
  380    H    VAL  51           H        VAL  51  15.386  17.258 -34.240
  381    HA   VAL  51           HA       VAL  51  15.534  20.229 -34.065
  382    HB   VAL  51           HB       VAL  51  17.894  19.983 -34.973
  383   HG11  VAL  51          HG11      VAL  51  17.357  18.953 -32.166
  384   HG12  VAL  51          HG12      VAL  51  18.873  19.662 -32.764
  385   HG13  VAL  51          HG13      VAL  51  17.411  20.653 -32.678
  386   HG21  VAL  51          HG21      VAL  51  17.745  17.572 -35.638
  387   HG22  VAL  51          HG22      VAL  51  19.128  17.952 -34.604
  388   HG23  VAL  51          HG23      VAL  51  17.711  17.134 -33.916
  389    HA   PRO  52           HA       PRO  52  14.245  20.564 -38.150
  390    HB2  PRO  52           HB2      PRO  52  16.785  22.083 -38.789
  391    HB3  PRO  52           HB3      PRO  52  15.094  22.464 -39.254
  392    HG2  PRO  52           HG2      PRO  52  16.163  23.721 -37.126
  393    HG3  PRO  52           HG3      PRO  52  14.532  23.007 -36.969
  394    HD2  PRO  52           HD2      PRO  52  17.152  21.844 -36.035
  395    HD3  PRO  52           HD3      PRO  52  15.584  21.979 -35.176
  396    H    GLY  53           H        GLY  53  14.222  19.623 -40.081
  397    HA2  GLY  53           HA2      GLY  53  16.412  17.738 -40.875
  398    HA3  GLY  53           HA3      GLY  53  14.723  17.642 -41.352
  399    H    LYS  54           H        LYS  54  15.324  17.470 -43.525
  400    HA   LYS  54           HA       LYS  54  17.125  19.001 -44.993
  401    HB2  LYS  54           HB2      LYS  54  14.570  17.542 -45.788
  402    HB3  LYS  54           HB3      LYS  54  15.607  18.272 -46.989
  403    HG2  LYS  54           HG2      LYS  54  16.425  16.070 -45.047
  404    HG3  LYS  54           HG3      LYS  54  16.047  15.878 -46.755
  405    HD2  LYS  54           HD2      LYS  54  18.449  17.321 -45.565
  406    HD3  LYS  54           HD3      LYS  54  18.432  15.819 -46.486
  407    HE2  LYS  54           HE2      LYS  54  17.576  17.069 -48.482
  408    HE3  LYS  54           HE3      LYS  54  17.668  18.575 -47.563
  409    HZ1  LYS  54           HZ1      LYS  54  19.990  16.827 -48.204
  410    HZ2  LYS  54           HZ2      LYS  54  19.656  18.247 -48.923
  411    HZ3  LYS  54           HZ3      LYS  54  20.079  18.215 -47.351
  412    H    THR  55           H        THR  55  13.955  20.173 -44.091
  413    HA   THR  55           HA       THR  55  14.311  22.493 -45.954
  414    HB   THR  55           HB       THR  55  11.990  22.442 -46.526
  415    HG1  THR  55           HG1      THR  55  11.242  21.507 -44.614
  416   HG21  THR  55          HG21      THR  55  13.038  19.612 -46.876
  417   HG22  THR  55          HG22      THR  55  11.860  20.472 -47.883
  418   HG23  THR  55          HG23      THR  55  13.553  21.000 -47.873
  419    HA   PRO  56           HA       PRO  56  13.465  24.039 -41.623
  420    HB2  PRO  56           HB2      PRO  56  15.489  25.890 -41.456
  421    HB3  PRO  56           HB3      PRO  56  15.686  24.161 -41.040
  422    HG2  PRO  56           HG2      PRO  56  16.367  25.536 -43.655
  423    HG3  PRO  56           HG3      PRO  56  17.387  24.417 -42.694
  424    HD2  PRO  56           HD2      PRO  56  15.944  23.558 -44.829
  425    HD3  PRO  56           HD3      PRO  56  16.127  22.544 -43.370
  426    H    SER  57           H        SER  57  13.822  25.487 -44.792
  427    HA   SER  57           HA       SER  57  12.632  28.019 -44.415
  428    HB2  SER  57           HB2      SER  57  12.253  26.134 -46.771
  429    HB3  SER  57           HB3      SER  57  12.115  27.901 -46.785
  430    HG   SER  57           HG       SER  57  14.336  28.027 -46.326
  431    H    ALA  58           H        ALA  58  11.141  24.907 -43.980
  432    HA   ALA  58           HA       ALA  58   8.535  26.243 -43.536
  433    HB1  ALA  58           HB1      ALA  58   8.357  25.388 -45.805
  434    HB2  ALA  58           HB2      ALA  58   8.910  23.782 -45.298
  435    HB3  ALA  58           HB3      ALA  58   7.348  24.414 -44.723
  436    H    TRP  59           H        TRP  59   9.204  22.738 -43.527
  437    HA   TRP  59           HA       TRP  59   9.310  22.532 -40.599
  438    HB2  TRP  59           HB2      TRP  59   6.960  23.076 -40.914
  439    HB3  TRP  59           HB3      TRP  59   6.799  21.883 -42.186
  440    HD1  TRP  59           HD1      TRP  59   6.410  19.400 -41.515
  441    HE1  TRP  59           HE1      TRP  59   5.601  18.267 -39.362
  442    HE3  TRP  59           HE3      TRP  59   7.323  23.206 -38.203
  443    HZ2  TRP  59           HZ2      TRP  59   5.275  18.961 -36.585
  444    HZ3  TRP  59           HZ3      TRP  59   6.737  22.939 -35.804
  445    HH2  TRP  59           HH2      TRP  59   5.702  20.835 -34.984
  446    H    ARG  60           H        ARG  60  10.907  21.031 -40.528
  447    HA   ARG  60           HA       ARG  60  10.117  18.297 -41.223
  448    HB2  ARG  60           HB2      ARG  60  11.487  19.393 -43.235
  449    HB3  ARG  60           HB3      ARG  60  12.868  19.183 -42.179
  450    HG2  ARG  60           HG2      ARG  60  12.835  17.252 -43.559
  451    HG3  ARG  60           HG3      ARG  60  12.158  16.691 -42.038
  452    HD2  ARG  60           HD2      ARG  60  10.663  15.786 -43.545
  453    HD3  ARG  60           HD3      ARG  60   9.821  17.278 -43.157
  454    HE   ARG  60           HE       ARG  60  11.403  16.679 -45.629
  455   HH11  ARG  60          HH11      ARG  60   9.113  18.955 -44.177
  456   HH12  ARG  60          HH12      ARG  60   8.569  19.456 -45.742
  457   HH21  ARG  60          HH21      ARG  60  10.697  17.495 -47.532
  458   HH22  ARG  60          HH22      ARG  60   9.459  18.710 -47.555
  459    H    TRP  61           H        TRP  61  11.294  16.696 -39.966
  460    HA   TRP  61           HA       TRP  61  12.916  17.828 -37.719
  461    HB2  TRP  61           HB2      TRP  61  10.408  16.112 -37.544
  462    HB3  TRP  61           HB3      TRP  61  11.501  16.422 -36.202
  463    HD1  TRP  61           HD1      TRP  61   8.443  17.749 -37.637
  464    HE1  TRP  61           HE1      TRP  61   7.881  20.065 -36.652
  465    HE3  TRP  61           HE3      TRP  61  12.889  18.732 -35.358
  466    HZ2  TRP  61           HZ2      TRP  61   9.224  22.091 -35.070
  467    HZ3  TRP  61           HZ3      TRP  61  13.229  20.835 -34.091
  468    HH2  TRP  61           HH2      TRP  61  11.411  22.497 -33.912
  469    H    VAL  62           H        VAL  62  14.275  16.527 -36.648
  470    HA   VAL  62           HA       VAL  62  14.592  13.651 -37.349
  471    HB   VAL  62           HB       VAL  62  16.918  15.617 -37.132
  472   HG11  VAL  62          HG11      VAL  62  17.490  13.245 -36.680
  473   HG12  VAL  62          HG12      VAL  62  16.778  12.777 -38.241
  474   HG13  VAL  62          HG13      VAL  62  18.221  13.809 -38.177
  475   HG21  VAL  62          HG21      VAL  62  17.216  15.394 -39.586
  476   HG22  VAL  62          HG22      VAL  62  15.653  14.551 -39.690
  477   HG23  VAL  62          HG23      VAL  62  15.739  16.251 -39.162
  478    HA   PRO  63           HA       PRO  63  15.149  13.652 -32.784
  479    HB2  PRO  63           HB2      PRO  63  16.268  11.162 -32.461
  480    HB3  PRO  63           HB3      PRO  63  14.522  11.437 -32.736
  481    HG2  PRO  63           HG2      PRO  63  16.657  10.699 -34.758
  482    HG3  PRO  63           HG3      PRO  63  15.037   9.962 -34.539
  483    HD2  PRO  63           HD2      PRO  63  15.508  11.835 -36.440
  484    HD3  PRO  63           HD3      PRO  63  13.964  11.812 -35.544
  485    H    LEU  64           H        LEU  64  16.860  14.166 -31.393
  486    HA   LEU  64           HA       LEU  64  19.093  15.213 -32.771
  487    HB2  LEU  64           HB2      LEU  64  17.929  16.375 -30.996
  488    HB3  LEU  64           HB3      LEU  64  18.500  15.215 -29.799
  489    HG   LEU  64           HG       LEU  64  20.724  16.064 -29.871
  490   HD11  LEU  64          HD11      LEU  64  19.992  17.665 -32.351
  491   HD12  LEU  64          HD12      LEU  64  21.532  17.747 -31.468
  492   HD13  LEU  64          HD13      LEU  64  21.085  16.265 -32.296
  493   HD21  LEU  64          HD21      LEU  64  20.514  18.463 -29.470
  494   HD22  LEU  64          HD22      LEU  64  18.888  18.452 -30.180
  495   HD23  LEU  64          HD23      LEU  64  19.230  17.549 -28.680
  496    H    GLN  65           H        GLN  65  19.492  12.567 -33.257
  497    HA   GLN  65           HA       GLN  65  21.424  11.250 -31.592
  498    HB2  GLN  65           HB2      GLN  65  20.894  11.095 -34.588
  499    HB3  GLN  65           HB3      GLN  65  22.058  10.073 -33.734
  500    HG2  GLN  65           HG2      GLN  65  20.207   9.334 -32.194
  501    HG3  GLN  65           HG3      GLN  65  19.058  10.195 -33.233
  502   HE21  GLN  65          HE22      GLN  65  21.515   7.577 -33.192
  503   HE22  GLN  65          HE21      GLN  65  20.756   6.658 -34.496
  504    H    GLU  66           H        GLU  66  21.829  14.026 -33.692
  505    HA   GLU  66           HA       GLU  66  24.635  13.949 -34.079
  506    HB2  GLU  66           HB2      GLU  66  22.867  15.500 -35.091
  507    HB3  GLU  66           HB3      GLU  66  22.994  16.460 -33.613
  508    HG2  GLU  66           HG2      GLU  66  25.404  16.836 -34.074
  509    HG3  GLU  66           HG3      GLU  66  25.296  15.807 -35.507
  510    H    ASP  67           H        ASP  67  22.897  14.450 -31.095
  511    HA   ASP  67           HA       ASP  67  25.519  14.892 -29.711
  512    HB2  ASP  67           HB2      ASP  67  24.231  17.010 -29.769
  513    HB3  ASP  67           HB3      ASP  67  22.879  16.202 -28.975
  514    H    ALA  68           H        ALA  68  22.208  13.512 -29.472
  515    HA   ALA  68           HA       ALA  68  22.778  12.110 -26.987
  516    HB1  ALA  68           HB1      ALA  68  20.532  12.946 -27.635
  517    HB2  ALA  68           HB2      ALA  68  20.523  11.813 -29.006
  518    HB3  ALA  68           HB3      ALA  68  20.527  11.197 -27.339
  519    H    ALA  69           H        ALA  69  23.745  11.442 -30.142
  520    HA   ALA  69           HA       ALA  69  24.461   9.753 -31.380
  521    HB1  ALA  69           HB1      ALA  69  25.082   8.430 -28.725
  522    HB2  ALA  69           HB2      ALA  69  25.777   8.013 -30.305
  523    HB3  ALA  69           HB3      ALA  69  26.099   9.604 -29.589
  524    H    ASP  70           H        ASP  70  22.731   8.022 -28.819
  525    HA   ASP  70           HA       ASP  70  20.912   6.733 -30.776
  526    HB2  ASP  70           HB2      ASP  70  23.002   5.333 -30.569
  527    HB3  ASP  70           HB3      ASP  70  22.668   5.156 -28.849
  528    H    GLU  71           H        GLU  71  21.252   8.315 -27.832
  529    HA   GLU  71           HA       GLU  71  19.188   6.795 -26.369
  530    HB2  GLU  71           HB2      GLU  71  21.432   7.941 -25.516
  531    HB3  GLU  71           HB3      GLU  71  20.411   9.376 -25.403
  532    HG2  GLU  71           HG2      GLU  71  18.834   8.041 -23.946
  533    HG3  GLU  71           HG3      GLU  71  19.922   6.663 -24.079
  534    H    SER  72           H        SER  72  18.937   8.964 -28.778
  535    HA   SER  72           HA       SER  72  17.330  11.105 -27.899
  536    HB2  SER  72           HB2      SER  72  16.936  11.337 -30.411
  537    HB3  SER  72           HB3      SER  72  18.601  11.322 -29.869
  538    HG   SER  72           HG       SER  72  17.340   8.906 -30.681
  539    H    GLN  73           H        GLN  73  16.138   8.234 -27.444
  540    HA   GLN  73           HA       GLN  73  13.362   9.021 -27.810
  541    HB2  GLN  73           HB2      GLN  73  12.631   7.221 -29.217
  542    HB3  GLN  73           HB3      GLN  73  13.820   8.193 -30.051
  543    HG2  GLN  73           HG2      GLN  73  14.231   5.416 -28.887
  544    HG3  GLN  73           HG3      GLN  73  14.142   5.853 -30.584
  545   HE21  GLN  73          HE22      GLN  73  16.289   4.930 -28.283
  546   HE22  GLN  73          HE21      GLN  73  17.727   5.739 -28.894
  547    H    ASN  74           H        ASN  74  14.784   8.697 -25.529
  548    HA   ASN  74           HA       ASN  74  13.642   6.252 -24.234
  549    HB2  ASN  74           HB2      ASN  74  16.164   6.268 -24.949
  550    HB3  ASN  74           HB3      ASN  74  16.372   7.462 -23.672
  551   HD21  ASN  74          HD22      ASN  74  16.188   6.703 -21.418
  552   HD22  ASN  74          HD21      ASN  74  16.237   4.975 -21.105
  553    H    ASP  75           H        ASP  75  13.536   6.404 -21.851
  554    HA   ASP  75           HA       ASP  75  12.763   9.020 -20.803
  555    HB2  ASP  75           HB2      ASP  75  11.802   6.680 -20.239
  556    HB3  ASP  75           HB3      ASP  75  13.223   6.480 -19.212
  557    H    TRP  76           H        TRP  76  13.846   9.378 -18.380
  558    HA   TRP  76           HA       TRP  76  16.767   9.789 -18.972
  559    HB2  TRP  76           HB2      TRP  76  14.691  11.454 -17.513
  560    HB3  TRP  76           HB3      TRP  76  16.399  11.835 -17.530
  561    HD1  TRP  76           HD1      TRP  76  13.782  11.163 -20.322
  562    HE1  TRP  76           HE1      TRP  76  13.989  12.986 -22.080
  563    HE3  TRP  76           HE3      TRP  76  17.576  13.899 -18.230
  564    HZ2  TRP  76           HZ2      TRP  76  15.641  15.268 -22.613
  565    HZ3  TRP  76           HZ3      TRP  76  18.449  15.905 -19.415
  566    HH2  TRP  76           HH2      TRP  76  17.497  16.590 -21.596
  567    H    ASP  77           H        ASP  77  14.920   8.071 -16.673
  568    HA   ASP  77           HA       ASP  77  17.126   8.151 -14.663
  569    HB2  ASP  77           HB2      ASP  77  15.578   8.886 -12.918
  570    HB3  ASP  77           HB3      ASP  77  15.605  10.067 -14.221
  571    H    GLU  78           H        GLU  78  15.962   6.988 -12.566
  572    HA   GLU  78           HA       GLU  78  15.197   4.234 -13.439
  573    HB2  GLU  78           HB2      GLU  78  16.763   3.367 -11.835
  574    HB3  GLU  78           HB3      GLU  78  17.608   4.555 -12.825
  575    HG2  GLU  78           HG2      GLU  78  17.067   6.261 -10.932
  576    HG3  GLU  78           HG3      GLU  78  16.632   4.864  -9.952
  577    H    GLU  79           H        GLU  79  13.796   6.776 -11.905
  578    HA   GLU  79           HA       GLU  79  12.332   5.099  -9.937
  579    HB2  GLU  79           HB2      GLU  79  14.599   6.077  -8.967
  580    HB3  GLU  79           HB3      GLU  79  13.700   7.577  -8.881
  581    HG2  GLU  79           HG2      GLU  79  13.611   6.526  -6.749
  582    HG3  GLU  79           HG3      GLU  79  12.001   6.415  -7.417
  583    H    LEU  80           H        LEU  80  12.186   7.681 -12.142
  584    HA   LEU  80           HA       LEU  80   9.857   8.935 -10.790
  585    HB2  LEU  80           HB2      LEU  80  11.213   9.934 -13.286
  586    HB3  LEU  80           HB3      LEU  80  10.144  10.802 -12.212
  587    HG   LEU  80           HG       LEU  80  13.046  10.060 -11.635
  588   HD11  LEU  80          HD11      LEU  80  12.591  11.873 -13.286
  589   HD12  LEU  80          HD12      LEU  80  11.727  12.756 -12.010
  590   HD13  LEU  80          HD13      LEU  80  13.464  12.374 -11.847
  591   HD21  LEU  80          HD21      LEU  80  11.701   9.990  -9.546
  592   HD22  LEU  80          HD22      LEU  80  12.755  11.406  -9.590
  593   HD23  LEU  80          HD23      LEU  80  11.018  11.582  -9.931
  594    H    SER  81           H        SER  81   8.123   9.628 -12.139
  595    HA   SER  81           HA       SER  81   7.647   8.363 -14.785
  596    HB2  SER  81           HB2      SER  81   6.451   7.012 -13.041
  597    HB3  SER  81           HB3      SER  81   5.584   8.481 -12.541
  598    HG   SER  81           HG       SER  81   4.421   7.208 -14.091
  599    H    ILE  82           H        ILE  82   6.665   9.834 -16.208
  600    HA   ILE  82           HA       ILE  82   6.488  12.625 -15.188
  601    HB   ILE  82           HB       ILE  82   7.784  11.363 -17.552
  602   HG12  ILE  82          HG12      ILE  82   9.360  13.257 -17.263
  603   HG13  ILE  82          HG13      ILE  82   8.348  13.919 -15.982
  604   HG21  ILE  82          HG21      ILE  82   6.149  12.672 -18.785
  605   HG22  ILE  82          HG22      ILE  82   6.545  14.128 -17.835
  606   HG23  ILE  82          HG23      ILE  82   7.744  13.402 -18.920
  607   HD11  ILE  82          HD11      ILE  82   8.877  12.046 -14.526
  608   HD12  ILE  82          HD12      ILE  82   9.692  11.184 -15.858
  609   HD13  ILE  82          HD13      ILE  82  10.382  12.681 -15.198
  610    H    HIS  83           H        HIS  83   4.941  13.993 -15.822
  611    HA   HIS  83           HA       HIS  83   2.737  13.126 -17.624
  612    HB2  HIS  83           HB2      HIS  83   2.342  14.329 -14.852
  613    HB3  HIS  83           HB3      HIS  83   1.070  14.026 -16.028
  614    HD1  HIS  83           HD1      HIS  83   0.237  11.467 -16.252
  615    HD2  HIS  83           HD2      HIS  83   3.372  12.178 -13.534
  616    HE1  HIS  83           HE1      HIS  83   0.473   9.344 -14.862
  617    H    LEU  84           H        LEU  84   1.523  15.002 -18.501
  618    HA   LEU  84           HA       LEU  84   2.849  17.638 -18.300
  619    HB2  LEU  84           HB2      LEU  84   3.851  15.841 -20.010
  620    HB3  LEU  84           HB3      LEU  84   2.496  16.332 -21.013
  621    HG   LEU  84           HG       LEU  84   4.563  18.217 -19.824
  622   HD11  LEU  84          HD11      LEU  84   4.462  16.995 -22.612
  623   HD12  LEU  84          HD12      LEU  84   5.660  18.174 -22.022
  624   HD13  LEU  84          HD13      LEU  84   5.596  16.562 -21.310
  625   HD21  LEU  84          HD21      LEU  84   2.839  19.658 -20.549
  626   HD22  LEU  84          HD22      LEU  84   3.824  19.568 -21.991
  627   HD23  LEU  84          HD23      LEU  84   2.356  18.573 -21.876
  628    H    GLN  85           H        GLN  85   1.620  19.342 -18.968
  629    HA   GLN  85           HA       GLN  85  -0.749  19.013 -20.616
  630    HB2  GLN  85           HB2      GLN  85  -2.260  20.245 -19.079
  631    HB3  GLN  85           HB3      GLN  85  -1.874  18.625 -18.546
  632    HG2  GLN  85           HG2      GLN  85  -0.517  21.130 -17.454
  633    HG3  GLN  85           HG3      GLN  85  -1.965  20.432 -16.758
  634   HE21  GLN  85          HE22      GLN  85   1.171  20.638 -16.057
  635   HE22  GLN  85          HE21      GLN  85   1.412  19.049 -15.325
  636    HA   PRO  86           HA       PRO  86  -2.491  20.578 -21.279
  637    HB2  PRO  86           HB2      PRO  86  -3.036  22.117 -23.427
  638    HB3  PRO  86           HB3      PRO  86  -3.089  22.774 -21.764
  639    HG2  PRO  86           HG2      PRO  86  -0.804  22.965 -23.760
  640    HG3  PRO  86           HG3      PRO  86  -1.568  24.293 -22.826
  641    HD2  PRO  86           HD2      PRO  86   0.714  23.024 -21.993
  642    HD3  PRO  86           HD3      PRO  86  -0.506  23.631 -20.837
  643    H    PHE  87           H        PHE  87   0.529  20.535 -23.044
  644    HA   PHE  87           HA       PHE  87  -0.341  19.376 -25.478
  645    HB2  PHE  87           HB2      PHE  87   2.337  19.198 -24.048
  646    HB3  PHE  87           HB3      PHE  87   2.037  18.538 -25.637
  647    HD1  PHE  87           HD1      PHE  87   0.838  20.268 -27.346
  648    HD2  PHE  87           HD2      PHE  87   3.420  21.290 -24.040
  649    HE1  PHE  87           HE1      PHE  87   1.469  22.380 -28.486
  650    HE2  PHE  87           HE2      PHE  87   4.064  23.390 -25.196
  651    HZ   PHE  87           HZ       PHE  87   3.109  23.914 -27.439
  652    H    LYS  88           H        LYS  88  -0.485  17.420 -26.252
  653    HA   LYS  88           HA       LYS  88  -1.101  15.116 -24.677
  654    HB2  LYS  88           HB2      LYS  88  -1.103  13.924 -26.835
  655    HB3  LYS  88           HB3      LYS  88  -2.057  15.402 -26.853
  656    HG2  LYS  88           HG2      LYS  88  -0.200  16.585 -28.052
  657    HG3  LYS  88           HG3      LYS  88   0.726  15.076 -28.071
  658    HD2  LYS  88           HD2      LYS  88  -1.054  13.981 -29.376
  659    HD3  LYS  88           HD3      LYS  88  -1.973  15.505 -29.395
  660    HE2  LYS  88           HE2      LYS  88  -0.218  16.636 -30.622
  661    HE3  LYS  88           HE3      LYS  88   0.892  15.280 -30.404
  662    HZ1  LYS  88           HZ1      LYS  88  -0.118  15.271 -32.620
  663    HZ2  LYS  88           HZ2      LYS  88  -0.531  13.924 -31.803
  664    HZ3  LYS  88           HZ3      LYS  88  -1.618  15.137 -31.992
  665    HA   PRO  89           HA       PRO  89   3.187  13.546 -24.342
  666    HB2  PRO  89           HB2      PRO  89   2.818  11.591 -22.529
  667    HB3  PRO  89           HB3      PRO  89   2.630  13.305 -22.071
  668    HG2  PRO  89           HG2      PRO  89   0.426  11.350 -22.822
  669    HG3  PRO  89           HG3      PRO  89   0.513  12.420 -21.388
  670    HD2  PRO  89           HD2      PRO  89  -0.818  13.086 -23.719
  671    HD3  PRO  89           HD3      PRO  89  -0.069  14.303 -22.642
  672    H    ASP  90           H        ASP  90   2.258  13.117 -26.728
  673    HA   ASP  90           HA       ASP  90   1.524  10.249 -27.176
  674    HB2  ASP  90           HB2      ASP  90  -0.148  11.909 -27.801
  675    HB3  ASP  90           HB3      ASP  90   1.035  12.770 -28.785
  676    H    ASP  91           H        ASP  91   2.417   9.055 -28.854
  677    HA   ASP  91           HA       ASP  91   5.168   9.599 -29.642
  678    HB2  ASP  91           HB2      ASP  91   4.323   7.365 -28.982
  679    HB3  ASP  91           HB3      ASP  91   3.243   7.361 -30.376
  680    H    SER  92           H        SER  92   3.833  11.706 -30.582
  681    HA   SER  92           HA       SER  92   2.549  11.477 -33.113
  682    HB2  SER  92           HB2      SER  92   3.876  13.964 -32.000
  683    HB3  SER  92           HB3      SER  92   2.506  13.865 -33.120
  684    HG   SER  92           HG       SER  92   1.525  12.594 -31.206
  685    H    ASN  93           H        ASN  93   5.853  11.144 -32.583
  686    HA   ASN  93           HA       ASN  93   7.731  11.271 -33.795
  687    HB2  ASN  93           HB2      ASN  93   6.373   9.704 -35.201
  688    HB3  ASN  93           HB3      ASN  93   5.933  11.060 -36.240
  689   HD21  ASN  93          HD22      ASN  93   8.917   9.525 -34.850
  690   HD22  ASN  93          HD21      ASN  93   9.822   9.690 -36.340
  691    H    GLN  94           H        GLN  94   6.483  13.723 -33.013
  692    HA   GLN  94           HA       GLN  94   8.254  15.569 -34.434
  693    HB2  GLN  94           HB2      GLN  94   6.564  17.289 -34.758
  694    HB3  GLN  94           HB3      GLN  94   6.069  15.855 -35.634
  695    HG2  GLN  94           HG2      GLN  94   4.308  15.390 -34.110
  696    HG3  GLN  94           HG3      GLN  94   4.990  16.396 -32.832
  697   HE21  GLN  94          HE22      GLN  94   4.737  18.668 -32.850
  698   HE22  GLN  94          HE21      GLN  94   3.557  19.409 -33.931
  699    HA   PRO  95           HA       PRO  95   8.480  17.032 -30.181
  700    HB2  PRO  95           HB2      PRO  95   8.826  19.738 -30.385
  701    HB3  PRO  95           HB3      PRO  95  10.109  18.524 -30.727
  702    HG2  PRO  95           HG2      PRO  95   8.322  19.930 -32.722
  703    HG3  PRO  95           HG3      PRO  95  10.103  19.705 -32.772
  704    HD2  PRO  95           HD2      PRO  95   8.424  18.067 -34.129
  705    HD3  PRO  95           HD3      PRO  95   9.891  17.426 -33.347
  706    H    GLN  96           H        GLN  96   7.132  17.800 -28.604
  707    HA   GLN  96           HA       GLN  96   4.430  18.861 -29.361
  708    HB2  GLN  96           HB2      GLN  96   5.346  18.003 -26.595
  709    HB3  GLN  96           HB3      GLN  96   3.709  18.198 -27.194
  710    HG2  GLN  96           HG2      GLN  96   5.652  15.967 -27.949
  711    HG3  GLN  96           HG3      GLN  96   4.349  15.865 -26.786
  712   HE21  GLN  96          HE22      GLN  96   4.066  13.906 -28.414
  713   HE22  GLN  96          HE21      GLN  96   2.980  14.250 -29.750
  714    H    VAL  97           H        VAL  97   7.173  19.426 -27.169
  715    HA   VAL  97           HA       VAL  97   6.338  22.241 -26.585
  716    HB   VAL  97           HB       VAL  97   8.539  20.432 -25.497
  717   HG11  VAL  97          HG11      VAL  97   9.388  22.754 -25.482
  718   HG12  VAL  97          HG12      VAL  97   7.902  23.293 -24.667
  719   HG13  VAL  97          HG13      VAL  97   9.030  22.190 -23.854
  720   HG21  VAL  97          HG21      VAL  97   6.056  21.620 -24.182
  721   HG22  VAL  97          HG22      VAL  97   6.255  19.921 -24.663
  722   HG23  VAL  97          HG23      VAL  97   7.268  20.600 -23.386
  723    H    VAL  98           H        VAL  98   7.442  23.985 -27.472
  724    HA   VAL  98           HA       VAL  98   9.697  23.368 -29.348
  725    HB   VAL  98           HB       VAL  98   7.210  24.956 -30.067
  726   HG11  VAL  98          HG11      VAL  98   9.654  24.243 -31.738
  727   HG12  VAL  98          HG12      VAL  98   8.161  24.981 -32.354
  728   HG13  VAL  98          HG13      VAL  98   9.163  25.877 -31.221
  729   HG21  VAL  98          HG21      VAL  98   6.719  22.553 -30.102
  730   HG22  VAL  98          HG22      VAL  98   6.854  23.148 -31.751
  731   HG23  VAL  98          HG23      VAL  98   8.201  22.238 -31.033
  732    H    ILE  99           H        ILE  99  11.137  24.870 -29.724
  733    HA   ILE  99           HA       ILE  99  11.289  27.301 -27.996
  734    HB   ILE  99           HB       ILE  99  13.528  25.518 -29.086
  735   HG12  ILE  99          HG12      ILE  99  13.996  25.201 -26.554
  736   HG13  ILE  99          HG13      ILE  99  12.307  25.631 -26.312
  737   HG21  ILE  99          HG21      ILE  99  13.611  27.901 -27.181
  738   HG22  ILE  99          HG22      ILE  99  14.978  26.883 -27.679
  739   HG23  ILE  99          HG23      ILE  99  14.179  27.897 -28.862
  740   HD11  ILE  99          HD11      ILE  99  13.270  23.325 -28.053
  741   HD12  ILE  99          HD12      ILE  99  12.798  23.176 -26.356
  742   HD13  ILE  99          HD13      ILE  99  11.592  23.649 -27.544
  743    H    LEU 100           H        LEU 100  11.002  29.069 -29.219
  744    HA   LEU 100           HA       LEU 100  11.403  29.100 -32.127
  745    HB2  LEU 100           HB2      LEU 100  10.455  31.057 -30.018
  746    HB3  LEU 100           HB3      LEU 100  10.803  31.615 -31.630
  747    HG   LEU 100           HG       LEU 100   8.383  31.175 -31.069
  748   HD11  LEU 100          HD11      LEU 100   9.184  31.460 -33.372
  749   HD12  LEU 100          HD12      LEU 100   9.505  29.718 -33.486
  750   HD13  LEU 100          HD13      LEU 100   7.845  30.307 -33.287
  751   HD21  LEU 100          HD21      LEU 100   8.615  28.963 -29.941
  752   HD22  LEU 100          HD22      LEU 100   7.455  28.959 -31.277
  753   HD23  LEU 100          HD23      LEU 100   9.061  28.247 -31.508
  754    H    ALA 101           H        ALA 101  12.852  30.475 -33.178
  755    HA   ALA 101           HA       ALA 101  15.516  30.423 -32.313
  756    HB1  ALA 101           HB1      ALA 101  15.943  31.819 -34.308
  757    HB2  ALA 101           HB2      ALA 101  14.780  30.531 -34.662
  758    HB3  ALA 101           HB3      ALA 101  14.214  32.201 -34.421
  759    H    ASP 102           H        ASP 102  13.153  32.865 -31.537
  760    HA   ASP 102           HA       ASP 102  15.014  34.979 -30.808
  761    HB2  ASP 102           HB2      ASP 102  12.645  35.292 -31.586
  762    HB3  ASP 102           HB3      ASP 102  12.086  34.552 -30.087
  763    H    GLY 103           H        GLY 103  14.198  32.025 -29.269
  764    HA2  GLY 103           HA2      GLY 103  14.963  31.222 -27.246
  765    HA3  GLY 103           HA3      GLY 103  15.410  32.846 -26.712
  766    H    GLN 104           H        GLN 104  12.189  32.133 -27.939
  767    HA   GLN 104           HA       GLN 104  11.034  32.280 -25.199
  768    HB2  GLN 104           HB2      GLN 104   9.078  33.343 -26.045
  769    HB3  GLN 104           HB3      GLN 104  10.494  34.266 -26.497
  770    HG2  GLN 104           HG2      GLN 104   9.400  34.407 -28.463
  771    HG3  GLN 104           HG3      GLN 104  10.229  32.900 -28.799
  772   HE21  GLN 104          HE22      GLN 104   8.866  30.826 -28.299
  773   HE22  GLN 104          HE21      GLN 104   7.122  30.987 -28.512
  774    H    ILE 105           H        ILE 105   9.243  30.817 -24.815
  775    HA   ILE 105           HA       ILE 105   9.574  28.304 -26.434
  776    HB   ILE 105           HB       ILE 105   9.178  28.341 -23.451
  777   HG12  ILE 105          HG12      ILE 105  11.166  29.661 -23.602
  778   HG13  ILE 105          HG13      ILE 105  11.530  28.082 -22.961
  779   HG21  ILE 105          HG21      ILE 105  10.371  26.306 -25.363
  780   HG22  ILE 105          HG22      ILE 105  10.347  26.127 -23.598
  781   HG23  ILE 105          HG23      ILE 105   8.831  26.192 -24.494
  782   HD11  ILE 105          HD11      ILE 105  12.601  27.415 -25.023
  783   HD12  ILE 105          HD12      ILE 105  12.095  28.923 -25.834
  784   HD13  ILE 105          HD13      ILE 105  13.251  28.975 -24.503
  785    H    THR 106           H        THR 106   7.730  26.888 -26.515
  786    HA   THR 106           HA       THR 106   5.110  28.001 -26.369
  787    HB   THR 106           HB       THR 106   4.442  25.534 -26.263
  788    HG1  THR 106           HG1      THR 106   6.472  24.961 -25.247
  789   HG21  THR 106          HG21      THR 106   6.375  26.388 -28.442
  790   HG22  THR 106          HG22      THR 106   5.262  25.000 -28.529
  791   HG23  THR 106          HG23      THR 106   4.619  26.650 -28.420
  792    HA   PRO 107           HA       PRO 107   4.821  27.699 -21.837
  793    HB2  PRO 107           HB2      PRO 107   2.249  28.525 -21.422
  794    HB3  PRO 107           HB3      PRO 107   3.602  29.621 -21.826
  795    HG2  PRO 107           HG2      PRO 107   1.506  28.488 -23.676
  796    HG3  PRO 107           HG3      PRO 107   2.147  30.165 -23.588
  797    HD2  PRO 107           HD2      PRO 107   3.005  28.300 -25.430
  798    HD3  PRO 107           HD3      PRO 107   4.060  29.597 -24.791
  799    H    PHE 108           H        PHE 108   4.400  26.036 -20.514
  800    HA   PHE 108           HA       PHE 108   2.154  24.251 -20.620
  801    HB2  PHE 108           HB2      PHE 108   3.182  22.228 -21.294
  802    HB3  PHE 108           HB3      PHE 108   3.588  23.373 -22.547
  803    HD1  PHE 108           HD2      PHE 108   5.905  24.555 -22.338
  804    HD2  PHE 108           HD1      PHE 108   4.919  20.932 -20.258
  805    HE1  PHE 108           HE2      PHE 108   8.310  24.075 -22.081
  806    HE2  PHE 108           HE1      PHE 108   7.337  20.407 -20.049
  807    HZ   PHE 108           HZ       PHE 108   9.039  21.971 -20.948
  808    H    SER 109           H        SER 109   2.626  22.283 -19.108
  809    HA   SER 109           HA       SER 109   4.713  22.847 -17.131
  810    HB2  SER 109           HB2      SER 109   3.190  22.377 -15.210
  811    HB3  SER 109           HB3      SER 109   2.898  23.917 -16.032
  812    HG   SER 109           HG       SER 109   1.241  22.790 -17.247
  813    H    LEU 110           H        LEU 110   5.408  21.100 -15.992
  814    HA   LEU 110           HA       LEU 110   4.837  18.386 -17.116
  815    HB2  LEU 110           HB2      LEU 110   6.598  19.013 -18.452
  816    HB3  LEU 110           HB3      LEU 110   7.225  20.185 -17.302
  817    HG   LEU 110           HG       LEU 110   8.243  18.389 -15.962
  818   HD11  LEU 110          HD11      LEU 110   8.537  16.141 -17.007
  819   HD12  LEU 110          HD12      LEU 110   6.834  16.425 -16.649
  820   HD13  LEU 110          HD13      LEU 110   7.421  16.596 -18.311
  821   HD21  LEU 110          HD21      LEU 110  10.056  17.932 -17.560
  822   HD22  LEU 110          HD22      LEU 110   9.008  18.427 -18.906
  823   HD23  LEU 110          HD23      LEU 110   9.503  19.610 -17.678
  824    H    LEU 111           H        LEU 111   4.799  16.848 -15.558
  825    HA   LEU 111           HA       LEU 111   5.647  17.580 -12.786
  826    HB2  LEU 111           HB2      LEU 111   3.277  17.775 -13.096
  827    HB3  LEU 111           HB3      LEU 111   3.148  16.181 -13.820
  828    HG   LEU 111           HG       LEU 111   4.299  16.414 -11.046
  829   HD11  LEU 111          HD11      LEU 111   2.340  17.830 -10.990
  830   HD12  LEU 111          HD12      LEU 111   1.330  16.535 -11.675
  831   HD13  LEU 111          HD13      LEU 111   2.054  16.351 -10.057
  832   HD21  LEU 111          HD21      LEU 111   2.346  14.386 -12.251
  833   HD22  LEU 111          HD22      LEU 111   4.096  14.137 -12.189
  834   HD23  LEU 111          HD23      LEU 111   3.179  14.260 -10.689
  835    H    MET 112           H        MET 112   6.372  15.947 -11.460
  836    HA   MET 112           HA       MET 112   7.272  13.401 -12.753
  837    HB2  MET 112           HB2      MET 112   8.834  15.195 -10.849
  838    HB3  MET 112           HB3      MET 112   9.350  13.606 -11.418
  839    HG2  MET 112           HG2      MET 112   9.434  14.450 -13.732
  840    HG3  MET 112           HG3      MET 112   8.912  16.048 -13.184
  841    HE1  MET 112           HE1      MET 112  11.081  16.844 -14.665
  842    HE2  MET 112           HE2      MET 112  12.747  16.371 -14.257
  843    HE3  MET 112           HE3      MET 112  11.620  15.163 -14.913
  844    H    ALA 113           H        ALA 113   6.921  11.632 -11.503
  845    HA   ALA 113           HA       ALA 113   6.081  11.920  -8.649
  846    HB1  ALA 113           HB1      ALA 113   4.095  11.773 -10.118
  847    HB2  ALA 113           HB2      ALA 113   4.755  10.313 -10.883
  848    HB3  ALA 113           HB3      ALA 113   4.276  10.280  -9.176
  849    H    ASN 114           H        ASN 114   6.405  10.055  -7.349
  850    HA   ASN 114           HA       ASN 114   8.764   8.440  -7.884
  851    HB2  ASN 114           HB2      ASN 114   8.198   9.087  -5.647
  852    HB3  ASN 114           HB3      ASN 114   6.563   8.474  -5.791
  853   HD21  ASN 114          HD22      ASN 114   8.261   7.856  -3.635
  854   HD22  ASN 114          HD21      ASN 114   8.631   6.143  -3.710
  855    H    ALA 115           H        ALA 115   8.873   6.741  -9.201
  856    HA   ALA 115           HA       ALA 115   6.722   5.782 -10.723
  857    HB1  ALA 115           HB1      ALA 115   9.102   5.736 -11.379
  858    HB2  ALA 115           HB2      ALA 115   9.426   4.487 -10.159
  859    HB3  ALA 115           HB3      ALA 115   8.365   4.135 -11.542
  860    H    GLY 116           H        GLY 116   7.591   4.719  -7.518
  861    HA2  GLY 116           HA2      GLY 116   6.250   2.066  -7.846
  862    HA3  GLY 116           HA3      GLY 116   7.283   2.586  -6.523
  863    H    THR 117           H        THR 117   6.083   5.014  -5.684
  864    HA   THR 117           HA       THR 117   3.653   4.036  -4.371
  865    HB   THR 117           HB       THR 117   3.705   6.178  -3.225
  866    HG1  THR 117           HG1      THR 117   5.354   7.642  -3.739
  867   HG21  THR 117          HG21      THR 117   6.538   5.079  -3.429
  868   HG22  THR 117          HG22      THR 117   5.905   6.126  -2.145
  869   HG23  THR 117          HG23      THR 117   5.273   4.487  -2.334
  870    H    GLY 118           H        GLY 118   4.422   6.161  -7.082
  871    HA2  GLY 118           HA2      GLY 118   3.022   7.017  -8.725
  872    HA3  GLY 118           HA3      GLY 118   1.590   6.503  -7.824
  873    H    GLU 119           H        GLU 119   3.630   8.117  -5.660
  874    HA   GLU 119           HA       GLU 119   1.833  10.402  -5.510
  875    HB2  GLU 119           HB2      GLU 119   4.389   9.677  -4.025
  876    HB3  GLU 119           HB3      GLU 119   3.391  11.077  -3.639
  877    HG2  GLU 119           HG2      GLU 119   2.427   8.183  -3.528
  878    HG3  GLU 119           HG3      GLU 119   3.003   9.110  -2.153
  879    HA   PRO 120           HA       PRO 120   4.320  13.113  -8.093
  880    HB2  PRO 120           HB2      PRO 120   3.408  15.576  -7.355
  881    HB3  PRO 120           HB3      PRO 120   2.488  14.440  -8.377
  882    HG2  PRO 120           HG2      PRO 120   2.222  14.857  -5.382
  883    HG3  PRO 120           HG3      PRO 120   0.917  14.774  -6.607
  884    HD2  PRO 120           HD2      PRO 120   1.628  12.629  -5.078
  885    HD3  PRO 120           HD3      PRO 120   1.117  12.427  -6.782
  886    H    LEU 121           H        LEU 121   6.069  14.447  -7.965
  887    HA   LEU 121           HA       LEU 121   7.478  14.646  -5.344
  888    HB2  LEU 121           HB2      LEU 121   7.886  13.056  -7.720
  889    HB3  LEU 121           HB3      LEU 121   9.112  14.285  -7.775
  890    HG   LEU 121           HG       LEU 121   9.901  12.274  -6.809
  891   HD11  LEU 121          HD11      LEU 121  10.859  14.381  -6.021
  892   HD12  LEU 121          HD12      LEU 121   9.675  14.458  -4.696
  893   HD13  LEU 121          HD13      LEU 121  10.864  13.147  -4.732
  894   HD21  LEU 121          HD21      LEU 121   7.753  11.449  -5.813
  895   HD22  LEU 121          HD22      LEU 121   9.133  11.339  -4.701
  896   HD23  LEU 121          HD23      LEU 121   7.933  12.628  -4.504
  897    H    LEU 122           H        LEU 122   7.381  15.923  -8.647
  898    HA   LEU 122           HA       LEU 122   8.395  18.623  -7.857
  899    HB2  LEU 122           HB2      LEU 122   9.870  16.429  -9.147
  900    HB3  LEU 122           HB3      LEU 122   9.673  17.725 -10.292
  901    HG   LEU 122           HG       LEU 122  11.815  17.798  -9.200
  902   HD11  LEU 122          HD11      LEU 122  10.762  19.929  -9.918
  903   HD12  LEU 122          HD12      LEU 122  10.190  20.165  -8.251
  904   HD13  LEU 122          HD13      LEU 122  11.922  20.110  -8.582
  905   HD21  LEU 122          HD21      LEU 122  11.196  16.809  -7.023
  906   HD22  LEU 122          HD22      LEU 122  12.105  18.320  -6.841
  907   HD23  LEU 122          HD23      LEU 122  10.350  18.306  -6.592
  908    H    THR 123           H        THR 123   7.828  20.214  -9.346
  909    HA   THR 123           HA       THR 123   6.500  19.407 -11.862
  910    HB   THR 123           HB       THR 123   5.190  21.512 -10.111
  911    HG1  THR 123           HG1      THR 123   4.912  18.739 -10.137
  912   HG21  THR 123          HG21      THR 123   3.258  21.051 -11.540
  913   HG22  THR 123          HG22      THR 123   4.634  21.568 -12.530
  914   HG23  THR 123          HG23      THR 123   4.190  19.842 -12.445
  915    H    LEU 124           H        LEU 124   6.911  20.687 -13.492
  916    HA   LEU 124           HA       LEU 124   8.657  23.065 -13.160
  917    HB2  LEU 124           HB2      LEU 124   8.631  20.767 -15.161
  918    HB3  LEU 124           HB3      LEU 124   9.318  22.325 -15.579
  919    HG   LEU 124           HG       LEU 124  10.991  22.165 -13.831
  920   HD11  LEU 124          HD11      LEU 124   9.779  19.426 -13.249
  921   HD12  LEU 124          HD12      LEU 124  11.395  19.935 -12.717
  922   HD13  LEU 124          HD13      LEU 124   9.981  20.787 -12.116
  923   HD21  LEU 124          HD21      LEU 124  10.872  19.664 -15.560
  924   HD22  LEU 124          HD22      LEU 124  11.398  21.273 -16.109
  925   HD23  LEU 124          HD23      LEU 124  12.329  20.415 -14.877
  926    H    VAL 125           H        VAL 125   8.187  24.819 -14.478
  927    HA   VAL 125           HA       VAL 125   5.634  24.742 -16.022
  928    HB   VAL 125           HB       VAL 125   6.120  26.760 -13.804
  929   HG11  VAL 125          HG11      VAL 125   3.727  27.334 -14.201
  930   HG12  VAL 125          HG12      VAL 125   4.724  27.674 -15.611
  931   HG13  VAL 125          HG13      VAL 125   3.697  26.220 -15.583
  932   HG21  VAL 125          HG21      VAL 125   4.185  25.639 -12.663
  933   HG22  VAL 125          HG22      VAL 125   4.270  24.335 -13.869
  934   HG23  VAL 125          HG23      VAL 125   5.615  24.616 -12.744
  935    H    CYS 126           H        CYS 126   5.568  25.973 -17.787
  936    HA   CYS 126           HA       CYS 126   7.761  27.945 -18.313
  937    HB2  CYS 126           HB2      CYS 126   7.730  25.922 -19.810
  938    HB3  CYS 126           HB3      CYS 126   6.077  26.304 -20.250
  939    HG   CYS 126           HG       CYS 126   7.374  27.109 -22.248
  940    H    SER 127           H        SER 127   7.048  29.977 -18.042
  941    HA   SER 127           HA       SER 127   4.289  30.837 -18.325
  942    HB2  SER 127           HB2      SER 127   5.311  33.081 -17.933
  943    HB3  SER 127           HB3      SER 127   5.788  31.878 -16.720
  944    HG   SER 127           HG       SER 127   7.581  33.087 -17.513
  945    H    GLY 128           H        GLY 128   6.734  30.261 -20.636
  946    HA2  GLY 128           HA2      GLY 128   5.958  30.617 -23.013
  947    HA3  GLY 128           HA3      GLY 128   5.695  32.303 -22.578
  948    H    SER 129           H        SER 129   8.464  31.330 -20.931
  949    HA   SER 129           HA       SER 129  10.414  31.733 -23.094
  950    HB2  SER 129           HB2      SER 129   9.807  33.881 -21.042
  951    HB3  SER 129           HB3      SER 129  11.388  33.762 -21.838
  952    HG   SER 129           HG       SER 129   9.051  33.680 -23.393
  953    H    TRP 130           H        TRP 130  12.573  31.498 -22.489
  954    HA   TRP 130           HA       TRP 130  13.179  29.434 -20.735
  955    HB2  TRP 130           HB2      TRP 130  14.544  29.891 -22.591
  956    HB3  TRP 130           HB3      TRP 130  14.721  31.587 -22.187
  957    HD1  TRP 130           HD1      TRP 130  16.730  32.351 -20.862
  958    HE1  TRP 130           HE1      TRP 130  18.730  31.238 -19.705
  959    HE3  TRP 130           HE3      TRP 130  15.280  27.458 -21.280
  960    HZ2  TRP 130           HZ2      TRP 130  19.604  28.561 -19.055
  961    HZ3  TRP 130           HZ3      TRP 130  16.698  25.660 -20.316
  962    HH2  TRP 130           HH2      TRP 130  18.844  26.199 -19.217
  963    HA   PRO 131           HA       PRO 131  14.015  28.307 -19.287
  964    HB2  PRO 131           HB2      PRO 131  14.921  27.411 -16.937
  965    HB3  PRO 131           HB3      PRO 131  16.018  28.279 -18.042
  966    HG2  PRO 131           HG2      PRO 131  14.579  29.369 -15.625
  967    HG3  PRO 131           HG3      PRO 131  16.298  29.564 -16.102
  968    HD2  PRO 131           HD2      PRO 131  14.281  31.425 -16.666
  969    HD3  PRO 131           HD3      PRO 131  15.775  31.245 -17.627
  970    H    LEU 132           H        LEU 132  12.899  26.454 -17.889
  971    HA   LEU 132           HA       LEU 132  10.271  27.329 -16.992
  972    HB2  LEU 132           HB2      LEU 132  11.672  24.626 -17.141
  973    HB3  LEU 132           HB3      LEU 132  10.243  24.854 -16.143
  974    HG   LEU 132           HG       LEU 132   9.166  25.925 -18.247
  975   HD11  LEU 132          HD11      LEU 132  11.135  25.956 -19.710
  976   HD12  LEU 132          HD12      LEU 132  11.273  24.185 -19.565
  977   HD13  LEU 132          HD13      LEU 132   9.875  24.917 -20.378
  978   HD21  LEU 132          HD21      LEU 132   9.596  22.921 -18.181
  979   HD22  LEU 132          HD22      LEU 132   8.417  23.817 -17.198
  980   HD23  LEU 132          HD23      LEU 132   8.243  23.802 -18.937
  981    H    ASP 133           H        ASP 133   9.445  27.125 -14.977
  982    HA   ASP 133           HA       ASP 133  11.218  27.730 -12.689
  983    HB2  ASP 133           HB2      ASP 133   9.037  28.937 -13.177
  984    HB3  ASP 133           HB3      ASP 133   8.191  27.427 -12.838
  985    H    GLN 134           H        GLN 134  10.602  26.506 -10.625
  986    HA   GLN 134           HA       GLN 134   9.925  23.631 -10.992
  987    HB2  GLN 134           HB2      GLN 134  12.489  24.666  -9.709
  988    HB3  GLN 134           HB3      GLN 134  11.834  23.054  -9.418
  989    HG2  GLN 134           HG2      GLN 134  12.008  22.514 -11.814
  990    HG3  GLN 134           HG3      GLN 134  12.692  24.114 -12.140
  991   HE21  GLN 134          HE22      GLN 134  13.275  21.064 -10.282
  992   HE22  GLN 134          HE21      GLN 134  15.018  21.282 -10.256
  993    H    THR 135           H        THR 135   8.858  22.740  -9.275
  994    HA   THR 135           HA       THR 135   8.936  23.964  -6.587
  995    HB   THR 135           HB       THR 135   7.131  25.107  -7.904
  996    HG1  THR 135           HG1      THR 135   6.952  25.123  -5.737
  997   HG21  THR 135          HG21      THR 135   6.232  23.248  -9.222
  998   HG22  THR 135          HG22      THR 135   5.637  22.463  -7.735
  999   HG23  THR 135          HG23      THR 135   4.983  24.028  -8.249
 1000    H    LEU 136           H        LEU 136   8.132  22.542  -4.920
 1001    HA   LEU 136           HA       LEU 136   8.293  19.672  -5.522
 1002    HB2  LEU 136           HB2      LEU 136   7.389  21.138  -3.006
 1003    HB3  LEU 136           HB3      LEU 136   7.659  19.404  -3.149
 1004    HG   LEU 136           HG       LEU 136   9.788  21.580  -3.354
 1005   HD11  LEU 136          HD11      LEU 136  10.621  20.596  -1.271
 1006   HD12  LEU 136          HD12      LEU 136   8.943  21.125  -1.075
 1007   HD13  LEU 136          HD13      LEU 136   9.308  19.397  -1.284
 1008   HD21  LEU 136          HD21      LEU 136  10.046  18.555  -3.619
 1009   HD22  LEU 136          HD22      LEU 136  10.470  19.792  -4.828
 1010   HD23  LEU 136          HD23      LEU 136  11.409  19.666  -3.340
 1011    H    ALA 137           H        ALA 137   6.674  18.336  -5.918
 1012    HA   ALA 137           HA       ALA 137   4.574  17.874  -6.926
 1013    HB1  ALA 137           HB1      ALA 137   4.319  17.896  -3.895
 1014    HB2  ALA 137           HB2      ALA 137   3.357  16.905  -5.010
 1015    HB3  ALA 137           HB3      ALA 137   5.107  16.644  -4.877
 1016    H    ARG 138           H        ARG 138   4.097  20.016  -7.922
 1017    HA   ARG 138           HA       ARG 138   2.770  21.741  -8.477
 1018    HB2  ARG 138           HB2      ARG 138   0.592  20.043  -7.196
 1019    HB3  ARG 138           HB3      ARG 138   0.366  21.322  -8.382
 1020    HG2  ARG 138           HG2      ARG 138   1.998  19.939  -9.872
 1021    HG3  ARG 138           HG3      ARG 138   1.587  18.600  -8.787
 1022    HD2  ARG 138           HD2      ARG 138  -0.288  20.290 -10.492
 1023    HD3  ARG 138           HD3      ARG 138   0.177  18.635 -10.808
 1024    HE   ARG 138           HE       ARG 138  -1.118  17.875  -8.909
 1025   HH11  ARG 138          HH21      ARG 138  -1.691  21.273  -9.597
 1026   HH12  ARG 138          HH22      ARG 138  -3.377  21.174  -9.205
 1027   HH21  ARG 138          HH11      ARG 138  -3.229  17.881  -8.163
 1028   HH22  ARG 138          HH12      ARG 138  -4.150  19.354  -8.213
 1029    H    ASP 139           H        ASP 139   3.811  22.063  -5.570
 1030    HA   ASP 139           HA       ASP 139   1.892  23.408  -4.056
 1031    HB2  ASP 139           HB2      ASP 139   4.100  22.640  -3.283
 1032    HB3  ASP 139           HB3      ASP 139   4.870  23.950  -4.170
 1033    H    THR 140           H        THR 140   3.365  24.681  -6.938
 1034    HA   THR 140           HA       THR 140   1.619  27.068  -6.638
 1035    HB   THR 140           HB       THR 140   3.918  27.734  -6.105
 1036    HG1  THR 140           HG1      THR 140   2.830  28.801  -8.469
 1037   HG21  THR 140          HG21      THR 140   5.241  26.338  -7.582
 1038   HG22  THR 140          HG22      THR 140   4.582  27.146  -9.018
 1039   HG23  THR 140          HG23      THR 140   5.587  28.045  -7.861
 1040    H    ARG 141           H        ARG 141   1.181  24.534  -8.004
 1041    HA   ARG 141           HA       ARG 141   0.567  25.580 -10.735
 1042    HB2  ARG 141           HB2      ARG 141   2.714  24.236 -10.652
 1043    HB3  ARG 141           HB3      ARG 141   1.754  22.815 -10.304
 1044    HG2  ARG 141           HG2      ARG 141   1.396  24.564 -12.797
 1045    HG3  ARG 141           HG3      ARG 141   2.509  23.215 -12.689
 1046    HD2  ARG 141           HD2      ARG 141   0.791  22.175 -13.740
 1047    HD3  ARG 141           HD3      ARG 141   0.441  21.766 -12.072
 1048    HE   ARG 141           HE       ARG 141  -1.491  23.127 -12.134
 1049   HH11  ARG 141          HH11      ARG 141   0.174  23.454 -15.242
 1050   HH12  ARG 141          HH12      ARG 141  -1.142  24.392 -15.887
 1051   HH21  ARG 141          HH21      ARG 141  -3.063  24.149 -13.044
 1052   HH22  ARG 141          HH22      ARG 141  -2.972  24.761 -14.696
 1053    HA   PRO 142           HA       PRO 142  -3.105  24.048  -8.263
 1054    HB2  PRO 142           HB2      PRO 142  -4.301  26.000 -10.239
 1055    HB3  PRO 142           HB3      PRO 142  -4.780  25.679  -8.542
 1056    HG2  PRO 142           HG2      PRO 142  -3.241  27.822  -9.120
 1057    HG3  PRO 142           HG3      PRO 142  -2.830  26.791  -7.708
 1058    HD2  PRO 142           HD2      PRO 142  -1.586  26.792 -10.463
 1059    HD3  PRO 142           HD3      PRO 142  -0.806  26.701  -8.859
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1   6.385  13.830   0.998
    2    H2   MET   1           H2       MET   1   6.668  13.288  -0.522
    3    H3   MET   1           H3       MET   1   5.131  13.455   0.010
    4    HA   MET   1           HA       MET   1   7.114  11.512   1.014
    5    HB2  MET   1           HB2      MET   1   4.251  12.028   1.941
    6    HB3  MET   1           HB3      MET   1   5.134  10.540   2.263
    7    HG2  MET   1           HG2      MET   1   5.331  11.861   4.195
    8    HG3  MET   1           HG3      MET   1   6.912  11.833   3.424
    9    HE1  MET   1           HE1      MET   1   6.834  15.294   5.267
   10    HE2  MET   1           HE2      MET   1   6.101  13.769   5.811
   11    HE3  MET   1           HE3      MET   1   7.706  13.762   5.044
   12    H    ALA   2           H        ALA   2   6.791   9.356   0.410
   13    HA   ALA   2           HA       ALA   2   4.629   8.676  -1.489
   14    HB1  ALA   2           HB1      ALA   2   7.572   8.443  -2.257
   15    HB2  ALA   2           HB2      ALA   2   6.212   7.785  -3.174
   16    HB3  ALA   2           HB3      ALA   2   6.374   9.536  -2.979
   17    H    TYR   3           H        TYR   3   4.527   6.372  -1.953
   18    HA   TYR   3           HA       TYR   3   4.367   4.898   0.439
   19    HB2  TYR   3           HB2      TYR   3   2.888   4.632  -1.461
   20    HB3  TYR   3           HB3      TYR   3   4.197   4.080  -2.480
   21    HD1  TYR   3           HD2      TYR   3   2.308   3.178   0.642
   22    HD2  TYR   3           HD1      TYR   3   4.626   1.772  -2.717
   23    HE1  TYR   3           HE2      TYR   3   1.783   0.825   1.263
   24    HE2  TYR   3           HE1      TYR   3   4.093  -0.577  -2.103
   25    HH   TYR   3           HH       TYR   3   2.064  -1.388   0.742
   26    H    GLY   4           H        GLY   4   7.069   4.986  -1.811
   27    HA2  GLY   4           HA2      GLY   4   8.843   3.754   0.059
   28    HA3  GLY   4           HA3      GLY   4   8.481   2.620  -1.251
   29    H    ARG   5           H        ARG   5  11.056   3.548  -0.837
   30    HA   ARG   5           HA       ARG   5  12.892   4.625  -1.709
   31    HB2  ARG   5           HB2      ARG   5  11.289   4.489  -4.298
   32    HB3  ARG   5           HB3      ARG   5  13.028   4.683  -4.180
   33    HG2  ARG   5           HG2      ARG   5  11.480   2.223  -3.246
   34    HG3  ARG   5           HG3      ARG   5  12.321   2.380  -4.780
   35    HD2  ARG   5           HD2      ARG   5  13.684   2.561  -2.059
   36    HD3  ARG   5           HD3      ARG   5  13.608   1.110  -3.072
   37    HE   ARG   5           HE       ARG   5  14.630   3.130  -4.738
   38   HH11  ARG   5          HH11      ARG   5  15.832   1.515  -1.847
   39   HH12  ARG   5          HH12      ARG   5  17.482   1.761  -2.344
   40   HH21  ARG   5          HH21      ARG   5  16.553   3.374  -5.267
   41   HH22  ARG   5          HH22      ARG   5  17.925   2.801  -4.302
   42    H    GLU   6           H        GLU   6  10.604   6.412  -0.822
   43    HA   GLU   6           HA       GLU   6  10.239   8.570  -2.498
   44    HB2  GLU   6           HB2      GLU   6   9.269   9.717  -0.674
   45    HB3  GLU   6           HB3      GLU   6   8.902   7.996  -0.523
   46    HG2  GLU   6           HG2      GLU   6  10.760   7.805   1.168
   47    HG3  GLU   6           HG3      GLU   6  10.915   9.567   1.120
   48    H    ASP   7           H        ASP   7  12.944   8.349  -0.150
   49    HA   ASP   7           HA       ASP   7  13.810  11.067  -0.549
   50    HB2  ASP   7           HB2      ASP   7  14.423   9.672   1.400
   51    HB3  ASP   7           HB3      ASP   7  15.360   8.607   0.351
   52    H    VAL   8           H        VAL   8  14.648   8.028  -2.171
   53    HA   VAL   8           HA       VAL   8  16.680   9.200  -3.914
   54    HB   VAL   8           HB       VAL   8  15.131   6.606  -4.324
   55   HG11  VAL   8          HG11      VAL   8  17.777   7.633  -5.464
   56   HG12  VAL   8          HG12      VAL   8  17.102   6.011  -5.721
   57   HG13  VAL   8          HG13      VAL   8  16.265   7.423  -6.371
   58   HG21  VAL   8          HG21      VAL   8  17.809   7.108  -2.947
   59   HG22  VAL   8          HG22      VAL   8  16.328   6.496  -2.178
   60   HG23  VAL   8          HG23      VAL   8  17.163   5.512  -3.380
   61    H    ALA   9           H        ALA   9  13.200   8.300  -4.313
   62    HA   ALA   9           HA       ALA   9  12.944   9.224  -6.973
   63    HB1  ALA   9           HB1      ALA   9  10.540   9.287  -6.484
   64    HB2  ALA   9           HB2      ALA   9  11.286   7.825  -5.806
   65    HB3  ALA   9           HB3      ALA   9  10.867   9.187  -4.740
   66    H    ASN  10           H        ASN  10  12.550  11.110  -3.891
   67    HA   ASN  10           HA       ASN  10  11.945  13.598  -5.185
   68    HB2  ASN  10           HB2      ASN  10  11.594  13.100  -2.741
   69    HB3  ASN  10           HB3      ASN  10  13.340  13.096  -2.511
   70   HD21  ASN  10          HD22      ASN  10  10.536  15.149  -3.344
   71   HD22  ASN  10          HD21      ASN  10  11.366  16.648  -2.980
   72    H    THR  11           H        THR  11  15.097  12.247  -4.139
   73    HA   THR  11           HA       THR  11  16.743  14.383  -5.041
   74    HB   THR  11           HB       THR  11  17.362  11.400  -5.025
   75    HG1  THR  11           HG1      THR  11  16.805  12.016  -3.008
   76   HG21  THR  11          HG21      THR  11  19.086  12.634  -6.279
   77   HG22  THR  11          HG22      THR  11  19.202  13.837  -4.974
   78   HG23  THR  11          HG23      THR  11  19.715  12.157  -4.697
   79    H    ARG  12           H        ARG  12  15.699  11.442  -6.844
   80    HA   ARG  12           HA       ARG  12  16.849  12.308  -9.357
   81    HB2  ARG  12           HB2      ARG  12  14.725  10.211  -8.778
   82    HB3  ARG  12           HB3      ARG  12  15.519  10.467 -10.332
   83    HG2  ARG  12           HG2      ARG  12  16.851   9.525  -7.760
   84    HG3  ARG  12           HG3      ARG  12  16.551   8.595  -9.218
   85    HD2  ARG  12           HD2      ARG  12  18.108  10.208 -10.442
   86    HD3  ARG  12           HD3      ARG  12  18.501  10.899  -8.870
   87    HE   ARG  12           HE       ARG  12  19.720   8.997  -8.294
   88   HH11  ARG  12          HH11      ARG  12  18.071   8.298 -11.363
   89   HH12  ARG  12          HH12      ARG  12  18.992   6.785 -11.499
   90   HH21  ARG  12          HH21      ARG  12  20.775   7.012  -8.714
   91   HH22  ARG  12          HH22      ARG  12  20.324   6.150 -10.186
   92    H    ALA  13           H        ALA  13  13.645  13.004  -7.957
   93    HA   ALA  13           HA       ALA  13  12.552  14.100 -10.368
   94    HB1  ALA  13           HB1      ALA  13  12.067  15.039  -7.508
   95    HB2  ALA  13           HB2      ALA  13  10.993  15.200  -8.912
   96    HB3  ALA  13           HB3      ALA  13  11.305  13.604  -8.221
   97    H    ARG  14           H        ARG  14  14.447  15.590  -7.747
   98    HA   ARG  14           HA       ARG  14  14.539  18.262  -8.873
   99    HB2  ARG  14           HB2      ARG  14  16.168  16.807  -6.741
  100    HB3  ARG  14           HB3      ARG  14  16.339  18.533  -7.088
  101    HG2  ARG  14           HG2      ARG  14  14.181  19.061  -6.290
  102    HG3  ARG  14           HG3      ARG  14  13.582  17.416  -6.498
  103    HD2  ARG  14           HD2      ARG  14  13.769  17.884  -4.166
  104    HD3  ARG  14           HD3      ARG  14  14.889  16.600  -4.643
  105    HE   ARG  14           HE       ARG  14  16.224  19.155  -4.648
  106   HH11  ARG  14          HH11      ARG  14  15.005  16.732  -2.411
  107   HH12  ARG  14          HH12      ARG  14  16.204  17.130  -1.204
  108   HH21  ARG  14          HH21      ARG  14  17.714  19.601  -3.043
  109   HH22  ARG  14          HH22      ARG  14  17.675  18.714  -1.552
  110    H    GLU  15           H        GLU  15  16.819  15.534  -8.955
  111    HA   GLU  15           HA       GLU  15  18.776  16.858 -10.627
  112    HB2  GLU  15           HB2      GLU  15  18.129  13.947 -10.061
  113    HB3  GLU  15           HB3      GLU  15  19.455  14.422 -11.120
  114    HG2  GLU  15           HG2      GLU  15  19.215  15.345  -8.223
  115    HG3  GLU  15           HG3      GLU  15  20.094  13.907  -8.727
  116    H    THR  16           H        THR  16  15.894  14.844 -11.534
  117    HA   THR  16           HA       THR  16  16.575  14.992 -14.361
  118    HB   THR  16           HB       THR  16  13.782  14.494 -13.303
  119    HG1  THR  16           HG1      THR  16  15.039  13.005 -12.320
  120   HG21  THR  16          HG21      THR  16  13.654  13.117 -15.355
  121   HG22  THR  16          HG22      THR  16  14.053  14.784 -15.799
  122   HG23  THR  16          HG23      THR  16  15.327  13.556 -15.777
  123    H    ALA  17           H        ALA  17  14.604  17.062 -12.234
  124    HA   ALA  17           HA       ALA  17  13.772  18.859 -14.295
  125    HB1  ALA  17           HB1      ALA  17  14.328  19.325 -11.333
  126    HB2  ALA  17           HB2      ALA  17  13.471  20.447 -12.409
  127    HB3  ALA  17           HB3      ALA  17  12.781  18.840 -12.059
  128    H    ALA  18           H        ALA  18  16.727  18.976 -12.209
  129    HA   ALA  18           HA       ALA  18  17.890  21.262 -13.427
  130    HB1  ALA  18           HB1      ALA  18  18.659  20.242 -11.313
  131    HB2  ALA  18           HB2      ALA  18  19.228  18.807 -12.191
  132    HB3  ALA  18           HB3      ALA  18  19.993  20.384 -12.473
  133    H    ARG  19           H        ARG  19  18.196  17.807 -14.315
  134    HA   ARG  19           HA       ARG  19  19.988  18.197 -16.557
  135    HB2  ARG  19           HB2      ARG  19  18.062  15.947 -15.845
  136    HB3  ARG  19           HB3      ARG  19  19.104  15.924 -17.268
  137    HG2  ARG  19           HG2      ARG  19  21.114  16.064 -15.943
  138    HG3  ARG  19           HG3      ARG  19  20.205  16.192 -14.442
  139    HD2  ARG  19           HD2      ARG  19  20.059  13.821 -16.357
  140    HD3  ARG  19           HD3      ARG  19  21.131  13.905 -14.947
  141    HE   ARG  19           HE       ARG  19  18.476  14.413 -14.071
  142   HH11  ARG  19          HH11      ARG  19  20.517  11.706 -15.013
  143   HH12  ARG  19          HH12      ARG  19  19.479  10.558 -14.206
  144   HH21  ARG  19          HH21      ARG  19  17.047  12.702 -13.333
  145   HH22  ARG  19          HH22      ARG  19  17.742  11.123 -13.177
  146    H    PHE  20           H        PHE  20  16.398  17.905 -16.500
  147    HA   PHE  20           HA       PHE  20  16.059  18.341 -19.300
  148    HB2  PHE  20           HB2      PHE  20  14.269  17.450 -17.917
  149    HB3  PHE  20           HB3      PHE  20  14.219  18.927 -16.957
  150    HD1  PHE  20           HD1      PHE  20  13.861  17.738 -20.531
  151    HD2  PHE  20           HD2      PHE  20  12.787  20.707 -17.588
  152    HE1  PHE  20           HE1      PHE  20  12.203  18.699 -22.095
  153    HE2  PHE  20           HE2      PHE  20  11.192  21.718 -19.200
  154    HZ   PHE  20           HZ       PHE  20  10.884  20.702 -21.452
  155    H    THR  21           H        THR  21  16.241  20.720 -16.601
  156    HA   THR  21           HA       THR  21  15.776  23.026 -18.223
  157    HB   THR  21           HB       THR  21  17.496  22.869 -15.716
  158    HG1  THR  21           HG1      THR  21  15.480  22.079 -15.286
  159   HG21  THR  21          HG21      THR  21  16.007  25.177 -17.057
  160   HG22  THR  21          HG22      THR  21  16.632  25.231 -15.400
  161   HG23  THR  21          HG23      THR  21  17.757  25.048 -16.747
  162    H    ALA  22           H        ALA  22  18.919  21.370 -17.449
  163    HA   ALA  22           HA       ALA  22  20.489  23.076 -19.123
  164    HB1  ALA  22           HB1      ALA  22  20.922  20.157 -18.344
  165    HB2  ALA  22           HB2      ALA  22  22.155  21.265 -18.980
  166    HB3  ALA  22           HB3      ALA  22  21.420  21.574 -17.395
  167    H    ALA  23           H        ALA  23  18.757  20.049 -19.918
  168    HA   ALA  23           HA       ALA  23  19.594  19.891 -22.646
  169    HB1  ALA  23           HB1      ALA  23  18.601  18.033 -21.355
  170    HB2  ALA  23           HB2      ALA  23  17.027  18.868 -21.367
  171    HB3  ALA  23           HB3      ALA  23  17.756  18.313 -22.884
  172    H    LEU  24           H        LEU  24  16.876  21.661 -21.155
  173    HA   LEU  24           HA       LEU  24  15.792  22.621 -23.646
  174    HB2  LEU  24           HB2      LEU  24  14.590  22.359 -21.447
  175    HB3  LEU  24           HB3      LEU  24  15.515  23.716 -20.827
  176    HG   LEU  24           HG       LEU  24  14.475  25.157 -22.658
  177   HD11  LEU  24          HD11      LEU  24  13.817  23.365 -24.244
  178   HD12  LEU  24          HD12      LEU  24  12.726  22.667 -23.029
  179   HD13  LEU  24          HD13      LEU  24  12.394  24.271 -23.713
  180   HD21  LEU  24          HD21      LEU  24  13.598  25.088 -20.339
  181   HD22  LEU  24          HD22      LEU  24  12.296  25.308 -21.524
  182   HD23  LEU  24          HD23      LEU  24  12.565  23.712 -20.784
  183    H    GLU  25           H        GLU  25  18.311  23.876 -21.434
  184    HA   GLU  25           HA       GLU  25  18.733  26.380 -22.789
  185    HB2  GLU  25           HB2      GLU  25  19.732  25.629 -20.548
  186    HB3  GLU  25           HB3      GLU  25  20.908  24.709 -21.482
  187    HG2  GLU  25           HG2      GLU  25  21.602  26.810 -22.642
  188    HG3  GLU  25           HG3      GLU  25  20.433  27.711 -21.675
  189    H    LEU  26           H        LEU  26  20.170  23.144 -23.287
  190    HA   LEU  26           HA       LEU  26  21.697  23.599 -25.630
  191    HB2  LEU  26           HB2      LEU  26  22.049  21.528 -24.707
  192    HB3  LEU  26           HB3      LEU  26  20.397  21.332 -24.220
  193    HG   LEU  26           HG       LEU  26  19.812  20.827 -26.675
  194   HD11  LEU  26          HD11      LEU  26  22.833  20.446 -26.809
  195   HD12  LEU  26          HD12      LEU  26  21.652  19.987 -28.055
  196   HD13  LEU  26          HD13      LEU  26  21.919  21.696 -27.680
  197   HD21  LEU  26          HD21      LEU  26  20.563  18.494 -26.440
  198   HD22  LEU  26          HD22      LEU  26  21.608  18.972 -25.082
  199   HD23  LEU  26          HD23      LEU  26  19.839  19.128 -24.957
  200    H    ALA  27           H        ALA  27  18.219  22.847 -25.351
  201    HA   ALA  27           HA       ALA  27  17.668  22.921 -28.142
  202    HB1  ALA  27           HB1      ALA  27  15.801  23.539 -25.818
  203    HB2  ALA  27           HB2      ALA  27  15.341  23.055 -27.457
  204    HB3  ALA  27           HB3      ALA  27  16.207  21.914 -26.410
  205    H    ILE  28           H        ILE  28  17.551  25.606 -25.733
  206    HA   ILE  28           HA       ILE  28  16.683  27.648 -27.583
  207    HB   ILE  28           HB       ILE  28  18.266  27.820 -24.991
  208   HG12  ILE  28          HG12      ILE  28  15.357  28.595 -25.420
  209   HG13  ILE  28          HG13      ILE  28  15.786  26.933 -25.045
  210   HG21  ILE  28          HG21      ILE  28  18.679  29.877 -26.270
  211   HG22  ILE  28          HG22      ILE  28  16.942  30.053 -26.605
  212   HG23  ILE  28          HG23      ILE  28  17.569  30.234 -24.955
  213   HD11  ILE  28          HD11      ILE  28  16.930  27.719 -22.960
  214   HD12  ILE  28          HD12      ILE  28  16.285  29.346 -23.282
  215   HD13  ILE  28          HD13      ILE  28  15.182  27.979 -23.017
  216    H    ASP  29           H        ASP  29  19.973  26.623 -26.568
  217    HA   ASP  29           HA       ASP  29  21.467  28.377 -28.214
  218    HB2  ASP  29           HB2      ASP  29  22.549  27.079 -26.517
  219    HB3  ASP  29           HB3      ASP  29  21.978  25.564 -27.202
  220    H    ARG  30           H        ARG  30  20.060  25.189 -29.040
  221    HA   ARG  30           HA       ARG  30  21.057  25.386 -31.764
  222    HB2  ARG  30           HB2      ARG  30  20.196  23.265 -30.224
  223    HB3  ARG  30           HB3      ARG  30  18.769  23.534 -31.195
  224    HG2  ARG  30           HG2      ARG  30  19.762  22.287 -32.785
  225    HG3  ARG  30           HG3      ARG  30  20.822  23.643 -33.112
  226    HD2  ARG  30           HD2      ARG  30  21.346  21.259 -31.288
  227    HD3  ARG  30           HD3      ARG  30  22.138  21.639 -32.821
  228    HE   ARG  30           HE       ARG  30  22.437  23.624 -30.634
  229   HH11  ARG  30          HH11      ARG  30  24.056  20.926 -32.320
  230   HH12  ARG  30          HH12      ARG  30  25.562  21.351 -31.561
  231   HH21  ARG  30          HH21      ARG  30  24.400  24.082 -29.849
  232   HH22  ARG  30          HH22      ARG  30  25.767  23.060 -30.243
  233    H    ALA  31           H        ALA  31  17.959  26.315 -30.288
  234    HA   ALA  31           HA       ALA  31  16.507  26.738 -32.691
  235    HB1  ALA  31           HB1      ALA  31  15.583  26.771 -30.318
  236    HB2  ALA  31           HB2      ALA  31  16.300  28.376 -30.123
  237    HB3  ALA  31           HB3      ALA  31  15.035  28.104 -31.341
  238    H    THR  32           H        THR  32  18.839  28.919 -31.087
  239    HA   THR  32           HA       THR  32  18.190  31.095 -32.937
  240    HB   THR  32           HB       THR  32  18.949  31.538 -30.642
  241    HG1  THR  32           HG1      THR  32  19.172  33.159 -32.089
  242   HG21  THR  32          HG21      THR  32  20.692  29.925 -30.262
  243   HG22  THR  32          HG22      THR  32  21.672  30.565 -31.607
  244   HG23  THR  32          HG23      THR  32  21.387  31.541 -30.149
  245    H    LEU  33           H        LEU  33  20.414  28.375 -33.025
  246    HA   LEU  33           HA       LEU  33  22.010  29.613 -35.119
  247    HB2  LEU  33           HB2      LEU  33  23.673  28.152 -34.603
  248    HB3  LEU  33           HB3      LEU  33  22.842  28.323 -33.066
  249    HG   LEU  33           HG       LEU  33  21.641  26.131 -33.635
  250   HD11  LEU  33          HD11      LEU  33  24.039  25.883 -35.522
  251   HD12  LEU  33          HD12      LEU  33  23.032  24.528 -34.972
  252   HD13  LEU  33          HD13      LEU  33  22.339  25.762 -36.002
  253   HD21  LEU  33          HD21      LEU  33  24.650  26.219 -33.120
  254   HD22  LEU  33          HD22      LEU  33  23.376  26.373 -31.896
  255   HD23  LEU  33          HD23      LEU  33  23.594  24.844 -32.756
  256    H    SER  34           H        SER  34  19.555  27.101 -34.896
  257    HA   SER  34           HA       SER  34  20.257  25.923 -37.474
  258    HB2  SER  34           HB2      SER  34  18.536  24.287 -36.958
  259    HB3  SER  34           HB3      SER  34  19.636  24.528 -35.588
  260    HG   SER  34           HG       SER  34  18.126  25.608 -34.507
  261    H    GLY  35           H        GLY  35  18.012  28.426 -36.632
  262    HA2  GLY  35           HA2      GLY  35  17.040  29.833 -38.223
  263    HA3  GLY  35           HA3      GLY  35  17.363  28.653 -39.490
  264    H    GLN  36           H        GLN  36  15.736  27.157 -36.943
  265    HA   GLN  36           HA       GLN  36  12.985  27.988 -37.600
  266    HB2  GLN  36           HB2      GLN  36  13.481  25.967 -39.075
  267    HB3  GLN  36           HB3      GLN  36  13.924  25.084 -37.616
  268    HG2  GLN  36           HG2      GLN  36  11.494  25.529 -36.805
  269    HG3  GLN  36           HG3      GLN  36  11.164  25.993 -38.470
  270   HE21  GLN  36          HE22      GLN  36  12.061  23.358 -36.220
  271   HE22  GLN  36          HE21      GLN  36  11.622  22.071 -37.367
  272    HA   PRO  37           HA       PRO  37  12.695  27.398 -33.084
  273    HB2  PRO  37           HB2      PRO  37  10.093  26.077 -33.941
  274    HB3  PRO  37           HB3      PRO  37  10.385  27.105 -32.505
  275    HG2  PRO  37           HG2      PRO  37   9.281  28.195 -34.715
  276    HG3  PRO  37           HG3      PRO  37  10.602  29.072 -33.878
  277    HD2  PRO  37           HD2      PRO  37  10.723  27.476 -36.411
  278    HD3  PRO  37           HD3      PRO  37  11.595  28.967 -35.968
  279    H    VAL  38           H        VAL  38  12.909  25.690 -31.623
  280    HA   VAL  38           HA       VAL  38  13.548  22.975 -32.742
  281    HB   VAL  38           HB       VAL  38  15.037  24.719 -30.786
  282   HG11  VAL  38          HG11      VAL  38  15.642  21.778 -31.218
  283   HG12  VAL  38          HG12      VAL  38  16.646  22.950 -30.362
  284   HG13  VAL  38          HG13      VAL  38  15.079  22.518 -29.703
  285   HG21  VAL  38          HG21      VAL  38  15.520  24.926 -33.227
  286   HG22  VAL  38          HG22      VAL  38  16.899  24.194 -32.397
  287   HG23  VAL  38          HG23      VAL  38  15.780  23.195 -33.337
  288    H    GLY  39           H        GLY  39  13.398  21.207 -30.951
  289    HA2  GLY  39           HA2      GLY  39  11.447  21.890 -28.838
  290    HA3  GLY  39           HA3      GLY  39  10.831  20.922 -30.161
  291    H    ILE  40           H        ILE  40  10.433  19.786 -27.993
  292    HA   ILE  40           HA       ILE  40  12.437  17.600 -27.784
  293    HB   ILE  40           HB       ILE  40  11.114  18.787 -25.322
  294   HG12  ILE  40          HG12      ILE  40  13.977  19.123 -26.325
  295   HG13  ILE  40          HG13      ILE  40  12.766  20.394 -26.206
  296   HG21  ILE  40          HG21      ILE  40  12.639  17.223 -24.137
  297   HG22  ILE  40          HG22      ILE  40  11.589  16.349 -25.237
  298   HG23  ILE  40          HG23      ILE  40  13.266  16.649 -25.697
  299   HD11  ILE  40          HD11      ILE  40  14.306  20.631 -24.396
  300   HD12  ILE  40          HD12      ILE  40  12.709  20.184 -23.769
  301   HD13  ILE  40          HD13      ILE  40  14.023  18.975 -23.845
  302    H    HIS  41           H        HIS  41  11.559  15.764 -28.165
  303    HA   HIS  41           HA       HIS  41   8.631  15.424 -28.362
  304    HB2  HIS  41           HB2      HIS  41   9.922  14.873 -30.294
  305    HB3  HIS  41           HB3      HIS  41  11.068  13.908 -29.368
  306    HD1  HIS  41           HD1      HIS  41  10.530  11.365 -29.199
  307    HD2  HIS  41           HD2      HIS  41   7.340  13.765 -30.531
  308    HE1  HIS  41           HE1      HIS  41   8.696   9.764 -29.956
  309    H    PHE  42           H        PHE  42   7.532  13.942 -27.268
  310    HA   PHE  42           HA       PHE  42   8.803  12.284 -25.151
  311    HB2  PHE  42           HB2      PHE  42   6.627  14.397 -24.839
  312    HB3  PHE  42           HB3      PHE  42   6.877  13.112 -23.678
  313    HD1  PHE  42           HD1      PHE  42   8.793  13.050 -22.192
  314    HD2  PHE  42           HD2      PHE  42   8.256  16.346 -24.940
  315    HE1  PHE  42           HE1      PHE  42  10.405  14.407 -20.891
  316    HE2  PHE  42           HE2      PHE  42   9.819  17.703 -23.594
  317    HZ   PHE  42           HZ       PHE  42  10.898  16.742 -21.571
  318    H    SER  43           H        SER  43   7.985  10.294 -25.149
  319    HA   SER  43           HA       SER  43   5.208   9.795 -26.096
  320    HB2  SER  43           HB2      SER  43   6.932   9.280 -27.861
  321    HB3  SER  43           HB3      SER  43   7.550   8.012 -26.777
  322    HG   SER  43           HG       SER  43   5.962   7.211 -28.231
  323    H    ASP  44           H        ASP  44   4.817   7.268 -25.559
  324    HA   ASP  44           HA       ASP  44   4.304   7.401 -22.786
  325    HB2  ASP  44           HB2      ASP  44   3.149   5.371 -23.014
  326    HB3  ASP  44           HB3      ASP  44   2.929   6.241 -24.521
  327    H    SER  45           H        SER  45   7.182   6.185 -24.231
  328    HA   SER  45           HA       SER  45   8.122   5.177 -21.584
  329    HB2  SER  45           HB2      SER  45   9.130   3.227 -22.663
  330    HB3  SER  45           HB3      SER  45   7.377   3.251 -22.904
  331    HG   SER  45           HG       SER  45   8.506   2.776 -24.842
  332    H    ALA  46           H        ALA  46   8.882   7.258 -24.194
  333    HA   ALA  46           HA       ALA  46  11.592   7.645 -23.214
  334    HB1  ALA  46           HB1      ALA  46  11.918   5.692 -24.720
  335    HB2  ALA  46           HB2      ALA  46  11.163   6.595 -26.052
  336    HB3  ALA  46           HB3      ALA  46  12.710   7.137 -25.363
  337    H    TRP  47           H        TRP  47  12.730   9.374 -24.306
  338    HA   TRP  47           HA       TRP  47  11.181  11.322 -25.901
  339    HB2  TRP  47           HB2      TRP  47  12.160  13.000 -24.003
  340    HB3  TRP  47           HB3      TRP  47  10.552  12.336 -24.009
  341    HD1  TRP  47           HD1      TRP  47  13.801  12.107 -22.097
  342    HE1  TRP  47           HE1      TRP  47  13.396  10.924 -19.869
  343    HE3  TRP  47           HE3      TRP  47   8.981  10.513 -22.863
  344    HZ2  TRP  47           HZ2      TRP  47  11.295   9.387 -18.602
  345    HZ3  TRP  47           HZ3      TRP  47   7.832   9.146 -21.151
  346    HH2  TRP  47           HH2      TRP  47   8.978   8.562 -19.026
  347    H    ARG  48           H        ARG  48  12.432  13.088 -26.700
  348    HA   ARG  48           HA       ARG  48  15.357  13.018 -26.742
  349    HB2  ARG  48           HB2      ARG  48  14.632  11.064 -28.246
  350    HB3  ARG  48           HB3      ARG  48  13.779  12.221 -29.252
  351    HG2  ARG  48           HG2      ARG  48  15.869  11.621 -30.292
  352    HG3  ARG  48           HG3      ARG  48  15.939  13.304 -29.832
  353    HD2  ARG  48           HD2      ARG  48  16.984  11.811 -27.624
  354    HD3  ARG  48           HD3      ARG  48  17.650  11.093 -29.087
  355    HE   ARG  48           HE       ARG  48  18.541  13.303 -29.725
  356   HH11  ARG  48          HH11      ARG  48  18.220  12.582 -26.307
  357   HH12  ARG  48          HH12      ARG  48  19.190  13.949 -25.866
  358   HH21  ARG  48          HH21      ARG  48  19.944  14.759 -29.114
  359   HH22  ARG  48          HH22      ARG  48  20.235  15.113 -27.423
  360    H    ILE  49           H        ILE  49  16.253  14.823 -27.723
  361    HA   ILE  49           HA       ILE  49  14.604  17.196 -28.095
  362    HB   ILE  49           HB       ILE  49  17.507  16.792 -28.868
  363   HG12  ILE  49          HG12      ILE  49  17.378  16.006 -26.591
  364   HG13  ILE  49          HG13      ILE  49  18.274  17.500 -26.727
  365   HG21  ILE  49          HG21      ILE  49  17.667  19.240 -28.313
  366   HG22  ILE  49          HG22      ILE  49  16.595  18.904 -29.675
  367   HG23  ILE  49          HG23      ILE  49  15.910  19.268 -28.080
  368   HD11  ILE  49          HD11      ILE  49  16.404  18.776 -25.773
  369   HD12  ILE  49          HD12      ILE  49  15.401  17.301 -25.747
  370   HD13  ILE  49          HD13      ILE  49  16.832  17.410 -24.723
  371    H    MET  50           H        MET  50  14.182  18.301 -30.143
  372    HA   MET  50           HA       MET  50  14.817  16.807 -32.646
  373    HB2  MET  50           HB2      MET  50  12.047  17.723 -31.781
  374    HB3  MET  50           HB3      MET  50  12.480  17.401 -33.461
  375    HG2  MET  50           HG2      MET  50  13.147  15.086 -32.836
  376    HG3  MET  50           HG3      MET  50  12.524  15.389 -31.211
  377    HE1  MET  50           HE1      MET  50  11.758  15.314 -35.004
  378    HE2  MET  50           HE2      MET  50  11.437  13.638 -34.514
  379    HE3  MET  50           HE3      MET  50  10.100  14.677 -35.080
  380    H    VAL  51           H        VAL  51  14.862  17.977 -34.508
  381    HA   VAL  51           HA       VAL  51  14.995  20.963 -34.366
  382    HB   VAL  51           HB       VAL  51  17.266  20.722 -35.513
  383   HG11  VAL  51          HG11      VAL  51  17.170  19.622 -32.688
  384   HG12  VAL  51          HG12      VAL  51  18.486  20.521 -33.480
  385   HG13  VAL  51          HG13      VAL  51  16.960  21.325 -33.117
  386   HG21  VAL  51          HG21      VAL  51  17.256  17.874 -34.466
  387   HG22  VAL  51          HG22      VAL  51  17.023  18.307 -36.169
  388   HG23  VAL  51          HG23      VAL  51  18.536  18.720 -35.358
  389    HA   PRO  52           HA       PRO  52  13.662  20.885 -38.670
  390    HB2  PRO  52           HB2      PRO  52  15.516  22.488 -39.996
  391    HB3  PRO  52           HB3      PRO  52  14.116  23.081 -39.062
  392    HG2  PRO  52           HG2      PRO  52  16.981  22.733 -38.120
  393    HG3  PRO  52           HG3      PRO  52  15.933  24.164 -37.909
  394    HD2  PRO  52           HD2      PRO  52  16.183  22.457 -35.894
  395    HD3  PRO  52           HD3      PRO  52  14.548  23.002 -36.323
  396    H    GLY  53           H        GLY  53  17.095  20.297 -38.103
  397    HA2  GLY  53           HA2      GLY  53  18.469  18.569 -38.640
  398    HA3  GLY  53           HA3      GLY  53  17.064  17.714 -39.257
  399    H    LYS  54           H        LYS  54  16.335  19.078 -41.461
  400    HA   LYS  54           HA       LYS  54  18.697  18.991 -43.332
  401    HB2  LYS  54           HB2      LYS  54  16.037  17.544 -43.623
  402    HB3  LYS  54           HB3      LYS  54  17.321  17.579 -44.836
  403    HG2  LYS  54           HG2      LYS  54  18.862  16.443 -43.245
  404    HG3  LYS  54           HG3      LYS  54  17.551  16.321 -42.064
  405    HD2  LYS  54           HD2      LYS  54  17.551  15.066 -44.839
  406    HD3  LYS  54           HD3      LYS  54  17.873  14.225 -43.315
  407    HE2  LYS  54           HE2      LYS  54  15.593  14.852 -42.502
  408    HE3  LYS  54           HE3      LYS  54  15.264  15.628 -44.054
  409    HZ1  LYS  54           HZ1      LYS  54  15.864  12.734 -43.700
  410    HZ2  LYS  54           HZ2      LYS  54  14.391  13.356 -44.006
  411    HZ3  LYS  54           HZ3      LYS  54  15.561  13.454 -45.132
  412    H    THR  55           H        THR  55  15.509  20.347 -42.710
  413    HA   THR  55           HA       THR  55  15.950  22.327 -44.852
  414    HB   THR  55           HB       THR  55  14.946  20.639 -46.117
  415    HG1  THR  55           HG1      THR  55  13.246  21.844 -46.905
  416   HG21  THR  55          HG21      THR  55  12.718  19.777 -45.858
  417   HG22  THR  55          HG22      THR  55  13.652  19.377 -44.413
  418   HG23  THR  55          HG23      THR  55  12.457  20.693 -44.368
  419    HA   PRO  56           HA       PRO  56  13.991  24.386 -41.202
  420    HB2  PRO  56           HB2      PRO  56  15.744  26.518 -41.142
  421    HB3  PRO  56           HB3      PRO  56  15.990  24.990 -40.254
  422    HG2  PRO  56           HG2      PRO  56  17.140  25.794 -42.935
  423    HG3  PRO  56           HG3      PRO  56  17.993  25.061 -41.539
  424    HD2  PRO  56           HD2      PRO  56  17.162  23.574 -43.650
  425    HD3  PRO  56           HD3      PRO  56  17.075  22.923 -41.990
  426    H    SER  57           H        SER  57  14.689  25.019 -44.523
  427    HA   SER  57           HA       SER  57  13.423  27.485 -45.027
  428    HB2  SER  57           HB2      SER  57  13.475  24.976 -46.750
  429    HB3  SER  57           HB3      SER  57  13.236  26.639 -47.319
  430    HG   SER  57           HG       SER  57  15.346  27.123 -46.636
  431    H    ALA  58           H        ALA  58  11.933  24.531 -43.984
  432    HA   ALA  58           HA       ALA  58   9.260  25.745 -44.140
  433    HB1  ALA  58           HB1      ALA  58   8.282  23.703 -45.156
  434    HB2  ALA  58           HB2      ALA  58   9.450  24.450 -46.258
  435    HB3  ALA  58           HB3      ALA  58   9.905  23.002 -45.331
  436    H    TRP  59           H        TRP  59   7.678  24.255 -42.862
  437    HA   TRP  59           HA       TRP  59   8.743  23.589 -40.262
  438    HB2  TRP  59           HB2      TRP  59   6.463  24.309 -40.513
  439    HB3  TRP  59           HB3      TRP  59   6.107  23.011 -41.640
  440    HD1  TRP  59           HD1      TRP  59   5.541  20.654 -40.699
  441    HE1  TRP  59           HE1      TRP  59   4.767  19.817 -38.402
  442    HE3  TRP  59           HE3      TRP  59   7.051  24.629 -37.833
  443    HZ2  TRP  59           HZ2      TRP  59   4.699  20.792 -35.684
  444    HZ3  TRP  59           HZ3      TRP  59   6.643  24.627 -35.383
  445    HH2  TRP  59           HH2      TRP  59   5.457  22.731 -34.302
  446    H    ARG  60           H        ARG  60  10.140  21.966 -39.952
  447    HA   ARG  60           HA       ARG  60   9.265  19.217 -40.568
  448    HB2  ARG  60           HB2      ARG  60  10.661  19.993 -42.529
  449    HB3  ARG  60           HB3      ARG  60  12.005  20.263 -41.433
  450    HG2  ARG  60           HG2      ARG  60  12.222  18.202 -42.732
  451    HG3  ARG  60           HG3      ARG  60  12.219  17.863 -41.019
  452    HD2  ARG  60           HD2      ARG  60   9.529  17.716 -42.318
  453    HD3  ARG  60           HD3      ARG  60  10.712  16.585 -42.975
  454    HE   ARG  60           HE       ARG  60  11.091  15.970 -40.438
  455   HH11  ARG  60          HH11      ARG  60   7.967  16.275 -42.061
  456   HH12  ARG  60          HH12      ARG  60   7.225  15.255 -40.835
  457   HH21  ARG  60          HH21      ARG  60   9.985  14.846 -38.943
  458   HH22  ARG  60          HH22      ARG  60   8.255  14.562 -39.164
  459    H    TRP  61           H        TRP  61  10.351  17.636 -39.370
  460    HA   TRP  61           HA       TRP  61  12.002  18.502 -37.059
  461    HB2  TRP  61           HB2      TRP  61   9.453  16.847 -36.960
  462    HB3  TRP  61           HB3      TRP  61  10.584  17.045 -35.620
  463    HD1  TRP  61           HD1      TRP  61   7.537  18.534 -36.875
  464    HE1  TRP  61           HE1      TRP  61   7.126  20.874 -35.827
  465    HE3  TRP  61           HE3      TRP  61  12.129  19.291 -34.822
  466    HZ2  TRP  61           HZ2      TRP  61   8.570  22.700 -34.091
  467    HZ3  TRP  61           HZ3      TRP  61  12.585  21.270 -33.429
  468    HH2  TRP  61           HH2      TRP  61  10.831  22.977 -33.042
  469    H    VAL  62           H        VAL  62  13.580  17.190 -36.542
  470    HA   VAL  62           HA       VAL  62  13.670  14.334 -37.390
  471    HB   VAL  62           HB       VAL  62  15.916  16.388 -37.665
  472   HG11  VAL  62          HG11      VAL  62  17.163  14.621 -38.824
  473   HG12  VAL  62          HG12      VAL  62  16.784  14.115 -37.182
  474   HG13  VAL  62          HG13      VAL  62  15.842  13.471 -38.550
  475   HG21  VAL  62          HG21      VAL  62  14.226  15.037 -39.813
  476   HG22  VAL  62          HG22      VAL  62  14.330  16.779 -39.465
  477   HG23  VAL  62          HG23      VAL  62  15.724  15.936 -40.133
  478    HA   PRO  63           HA       PRO  63  14.943  14.116 -33.027
  479    HB2  PRO  63           HB2      PRO  63  16.120  11.636 -32.950
  480    HB3  PRO  63           HB3      PRO  63  14.351  11.906 -32.985
  481    HG2  PRO  63           HG2      PRO  63  16.186  11.270 -35.312
  482    HG3  PRO  63           HG3      PRO  63  14.610  10.519 -34.905
  483    HD2  PRO  63           HD2      PRO  63  14.808  12.473 -36.767
  484    HD3  PRO  63           HD3      PRO  63  13.411  12.414 -35.656
  485    H    LEU  64           H        LEU  64  16.611  15.046 -32.080
  486    HA   LEU  64           HA       LEU  64  18.970  15.670 -33.603
  487    HB2  LEU  64           HB2      LEU  64  17.820  17.280 -32.089
  488    HB3  LEU  64           HB3      LEU  64  18.282  16.268 -30.725
  489    HG   LEU  64           HG       LEU  64  20.698  16.719 -31.201
  490   HD11  LEU  64          HD11      LEU  64  21.285  18.564 -32.738
  491   HD12  LEU  64          HD12      LEU  64  20.588  17.196 -33.618
  492   HD13  LEU  64          HD13      LEU  64  19.609  18.631 -33.292
  493   HD21  LEU  64          HD21      LEU  64  19.494  18.113 -29.589
  494   HD22  LEU  64          HD22      LEU  64  20.700  19.057 -30.466
  495   HD23  LEU  64          HD23      LEU  64  18.980  19.213 -30.893
  496    H    GLN  65           H        GLN  65  19.702  13.420 -33.892
  497    HA   GLN  65           HA       GLN  65  21.234  12.274 -31.613
  498    HB2  GLN  65           HB2      GLN  65  20.845  11.317 -34.473
  499    HB3  GLN  65           HB3      GLN  65  21.743  10.456 -33.212
  500    HG2  GLN  65           HG2      GLN  65  19.690  10.356 -31.816
  501    HG3  GLN  65           HG3      GLN  65  18.760  11.116 -33.107
  502   HE21  GLN  65          HE22      GLN  65  18.519   8.356 -31.809
  503   HE22  GLN  65          HE21      GLN  65  18.780   7.233 -33.133
  504    H    GLU  66           H        GLU  66  21.796  14.831 -33.522
  505    HA   GLU  66           HA       GLU  66  24.368  14.723 -34.614
  506    HB2  GLU  66           HB2      GLU  66  22.775  16.595 -34.801
  507    HB3  GLU  66           HB3      GLU  66  22.992  16.959 -33.085
  508    HG2  GLU  66           HG2      GLU  66  25.379  17.510 -33.503
  509    HG3  GLU  66           HG3      GLU  66  25.159  17.126 -35.211
  510    H    ASP  67           H        ASP  67  26.136  13.949 -33.706
  511    HA   ASP  67           HA       ASP  67  27.774  13.300 -32.368
  512    HB2  ASP  67           HB2      ASP  67  28.179  15.726 -32.224
  513    HB3  ASP  67           HB3      ASP  67  27.213  15.799 -30.751
  514    H    ALA  68           H        ALA  68  24.816  13.944 -30.574
  515    HA   ALA  68           HA       ALA  68  25.375  12.365 -28.262
  516    HB1  ALA  68           HB1      ALA  68  22.674  13.041 -29.515
  517    HB2  ALA  68           HB2      ALA  68  23.041  12.713 -27.799
  518    HB3  ALA  68           HB3      ALA  68  23.640  14.184 -28.558
  519    H    ALA  69           H        ALA  69  24.544  11.431 -31.486
  520    HA   ALA  69           HA       ALA  69  24.387   9.524 -32.588
  521    HB1  ALA  69           HB1      ALA  69  25.616   7.594 -31.817
  522    HB2  ALA  69           HB2      ALA  69  26.488   9.060 -31.354
  523    HB3  ALA  69           HB3      ALA  69  25.553   8.163 -30.137
  524    H    ASP  70           H        ASP  70  23.676   7.032 -32.358
  525    HA   ASP  70           HA       ASP  70  20.838   7.201 -32.051
  526    HB2  ASP  70           HB2      ASP  70  22.108   6.026 -33.879
  527    HB3  ASP  70           HB3      ASP  70  22.522   4.769 -32.711
  528    H    GLU  71           H        GLU  71  22.393   7.333 -29.555
  529    HA   GLU  71           HA       GLU  71  20.803   5.394 -27.924
  530    HB2  GLU  71           HB2      GLU  71  23.688   6.242 -27.435
  531    HB3  GLU  71           HB3      GLU  71  22.722   5.276 -26.330
  532    HG2  GLU  71           HG2      GLU  71  23.614   4.455 -29.124
  533    HG3  GLU  71           HG3      GLU  71  24.303   3.912 -27.604
  534    H    SER  72           H        SER  72  21.001   8.471 -28.821
  535    HA   SER  72           HA       SER  72  21.060   9.885 -26.278
  536    HB2  SER  72           HB2      SER  72  20.585  11.848 -27.689
  537    HB3  SER  72           HB3      SER  72  21.948  10.889 -28.270
  538    HG   SER  72           HG       SER  72  20.863  10.214 -29.954
  539    H    GLN  73           H        GLN  73  18.510   8.494 -28.251
  540    HA   GLN  73           HA       GLN  73  16.336   9.804 -26.796
  541    HB2  GLN  73           HB2      GLN  73  14.864   8.346 -27.954
  542    HB3  GLN  73           HB3      GLN  73  16.016   9.015 -29.091
  543    HG2  GLN  73           HG2      GLN  73  16.002   6.174 -27.995
  544    HG3  GLN  73           HG3      GLN  73  15.468   6.678 -29.581
  545   HE21  GLN  73          HE22      GLN  73  17.606   4.729 -28.788
  546   HE22  GLN  73          HE21      GLN  73  19.020   5.294 -29.672
  547    H    ASN  74           H        ASN  74  15.570   9.298 -24.823
  548    HA   ASN  74           HA       ASN  74  16.280   6.724 -23.506
  549    HB2  ASN  74           HB2      ASN  74  17.379   9.474 -22.749
  550    HB3  ASN  74           HB3      ASN  74  17.327   8.148 -21.599
  551   HD21  ASN  74          HD22      ASN  74  19.095   9.462 -24.260
  552   HD22  ASN  74          HD21      ASN  74  20.193   8.095 -24.436
  553    H    ASP  75           H        ASP  75  15.624   6.919 -21.074
  554    HA   ASP  75           HA       ASP  75  12.860   7.992 -20.887
  555    HB2  ASP  75           HB2      ASP  75  12.327   6.058 -19.602
  556    HB3  ASP  75           HB3      ASP  75  13.083   5.548 -21.106
  557    H    TRP  76           H        TRP  76  15.377   9.319 -20.142
  558    HA   TRP  76           HA       TRP  76  16.331  10.668 -18.685
  559    HB2  TRP  76           HB2      TRP  76  13.486  10.763 -17.799
  560    HB3  TRP  76           HB3      TRP  76  14.655  11.368 -16.664
  561    HD1  TRP  76           HD1      TRP  76  12.422  12.926 -18.661
  562    HE1  TRP  76           HE1      TRP  76  13.214  15.082 -19.784
  563    HE3  TRP  76           HE3      TRP  76  17.485  12.390 -17.988
  564    HZ2  TRP  76           HZ2      TRP  76  15.726  16.373 -20.395
  565    HZ3  TRP  76           HZ3      TRP  76  19.034  14.108 -18.851
  566    HH2  TRP  76           HH2      TRP  76  18.177  16.105 -20.047
  567    H    ASP  77           H        ASP  77  14.747   8.108 -16.750
  568    HA   ASP  77           HA       ASP  77  17.120   7.996 -14.985
  569    HB2  ASP  77           HB2      ASP  77  15.421   9.935 -14.327
  570    HB3  ASP  77           HB3      ASP  77  14.432   8.595 -13.749
  571    H    GLU  78           H        GLU  78  16.064   6.650 -12.839
  572    HA   GLU  78           HA       GLU  78  14.870   4.130 -13.888
  573    HB2  GLU  78           HB2      GLU  78  16.499   2.811 -12.775
  574    HB3  GLU  78           HB3      GLU  78  17.371   4.024 -13.709
  575    HG2  GLU  78           HG2      GLU  78  17.264   5.377 -11.393
  576    HG3  GLU  78           HG3      GLU  78  17.044   3.765 -10.721
  577    H    GLU  79           H        GLU  79  14.909   6.572 -11.378
  578    HA   GLU  79           HA       GLU  79  12.844   5.036  -9.829
  579    HB2  GLU  79           HB2      GLU  79  14.777   7.214  -8.977
  580    HB3  GLU  79           HB3      GLU  79  13.545   6.533  -7.931
  581    HG2  GLU  79           HG2      GLU  79  15.619   4.702  -9.187
  582    HG3  GLU  79           HG3      GLU  79  16.029   5.707  -7.826
  583    H    LEU  80           H        LEU  80  12.957   7.265 -12.211
  584    HA   LEU  80           HA       LEU  80  10.750   8.943 -11.161
  585    HB2  LEU  80           HB2      LEU  80  13.222   9.808 -11.030
  586    HB3  LEU  80           HB3      LEU  80  13.084   9.967 -12.772
  587    HG   LEU  80           HG       LEU  80  12.903  12.036 -11.573
  588   HD11  LEU  80          HD11      LEU  80  11.729  11.593 -13.789
  589   HD12  LEU  80          HD12      LEU  80  10.214  11.596 -12.841
  590   HD13  LEU  80          HD13      LEU  80  11.276  13.018 -12.863
  591   HD21  LEU  80          HD21      LEU  80  11.818  11.354  -9.528
  592   HD22  LEU  80          HD22      LEU  80  10.849  12.617 -10.319
  593   HD23  LEU  80          HD23      LEU  80  10.328  10.941 -10.397
  594    H    SER  81           H        SER  81   9.270   9.505 -12.640
  595    HA   SER  81           HA       SER  81   9.519   8.759 -15.518
  596    HB2  SER  81           HB2      SER  81   7.305   7.728 -15.485
  597    HB3  SER  81           HB3      SER  81   8.413   6.885 -14.391
  598    HG   SER  81           HG       SER  81   6.334   7.268 -13.474
  599    H    ILE  82           H        ILE  82   7.962   9.831 -16.935
  600    HA   ILE  82           HA       ILE  82   7.344  12.575 -15.950
  601    HB   ILE  82           HB       ILE  82   8.727  11.454 -18.364
  602   HG12  ILE  82          HG12      ILE  82  10.114  13.514 -18.103
  603   HG13  ILE  82          HG13      ILE  82   9.152  13.970 -16.700
  604   HG21  ILE  82          HG21      ILE  82   6.957  12.600 -19.504
  605   HG22  ILE  82          HG22      ILE  82   7.189  14.061 -18.505
  606   HG23  ILE  82          HG23      ILE  82   8.438  13.532 -19.647
  607   HD11  ILE  82          HD11      ILE  82  10.024  12.118 -15.424
  608   HD12  ILE  82          HD12      ILE  82  10.755  11.375 -16.867
  609   HD13  ILE  82          HD13      ILE  82  11.387  12.899 -16.215
  610    H    HIS  83           H        HIS  83   5.566  13.642 -16.615
  611    HA   HIS  83           HA       HIS  83   3.646  12.468 -18.551
  612    HB2  HIS  83           HB2      HIS  83   2.875  13.512 -15.794
  613    HB3  HIS  83           HB3      HIS  83   1.748  13.050 -17.062
  614    HD1  HIS  83           HD1      HIS  83   1.354  10.398 -17.402
  615    HD2  HIS  83           HD2      HIS  83   4.123  11.519 -14.437
  616    HE1  HIS  83           HE1      HIS  83   1.821   8.301 -16.031
  617    H    LEU  84           H        LEU  84   2.060  14.170 -19.315
  618    HA   LEU  84           HA       LEU  84   3.128  16.957 -19.204
  619    HB2  LEU  84           HB2      LEU  84   2.981  15.052 -21.547
  620    HB3  LEU  84           HB3      LEU  84   2.657  16.742 -21.856
  621    HG   LEU  84           HG       LEU  84   5.235  15.787 -20.553
  622   HD11  LEU  84          HD11      LEU  84   6.215  16.187 -22.792
  623   HD12  LEU  84          HD12      LEU  84   5.015  14.882 -22.830
  624   HD13  LEU  84          HD13      LEU  84   4.594  16.495 -23.451
  625   HD21  LEU  84          HD21      LEU  84   6.048  18.025 -21.249
  626   HD22  LEU  84          HD22      LEU  84   4.439  18.433 -21.877
  627   HD23  LEU  84          HD23      LEU  84   4.684  18.185 -20.137
  628    H    GLN  85           H        GLN  85   1.817  18.587 -19.937
  629    HA   GLN  85           HA       GLN  85  -0.762  18.165 -21.152
  630    HB2  GLN  85           HB2      GLN  85  -2.082  19.386 -19.458
  631    HB3  GLN  85           HB3      GLN  85  -1.533  17.831 -18.873
  632    HG2  GLN  85           HG2      GLN  85   0.216  20.179 -18.216
  633    HG3  GLN  85           HG3      GLN  85  -1.375  20.163 -17.476
  634   HE21  GLN  85          HE22      GLN  85   1.804  18.635 -17.442
  635   HE22  GLN  85          HE21      GLN  85   1.440  17.616 -16.049
  636    HA   PRO  86           HA       PRO  86  -2.594  19.696 -21.676
  637    HB2  PRO  86           HB2      PRO  86  -3.361  21.221 -23.777
  638    HB3  PRO  86           HB3      PRO  86  -3.333  21.863 -22.107
  639    HG2  PRO  86           HG2      PRO  86  -1.201  22.177 -24.250
  640    HG3  PRO  86           HG3      PRO  86  -1.957  23.460 -23.249
  641    HD2  PRO  86           HD2      PRO  86   0.436  22.304 -22.589
  642    HD3  PRO  86           HD3      PRO  86  -0.735  22.823 -21.343
  643    H    PHE  87           H        PHE  87   0.296  19.790 -23.542
  644    HA   PHE  87           HA       PHE  87  -0.411  18.315 -25.863
  645    HB2  PHE  87           HB2      PHE  87   2.199  18.502 -24.300
  646    HB3  PHE  87           HB3      PHE  87   2.039  17.795 -25.900
  647    HD1  PHE  87           HD1      PHE  87   1.317  19.175 -27.863
  648    HD2  PHE  87           HD2      PHE  87   2.362  20.923 -24.053
  649    HE1  PHE  87           HE1      PHE  87   1.676  21.378 -28.962
  650    HE2  PHE  87           HE2      PHE  87   2.693  23.125 -25.157
  651    HZ   PHE  87           HZ       PHE  87   2.381  23.342 -27.610
  652    H    LYS  88           H        LYS  88   0.671  16.186 -26.295
  653    HA   LYS  88           HA       LYS  88  -0.263  14.137 -24.333
  654    HB2  LYS  88           HB2      LYS  88  -1.020  12.883 -26.395
  655    HB3  LYS  88           HB3      LYS  88  -1.978  14.259 -25.852
  656    HG2  LYS  88           HG2      LYS  88  -1.144  15.680 -27.627
  657    HG3  LYS  88           HG3      LYS  88   0.083  14.500 -28.085
  658    HD2  LYS  88           HD2      LYS  88  -1.698  14.444 -29.678
  659    HD3  LYS  88           HD3      LYS  88  -1.608  12.922 -28.787
  660    HE2  LYS  88           HE2      LYS  88  -3.927  13.447 -29.066
  661    HE3  LYS  88           HE3      LYS  88  -3.534  13.652 -27.362
  662    HZ1  LYS  88           HZ1      LYS  88  -4.877  15.496 -28.222
  663    HZ2  LYS  88           HZ2      LYS  88  -3.428  16.070 -27.759
  664    HZ3  LYS  88           HZ3      LYS  88  -3.761  15.863 -29.345
  665    HA   PRO  89           HA       PRO  89   3.869  12.572 -25.250
  666    HB2  PRO  89           HB2      PRO  89   3.992  10.505 -23.468
  667    HB3  PRO  89           HB3      PRO  89   4.152  12.223 -23.000
  668    HG2  PRO  89           HG2      PRO  89   1.684  10.474 -22.843
  669    HG3  PRO  89           HG3      PRO  89   2.335  11.592 -21.606
  670    HD2  PRO  89           HD2      PRO  89   0.300  12.263 -23.327
  671    HD3  PRO  89           HD3      PRO  89   1.472  13.467 -22.714
  672    H    ASP  90           H        ASP  90   3.684  11.818 -27.313
  673    HA   ASP  90           HA       ASP  90   3.051   9.016 -27.805
  674    HB2  ASP  90           HB2      ASP  90   0.798  10.108 -27.925
  675    HB3  ASP  90           HB3      ASP  90   1.419  11.222 -29.145
  676    H    ASP  91           H        ASP  91   3.647   8.362 -29.932
  677    HA   ASP  91           HA       ASP  91   6.153   9.429 -30.804
  678    HB2  ASP  91           HB2      ASP  91   5.550   7.030 -30.582
  679    HB3  ASP  91           HB3      ASP  91   4.442   7.193 -31.943
  680    H    SER  92           H        SER  92   4.590  11.498 -31.272
  681    HA   SER  92           HA       SER  92   3.242  11.749 -33.777
  682    HB2  SER  92           HB2      SER  92   2.791  13.126 -31.816
  683    HB3  SER  92           HB3      SER  92   4.421  13.815 -31.881
  684    HG   SER  92           HG       SER  92   2.593  15.028 -32.887
  685    H    ASN  93           H        ASN  93   3.730  13.234 -35.473
  686    HA   ASN  93           HA       ASN  93   6.331  13.042 -36.750
  687    HB2  ASN  93           HB2      ASN  93   4.241  13.160 -38.022
  688    HB3  ASN  93           HB3      ASN  93   3.813  14.687 -37.249
  689   HD21  ASN  93          HD22      ASN  93   4.003  16.342 -38.667
  690   HD22  ASN  93          HD21      ASN  93   5.272  16.496 -39.858
  691    H    GLN  94           H        GLN  94   5.140  15.072 -34.235
  692    HA   GLN  94           HA       GLN  94   7.382  17.001 -34.623
  693    HB2  GLN  94           HB2      GLN  94   5.942  18.814 -33.936
  694    HB3  GLN  94           HB3      GLN  94   5.195  18.007 -35.298
  695    HG2  GLN  94           HG2      GLN  94   3.492  17.046 -33.929
  696    HG3  GLN  94           HG3      GLN  94   4.385  17.309 -32.432
  697   HE21  GLN  94          HE22      GLN  94   4.520  19.424 -31.503
  698   HE22  GLN  94          HE21      GLN  94   3.394  20.682 -32.020
  699    HA   PRO  95           HA       PRO  95   8.107  16.409 -30.212
  700    HB2  PRO  95           HB2      PRO  95   9.043  18.873 -29.444
  701    HB3  PRO  95           HB3      PRO  95  10.004  17.726 -30.431
  702    HG2  PRO  95           HG2      PRO  95   8.300  20.056 -31.378
  703    HG3  PRO  95           HG3      PRO  95  10.002  19.675 -31.828
  704    HD2  PRO  95           HD2      PRO  95   7.950  18.961 -33.395
  705    HD3  PRO  95           HD3      PRO  95   9.328  17.853 -33.164
  706    H    GLN  96           H        GLN  96   7.408  17.184 -28.087
  707    HA   GLN  96           HA       GLN  96   4.661  18.332 -28.081
  708    HB2  GLN  96           HB2      GLN  96   6.296  16.657 -26.129
  709    HB3  GLN  96           HB3      GLN  96   4.848  17.517 -25.634
  710    HG2  GLN  96           HG2      GLN  96   4.154  15.328 -26.064
  711    HG3  GLN  96           HG3      GLN  96   3.523  16.320 -27.369
  712   HE21  GLN  96          HE22      GLN  96   3.248  14.031 -28.195
  713   HE22  GLN  96          HE21      GLN  96   4.606  13.298 -29.050
  714    H    VAL  97           H        VAL  97   7.936  19.147 -27.085
  715    HA   VAL  97           HA       VAL  97   6.897  21.760 -26.000
  716    HB   VAL  97           HB       VAL  97   9.575  20.413 -25.484
  717   HG11  VAL  97          HG11      VAL  97   9.896  22.815 -25.452
  718   HG12  VAL  97          HG12      VAL  97   8.413  23.052 -24.504
  719   HG13  VAL  97          HG13      VAL  97   9.834  22.261 -23.783
  720   HG21  VAL  97          HG21      VAL  97   7.190  20.866 -23.643
  721   HG22  VAL  97          HG22      VAL  97   7.770  19.295 -24.235
  722   HG23  VAL  97          HG23      VAL  97   8.776  20.242 -23.138
  723    H    VAL  98           H        VAL  98   7.704  23.649 -26.902
  724    HA   VAL  98           HA       VAL  98   9.560  23.452 -29.215
  725    HB   VAL  98           HB       VAL  98   6.862  24.852 -29.285
  726   HG11  VAL  98          HG11      VAL  98   8.507  26.173 -30.547
  727   HG12  VAL  98          HG12      VAL  98   9.090  24.706 -31.372
  728   HG13  VAL  98          HG13      VAL  98   7.452  25.325 -31.671
  729   HG21  VAL  98          HG21      VAL  98   6.622  22.429 -29.650
  730   HG22  VAL  98          HG22      VAL  98   6.396  23.289 -31.172
  731   HG23  VAL  98          HG23      VAL  98   7.935  22.461 -30.848
  732    H    ILE  99           H        ILE  99  10.892  25.061 -29.433
  733    HA   ILE  99           HA       ILE  99  10.957  27.359 -27.527
  734    HB   ILE  99           HB       ILE  99  13.295  25.731 -28.641
  735   HG12  ILE  99          HG12      ILE  99  13.672  25.226 -26.108
  736   HG13  ILE  99          HG13      ILE  99  11.942  25.515 -25.934
  737   HG21  ILE  99          HG21      ILE  99  13.838  28.094 -28.234
  738   HG22  ILE  99          HG22      ILE  99  13.209  27.979 -26.583
  739   HG23  ILE  99          HG23      ILE  99  14.632  27.040 -27.078
  740   HD11  ILE  99          HD11      ILE  99  12.681  23.091 -26.247
  741   HD12  ILE  99          HD12      ILE  99  11.438  23.622 -27.368
  742   HD13  ILE  99          HD13      ILE  99  13.129  23.514 -27.909
  743    H    LEU 100           H        LEU 100  10.905  29.246 -28.618
  744    HA   LEU 100           HA       LEU 100  11.094  29.268 -31.555
  745    HB2  LEU 100           HB2      LEU 100  10.552  31.440 -29.497
  746    HB3  LEU 100           HB3      LEU 100  10.604  31.727 -31.217
  747    HG   LEU 100           HG       LEU 100   8.342  31.669 -30.500
  748   HD11  LEU 100          HD11      LEU 100   8.846  29.095 -32.031
  749   HD12  LEU 100          HD12      LEU 100   7.388  30.098 -32.052
  750   HD13  LEU 100          HD13      LEU 100   8.890  30.730 -32.743
  751   HD21  LEU 100          HD21      LEU 100   7.160  29.799 -29.588
  752   HD22  LEU 100          HD22      LEU 100   8.597  28.769 -29.627
  753   HD23  LEU 100          HD23      LEU 100   8.520  30.159 -28.519
  754    H    ALA 101           H        ALA 101  12.582  30.400 -32.748
  755    HA   ALA 101           HA       ALA 101  15.295  30.408 -31.954
  756    HB1  ALA 101           HB1      ALA 101  13.938  31.936 -34.218
  757    HB2  ALA 101           HB2      ALA 101  15.670  31.562 -34.097
  758    HB3  ALA 101           HB3      ALA 101  14.498  30.247 -34.283
  759    H    ASP 102           H        ASP 102  12.915  32.893 -31.456
  760    HA   ASP 102           HA       ASP 102  14.650  35.142 -30.919
  761    HB2  ASP 102           HB2      ASP 102  12.316  35.393 -31.563
  762    HB3  ASP 102           HB3      ASP 102  11.785  34.418 -30.196
  763    H    GLY 103           H        GLY 103  13.809  32.300 -29.058
  764    HA2  GLY 103           HA2      GLY 103  14.937  31.686 -27.103
  765    HA3  GLY 103           HA3      GLY 103  15.186  33.373 -26.651
  766    H    GLN 104           H        GLN 104  11.958  32.889 -27.614
  767    HA   GLN 104           HA       GLN 104  10.930  32.605 -24.852
  768    HB2  GLN 104           HB2      GLN 104   8.806  33.351 -25.810
  769    HB3  GLN 104           HB3      GLN 104  10.101  34.496 -26.125
  770    HG2  GLN 104           HG2      GLN 104  10.293  33.521 -28.460
  771    HG3  GLN 104           HG3      GLN 104   8.874  32.524 -28.095
  772   HE21  GLN 104          HE22      GLN 104  10.059  35.878 -28.453
  773   HE22  GLN 104          HE21      GLN 104   8.459  36.556 -28.779
  774    H    ILE 105           H        ILE 105   9.145  31.052 -24.543
  775    HA   ILE 105           HA       ILE 105   9.545  28.519 -26.113
  776    HB   ILE 105           HB       ILE 105   9.727  28.808 -23.082
  777   HG12  ILE 105          HG12      ILE 105  11.889  27.750 -23.168
  778   HG13  ILE 105          HG13      ILE 105  11.809  27.544 -24.906
  779   HG21  ILE 105          HG21      ILE 105   9.734  26.324 -24.855
  780   HG22  ILE 105          HG22      ILE 105  10.137  26.316 -23.125
  781   HG23  ILE 105          HG23      ILE 105   8.514  26.741 -23.628
  782   HD11  ILE 105          HD11      ILE 105  12.379  29.784 -25.309
  783   HD12  ILE 105          HD12      ILE 105  11.930  30.296 -23.653
  784   HD13  ILE 105          HD13      ILE 105  13.375  29.312 -23.957
  785    H    THR 106           H        THR 106   7.759  27.176 -26.249
  786    HA   THR 106           HA       THR 106   5.181  28.313 -26.083
  787    HB   THR 106           HB       THR 106   5.951  26.354 -27.469
  788    HG1  THR 106           HG1      THR 106   3.873  25.591 -27.522
  789   HG21  THR 106          HG21      THR 106   5.104  24.652 -25.097
  790   HG22  THR 106          HG22      THR 106   5.641  24.112 -26.695
  791   HG23  THR 106          HG23      THR 106   6.795  24.895 -25.587
  792    HA   PRO 107           HA       PRO 107   4.110  27.598 -21.720
  793    HB2  PRO 107           HB2      PRO 107   1.269  27.607 -22.701
  794    HB3  PRO 107           HB3      PRO 107   2.008  28.538 -21.367
  795    HG2  PRO 107           HG2      PRO 107   1.417  29.723 -23.745
  796    HG3  PRO 107           HG3      PRO 107   2.938  30.117 -22.880
  797    HD2  PRO 107           HD2      PRO 107   2.548  28.201 -25.198
  798    HD3  PRO 107           HD3      PRO 107   3.800  29.462 -24.959
  799    H    PHE 108           H        PHE 108   4.024  25.662 -20.652
  800    HA   PHE 108           HA       PHE 108   2.041  23.654 -21.147
  801    HB2  PHE 108           HB2      PHE 108   3.400  21.758 -21.691
  802    HB3  PHE 108           HB3      PHE 108   3.685  22.971 -22.910
  803    HD1  PHE 108           HD1      PHE 108   5.768  24.418 -22.720
  804    HD2  PHE 108           HD2      PHE 108   5.256  20.785 -20.490
  805    HE1  PHE 108           HE1      PHE 108   8.201  24.357 -22.310
  806    HE2  PHE 108           HE2      PHE 108   7.721  20.659 -20.158
  807    HZ   PHE 108           HZ       PHE 108   9.196  22.438 -21.059
  808    H    SER 109           H        SER 109   2.423  21.705 -19.650
  809    HA   SER 109           HA       SER 109   4.132  22.351 -17.332
  810    HB2  SER 109           HB2      SER 109   2.025  23.115 -16.545
  811    HB3  SER 109           HB3      SER 109   1.194  21.670 -17.127
  812    HG   SER 109           HG       SER 109   1.640  21.549 -14.886
  813    H    LEU 110           H        LEU 110   5.151  20.706 -16.518
  814    HA   LEU 110           HA       LEU 110   4.962  17.989 -17.761
  815    HB2  LEU 110           HB2      LEU 110   6.670  18.967 -18.960
  816    HB3  LEU 110           HB3      LEU 110   7.116  20.074 -17.673
  817    HG   LEU 110           HG       LEU 110   8.315  18.353 -16.476
  818   HD11  LEU 110          HD11      LEU 110   7.593  16.527 -18.827
  819   HD12  LEU 110          HD12      LEU 110   8.802  16.155 -17.579
  820   HD13  LEU 110          HD13      LEU 110   7.099  16.279 -17.142
  821   HD21  LEU 110          HD21      LEU 110   9.064  18.473 -19.425
  822   HD22  LEU 110          HD22      LEU 110   9.448  19.697 -18.196
  823   HD23  LEU 110          HD23      LEU 110  10.153  18.079 -18.081
  824    H    LEU 111           H        LEU 111   4.679  16.503 -16.240
  825    HA   LEU 111           HA       LEU 111   5.308  17.160 -13.398
  826    HB2  LEU 111           HB2      LEU 111   2.985  17.016 -13.933
  827    HB3  LEU 111           HB3      LEU 111   3.157  15.441 -14.689
  828    HG   LEU 111           HG       LEU 111   3.981  15.778 -11.805
  829   HD11  LEU 111          HD11      LEU 111   1.653  15.326 -11.092
  830   HD12  LEU 111          HD12      LEU 111   1.808  16.867 -11.951
  831   HD13  LEU 111          HD13      LEU 111   1.118  15.448 -12.785
  832   HD21  LEU 111          HD21      LEU 111   3.177  13.470 -11.588
  833   HD22  LEU 111          HD22      LEU 111   2.544  13.494 -13.245
  834   HD23  LEU 111          HD23      LEU 111   4.290  13.538 -12.952
  835    H    MET 112           H        MET 112   6.279  15.683 -12.092
  836    HA   MET 112           HA       MET 112   7.666  13.369 -13.360
  837    HB2  MET 112           HB2      MET 112   8.746  15.588 -11.580
  838    HB3  MET 112           HB3      MET 112   9.565  14.042 -11.782
  839    HG2  MET 112           HG2      MET 112   9.639  14.380 -14.228
  840    HG3  MET 112           HG3      MET 112   8.838  15.943 -14.048
  841    HE1  MET 112           HE1      MET 112  11.716  15.123 -15.508
  842    HE2  MET 112           HE2      MET 112  10.856  16.674 -15.677
  843    HE3  MET 112           HE3      MET 112  12.567  16.651 -15.197
  844    H    ALA 113           H        ALA 113   7.500  11.520 -12.282
  845    HA   ALA 113           HA       ALA 113   6.326  11.489  -9.532
  846    HB1  ALA 113           HB1      ALA 113   4.814   9.704 -10.388
  847    HB2  ALA 113           HB2      ALA 113   4.572  11.240 -11.242
  848    HB3  ALA 113           HB3      ALA 113   5.487   9.926 -12.013
  849    H    ASN 114           H        ASN 114   6.623   9.604  -8.326
  850    HA   ASN 114           HA       ASN 114   9.235   8.359  -8.473
  851    HB2  ASN 114           HB2      ASN 114   8.073   8.892  -6.389
  852    HB3  ASN 114           HB3      ASN 114   6.726   7.843  -6.810
  853   HD21  ASN 114          HD22      ASN 114   7.931   7.582  -4.409
  854   HD22  ASN 114          HD21      ASN 114   8.864   6.100  -4.346
  855    H    ALA 115           H        ALA 115   9.728   6.876 -10.019
  856    HA   ALA 115           HA       ALA 115   7.787   5.402 -11.505
  857    HB1  ALA 115           HB1      ALA 115  10.028   6.016 -12.348
  858    HB2  ALA 115           HB2      ALA 115  10.770   4.867 -11.201
  859    HB3  ALA 115           HB3      ALA 115   9.719   4.281 -12.501
  860    H    GLY 116           H        GLY 116   9.039   4.709  -8.352
  861    HA2  GLY 116           HA2      GLY 116   8.622   1.801  -8.437
  862    HA3  GLY 116           HA3      GLY 116   9.065   2.800  -7.052
  863    H    THR 117           H        THR 117   6.648   4.656  -7.607
  864    HA   THR 117           HA       THR 117   4.535   2.895  -6.455
  865    HB   THR 117           HB       THR 117   4.066   4.626  -4.940
  866    HG1  THR 117           HG1      THR 117   4.847   6.515  -4.915
  867   HG21  THR 117          HG21      THR 117   5.970   3.223  -4.217
  868   HG22  THR 117          HG22      THR 117   7.099   4.372  -4.968
  869   HG23  THR 117          HG23      THR 117   6.099   4.889  -3.610
  870    H    GLY 118           H        GLY 118   5.192   5.447  -8.767
  871    HA2  GLY 118           HA2      GLY 118   3.802   6.147 -10.504
  872    HA3  GLY 118           HA3      GLY 118   2.388   5.464  -9.692
  873    H    GLU 119           H        GLU 119   4.033   7.225  -7.359
  874    HA   GLU 119           HA       GLU 119   1.911   9.216  -7.323
  875    HB2  GLU 119           HB2      GLU 119   4.269   8.642  -5.512
  876    HB3  GLU 119           HB3      GLU 119   3.044   9.869  -5.171
  877    HG2  GLU 119           HG2      GLU 119   1.280   8.240  -5.031
  878    HG3  GLU 119           HG3      GLU 119   2.314   6.947  -5.642
  879    HA   PRO 120           HA       PRO 120   4.269  12.629  -9.232
  880    HB2  PRO 120           HB2      PRO 120   2.339  14.199  -7.523
  881    HB3  PRO 120           HB3      PRO 120   2.851  14.493  -9.213
  882    HG2  PRO 120           HG2      PRO 120   0.455  13.329  -8.684
  883    HG3  PRO 120           HG3      PRO 120   1.484  12.685 -10.004
  884    HD2  PRO 120           HD2      PRO 120   1.164  11.626  -7.187
  885    HD3  PRO 120           HD3      PRO 120   1.213  10.734  -8.740
  886    H    LEU 121           H        LEU 121   5.967  13.816  -8.591
  887    HA   LEU 121           HA       LEU 121   6.649  14.086  -5.696
  888    HB2  LEU 121           HB2      LEU 121   7.798  12.569  -7.900
  889    HB3  LEU 121           HB3      LEU 121   8.912  13.847  -7.507
  890    HG   LEU 121           HG       LEU 121   9.437  11.825  -6.386
  891   HD11  LEU 121          HD11      LEU 121   9.850  14.057  -5.283
  892   HD12  LEU 121          HD12      LEU 121   8.400  13.796  -4.299
  893   HD13  LEU 121          HD13      LEU 121   9.766  12.673  -4.151
  894   HD21  LEU 121          HD21      LEU 121   7.097  10.912  -6.148
  895   HD22  LEU 121          HD22      LEU 121   8.088  10.764  -4.680
  896   HD23  LEU 121          HD23      LEU 121   6.840  12.017  -4.797
  897    H    LEU 122           H        LEU 122   7.162  15.430  -8.944
  898    HA   LEU 122           HA       LEU 122   7.450  18.166  -7.884
  899    HB2  LEU 122           HB2      LEU 122   9.699  16.897  -7.887
  900    HB3  LEU 122           HB3      LEU 122   9.643  16.967  -9.641
  901    HG   LEU 122           HG       LEU 122   9.412  19.525  -8.029
  902   HD11  LEU 122          HD11      LEU 122  12.010  18.068  -8.634
  903   HD12  LEU 122          HD12      LEU 122  11.857  19.709  -7.958
  904   HD13  LEU 122          HD13      LEU 122  11.297  18.320  -7.024
  905   HD21  LEU 122          HD21      LEU 122  10.674  20.474  -9.914
  906   HD22  LEU 122          HD22      LEU 122  10.849  18.856 -10.644
  907   HD23  LEU 122          HD23      LEU 122   9.269  19.637 -10.548
  908    H    THR 123           H        THR 123   7.137  19.750  -9.609
  909    HA   THR 123           HA       THR 123   6.432  18.729 -12.295
  910    HB   THR 123           HB       THR 123   4.435  20.262 -10.576
  911    HG1  THR 123           HG1      THR 123   4.947  17.707 -10.825
  912   HG21  THR 123          HG21      THR 123   2.842  19.917 -12.387
  913   HG22  THR 123          HG22      THR 123   4.164  20.959 -12.926
  914   HG23  THR 123          HG23      THR 123   4.115  19.243 -13.415
  915    H    LEU 124           H        LEU 124   6.453  20.290 -13.883
  916    HA   LEU 124           HA       LEU 124   8.061  22.734 -13.304
  917    HB2  LEU 124           HB2      LEU 124   8.304  20.756 -15.616
  918    HB3  LEU 124           HB3      LEU 124   9.309  22.176 -15.355
  919    HG   LEU 124           HG       LEU 124   9.239  19.704 -13.564
  920   HD11  LEU 124          HD11      LEU 124  10.317  19.321 -15.771
  921   HD12  LEU 124          HD12      LEU 124  11.389  20.706 -15.478
  922   HD13  LEU 124          HD13      LEU 124  11.471  19.264 -14.438
  923   HD21  LEU 124          HD21      LEU 124  11.032  22.167 -13.499
  924   HD22  LEU 124          HD22      LEU 124   9.798  21.726 -12.292
  925   HD23  LEU 124          HD23      LEU 124  11.209  20.701 -12.502
  926    H    VAL 125           H        VAL 125   7.330  24.529 -14.287
  927    HA   VAL 125           HA       VAL 125   5.088  24.290 -16.278
  928    HB   VAL 125           HB       VAL 125   5.181  26.233 -13.946
  929   HG11  VAL 125          HG11      VAL 125   2.772  26.535 -14.496
  930   HG12  VAL 125          HG12      VAL 125   3.809  27.038 -15.827
  931   HG13  VAL 125          HG13      VAL 125   2.964  25.473 -15.906
  932   HG21  VAL 125          HG21      VAL 125   3.627  23.618 -14.215
  933   HG22  VAL 125          HG22      VAL 125   4.875  23.992 -13.005
  934   HG23  VAL 125          HG23      VAL 125   3.344  24.856 -12.967
  935    H    CYS 126           H        CYS 126   5.015  25.613 -17.954
  936    HA   CYS 126           HA       CYS 126   6.925  27.914 -18.146
  937    HB2  CYS 126           HB2      CYS 126   7.409  25.920 -19.699
  938    HB3  CYS 126           HB3      CYS 126   5.837  26.203 -20.427
  939    HG   CYS 126           HG       CYS 126   7.186  27.343 -22.106
  940    H    SER 127           H        SER 127   6.060  29.844 -18.746
  941    HA   SER 127           HA       SER 127   3.181  30.023 -19.542
  942    HB2  SER 127           HB2      SER 127   3.084  32.072 -18.179
  943    HB3  SER 127           HB3      SER 127   3.516  30.652 -17.212
  944    HG   SER 127           HG       SER 127   4.860  32.464 -16.758
  945    H    GLY 128           H        GLY 128   6.150  30.426 -20.870
  946    HA2  GLY 128           HA2      GLY 128   5.559  31.534 -23.190
  947    HA3  GLY 128           HA3      GLY 128   5.631  33.016 -22.237
  948    H    SER 129           H        SER 129   8.011  31.684 -20.625
  949    HA   SER 129           HA       SER 129  10.104  31.632 -22.684
  950    HB2  SER 129           HB2      SER 129   9.515  34.091 -22.226
  951    HB3  SER 129           HB3      SER 129  10.255  33.851 -20.629
  952    HG   SER 129           HG       SER 129  11.749  34.592 -22.233
  953    H    TRP 130           H        TRP 130  12.255  31.525 -21.821
  954    HA   TRP 130           HA       TRP 130  12.642  29.325 -20.089
  955    HB2  TRP 130           HB2      TRP 130  14.136  29.668 -21.849
  956    HB3  TRP 130           HB3      TRP 130  14.317  31.382 -21.528
  957    HD1  TRP 130           HD1      TRP 130  16.206  32.184 -19.988
  958    HE1  TRP 130           HE1      TRP 130  18.205  31.063 -18.834
  959    HE3  TRP 130           HE3      TRP 130  14.871  27.290 -20.662
  960    HZ2  TRP 130           HZ2      TRP 130  19.152  28.370 -18.341
  961    HZ3  TRP 130           HZ3      TRP 130  16.330  25.478 -19.810
  962    HH2  TRP 130           HH2      TRP 130  18.468  26.004 -18.675
  963    HA   PRO 131           HA       PRO 131  13.539  28.193 -18.662
  964    HB2  PRO 131           HB2      PRO 131  14.289  27.263 -16.265
  965    HB3  PRO 131           HB3      PRO 131  15.450  28.132 -17.304
  966    HG2  PRO 131           HG2      PRO 131  13.878  29.215 -14.962
  967    HG3  PRO 131           HG3      PRO 131  15.623  29.404 -15.334
  968    HD2  PRO 131           HD2      PRO 131  13.662  31.285 -15.997
  969    HD3  PRO 131           HD3      PRO 131  15.198  31.092 -16.887
  970    H    LEU 132           H        LEU 132  12.344  26.318 -17.347
  971    HA   LEU 132           HA       LEU 132   9.639  27.152 -16.671
  972    HB2  LEU 132           HB2      LEU 132  11.102  24.484 -16.761
  973    HB3  LEU 132           HB3      LEU 132   9.591  24.651 -15.878
  974    HG   LEU 132           HG       LEU 132   8.600  25.710 -17.978
  975   HD11  LEU 132          HD11      LEU 132  10.990  24.342 -19.240
  976   HD12  LEU 132          HD12      LEU 132   9.560  24.911 -20.127
  977   HD13  LEU 132          HD13      LEU 132  10.602  26.079 -19.316
  978   HD21  LEU 132          HD21      LEU 132   7.909  23.606 -18.865
  979   HD22  LEU 132          HD22      LEU 132   9.329  22.772 -18.174
  980   HD23  LEU 132          HD23      LEU 132   8.056  23.431 -17.134
  981    H    ASP 133           H        ASP 133   8.616  26.741 -14.740
  982    HA   ASP 133           HA       ASP 133  10.245  27.405 -12.325
  983    HB2  ASP 133           HB2      ASP 133   8.466  28.976 -13.029
  984    HB3  ASP 133           HB3      ASP 133   7.267  27.687 -12.889
  985    H    GLN 134           H        GLN 134  10.428  26.008 -10.665
  986    HA   GLN 134           HA       GLN 134   9.276  23.317 -10.855
  987    HB2  GLN 134           HB2      GLN 134  11.197  24.553  -8.823
  988    HB3  GLN 134           HB3      GLN 134  10.745  22.852  -8.921
  989    HG2  GLN 134           HG2      GLN 134  11.750  22.782 -11.235
  990    HG3  GLN 134           HG3      GLN 134  12.341  24.420 -10.987
  991   HE21  GLN 134          HE22      GLN 134  12.810  20.998 -10.138
  992   HE22  GLN 134          HE21      GLN 134  14.321  21.283  -9.298
  993    H    THR 135           H        THR 135   7.990  22.374  -9.392
  994    HA   THR 135           HA       THR 135   7.276  23.636  -6.817
  995    HB   THR 135           HB       THR 135   5.555  24.398  -8.475
  996    HG1  THR 135           HG1      THR 135   5.016  24.179  -6.302
  997   HG21  THR 135          HG21      THR 135   4.772  21.461  -8.582
  998   HG22  THR 135          HG22      THR 135   3.787  22.810  -9.158
  999   HG23  THR 135          HG23      THR 135   5.333  22.468  -9.945
 1000    H    LEU 136           H        LEU 136   6.669  22.041  -5.221
 1001    HA   LEU 136           HA       LEU 136   7.358  19.242  -5.890
 1002    HB2  LEU 136           HB2      LEU 136   6.363  20.565  -3.337
 1003    HB3  LEU 136           HB3      LEU 136   6.679  18.838  -3.497
 1004    HG   LEU 136           HG       LEU 136   8.777  21.027  -3.852
 1005   HD11  LEU 136          HD11      LEU 136   7.994  20.778  -1.522
 1006   HD12  LEU 136          HD12      LEU 136   8.331  19.034  -1.591
 1007   HD13  LEU 136          HD13      LEU 136   9.659  20.210  -1.713
 1008   HD21  LEU 136          HD21      LEU 136   9.037  17.987  -3.822
 1009   HD22  LEU 136          HD22      LEU 136   9.405  19.073  -5.181
 1010   HD23  LEU 136          HD23      LEU 136  10.399  19.130  -3.728
 1011    H    ALA 137           H        ALA 137   5.973  17.626  -6.184
 1012    HA   ALA 137           HA       ALA 137   4.128  16.869  -7.399
 1013    HB1  ALA 137           HB1      ALA 137   2.627  15.941  -5.675
 1014    HB2  ALA 137           HB2      ALA 137   4.324  15.862  -5.167
 1015    HB3  ALA 137           HB3      ALA 137   3.254  17.111  -4.494
 1016    H    ARG 138           H        ARG 138   3.848  18.971  -8.563
 1017    HA   ARG 138           HA       ARG 138   2.742  20.793  -9.322
 1018    HB2  ARG 138           HB2      ARG 138   0.803  20.292 -10.432
 1019    HB3  ARG 138           HB3      ARG 138   1.768  18.830 -10.391
 1020    HG2  ARG 138           HG2      ARG 138   0.312  17.959  -8.522
 1021    HG3  ARG 138           HG3      ARG 138  -0.731  19.379  -8.727
 1022    HD2  ARG 138           HD2      ARG 138  -0.023  17.285 -10.795
 1023    HD3  ARG 138           HD3      ARG 138  -1.590  17.429  -9.973
 1024    HE   ARG 138           HE       ARG 138  -1.365  19.880 -11.149
 1025   HH11  ARG 138          HH11      ARG 138  -0.992  16.715 -12.666
 1026   HH12  ARG 138          HH12      ARG 138  -1.107  17.449 -14.261
 1027   HH21  ARG 138          HH21      ARG 138  -1.553  20.618 -13.132
 1028   HH22  ARG 138          HH22      ARG 138  -1.481  19.511 -14.514
 1029    H    ASP 139           H        ASP 139   2.800  21.040  -6.375
 1030    HA   ASP 139           HA       ASP 139   0.379  21.972  -5.358
 1031    HB2  ASP 139           HB2      ASP 139   2.402  21.538  -4.048
 1032    HB3  ASP 139           HB3      ASP 139   3.191  22.944  -4.762
 1033    H    THR 140           H        THR 140   2.652  23.853  -7.347
 1034    HA   THR 140           HA       THR 140   0.971  26.260  -7.202
 1035    HB   THR 140           HB       THR 140   3.552  26.089  -7.488
 1036    HG1  THR 140           HG1      THR 140   3.480  28.140  -8.339
 1037   HG21  THR 140          HG21      THR 140   3.389  24.883  -9.772
 1038   HG22  THR 140          HG22      THR 140   2.852  26.435 -10.429
 1039   HG23  THR 140          HG23      THR 140   4.447  26.298  -9.670
 1040    H    ARG 141           H        ARG 141   0.415  23.450  -8.876
 1041    HA   ARG 141           HA       ARG 141  -1.195  24.724 -10.976
 1042    HB2  ARG 141           HB2      ARG 141   1.371  24.454 -11.639
 1043    HB3  ARG 141           HB3      ARG 141   0.981  22.771 -11.848
 1044    HG2  ARG 141           HG2      ARG 141   0.945  24.099 -13.942
 1045    HG3  ARG 141           HG3      ARG 141  -0.604  23.323 -13.639
 1046    HD2  ARG 141           HD2      ARG 141  -0.598  25.756 -14.506
 1047    HD3  ARG 141           HD3      ARG 141  -1.686  25.347 -13.186
 1048    HE   ARG 141           HE       ARG 141  -0.022  26.318 -11.599
 1049   HH11  ARG 141          HH11      ARG 141   0.062  27.607 -14.863
 1050   HH12  ARG 141          HH12      ARG 141   0.784  29.089 -14.308
 1051   HH21  ARG 141          HH21      ARG 141   0.834  28.109 -10.994
 1052   HH22  ARG 141          HH22      ARG 141   1.227  29.374 -12.137
 1053    HA   PRO 142           HA       PRO 142  -2.693  20.482  -9.465
 1054    HB2  PRO 142           HB2      PRO 142  -4.962  21.219  -8.122
 1055    HB3  PRO 142           HB3      PRO 142  -3.343  21.123  -7.365
 1056    HG2  PRO 142           HG2      PRO 142  -4.741  23.583  -8.461
 1057    HG3  PRO 142           HG3      PRO 142  -3.924  23.385  -6.877
 1058    HD2  PRO 142           HD2      PRO 142  -2.664  24.533  -8.996
 1059    HD3  PRO 142           HD3      PRO 142  -1.791  23.465  -7.856
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1   2.214   4.749   3.411
    2    H2   MET   1           H2       MET   1   2.894   3.870   4.613
    3    H3   MET   1           H3       MET   1   3.834   4.770   3.626
    4    HA   MET   1           HA       MET   1   4.032   2.460   3.029
    5    HB2  MET   1           HB2      MET   1   1.798   1.780   3.871
    6    HB3  MET   1           HB3      MET   1   1.028   2.615   2.517
    7    HG2  MET   1           HG2      MET   1   2.114   1.083   0.926
    8    HG3  MET   1           HG3      MET   1   3.040   0.347   2.234
    9    HE1  MET   1           HE1      MET   1  -0.897   1.288   2.169
   10    HE2  MET   1           HE2      MET   1  -0.445   0.771   0.528
   11    HE3  MET   1           HE3      MET   1  -1.510  -0.246   1.523
   12    H    ALA   2           H        ALA   2   4.965   2.288   1.069
   13    HA   ALA   2           HA       ALA   2   3.847   3.595  -1.319
   14    HB1  ALA   2           HB1      ALA   2   5.201   5.377  -0.245
   15    HB2  ALA   2           HB2      ALA   2   6.609   4.290  -0.207
   16    HB3  ALA   2           HB3      ALA   2   5.942   4.842  -1.756
   17    H    TYR   3           H        TYR   3   5.212   3.112  -3.229
   18    HA   TYR   3           HA       TYR   3   6.468   0.389  -3.145
   19    HB2  TYR   3           HB2      TYR   3   4.695   1.522  -5.316
   20    HB3  TYR   3           HB3      TYR   3   5.286  -0.127  -5.188
   21    HD1  TYR   3           HD1      TYR   3   4.268  -1.706  -3.554
   22    HD2  TYR   3           HD2      TYR   3   2.851   2.341  -3.981
   23    HE1  TYR   3           HE1      TYR   3   2.193  -2.308  -2.313
   24    HE2  TYR   3           HE2      TYR   3   0.764   1.742  -2.731
   25    HH   TYR   3           HH       TYR   3   0.180  -1.577  -1.511
   26    H    GLY   4           H        GLY   4   7.281   3.453  -3.543
   27    HA2  GLY   4           HA2      GLY   4   9.714   2.852  -5.033
   28    HA3  GLY   4           HA3      GLY   4   8.742   4.183  -5.696
   29    H    ARG   5           H        ARG   5  11.326   4.589  -4.582
   30    HA   ARG   5           HA       ARG   5  11.248   5.091  -1.720
   31    HB2  ARG   5           HB2      ARG   5  13.312   5.646  -3.874
   32    HB3  ARG   5           HB3      ARG   5  13.523   6.167  -2.210
   33    HG2  ARG   5           HG2      ARG   5  13.115   3.760  -1.473
   34    HG3  ARG   5           HG3      ARG   5  13.180   3.312  -3.185
   35    HD2  ARG   5           HD2      ARG   5  15.342   2.926  -2.238
   36    HD3  ARG   5           HD3      ARG   5  15.478   4.337  -3.303
   37    HE   ARG   5           HE       ARG   5  14.938   5.370  -0.730
   38   HH11  ARG   5          HH11      ARG   5  17.525   3.437  -2.135
   39   HH12  ARG   5          HH12      ARG   5  18.698   4.037  -1.000
   40   HH21  ARG   5          HH21      ARG   5  16.495   6.099   0.653
   41   HH22  ARG   5          HH22      ARG   5  18.132   5.488   0.534
   42    H    GLU   6           H        GLU   6   9.486   6.506  -1.439
   43    HA   GLU   6           HA       GLU   6   9.369   9.195  -2.255
   44    HB2  GLU   6           HB2      GLU   6   8.030   9.614  -0.302
   45    HB3  GLU   6           HB3      GLU   6   7.600   8.052  -0.998
   46    HG2  GLU   6           HG2      GLU   6   8.937   6.895   0.745
   47    HG3  GLU   6           HG3      GLU   6   9.391   8.449   1.445
   48    H    ASP   7           H        ASP   7  11.676   7.798   0.006
   49    HA   ASP   7           HA       ASP   7  12.592  10.333   1.081
   50    HB2  ASP   7           HB2      ASP   7  14.080   9.091   2.345
   51    HB3  ASP   7           HB3      ASP   7  12.662   8.062   2.232
   52    H    VAL   8           H        VAL   8  13.011   9.017  -1.955
   53    HA   VAL   8           HA       VAL   8  15.502  10.617  -2.486
   54    HB   VAL   8           HB       VAL   8  14.746   7.898  -3.632
   55   HG11  VAL   8          HG11      VAL   8  17.073   9.726  -4.361
   56   HG12  VAL   8          HG12      VAL   8  16.927   8.020  -4.841
   57   HG13  VAL   8          HG13      VAL   8  15.758   9.192  -5.435
   58   HG21  VAL   8          HG21      VAL   8  16.903   7.170  -2.654
   59   HG22  VAL   8          HG22      VAL   8  17.129   8.785  -1.946
   60   HG23  VAL   8          HG23      VAL   8  15.794   7.745  -1.409
   61    H    ALA   9           H        ALA   9  12.373   9.437  -3.748
   62    HA   ALA   9           HA       ALA   9  12.517  10.385  -6.334
   63    HB1  ALA   9           HB1      ALA   9  10.771   8.887  -5.448
   64    HB2  ALA   9           HB2      ALA   9  10.058  10.237  -4.538
   65    HB3  ALA   9           HB3      ALA   9  10.065  10.257  -6.317
   66    H    ASN  10           H        ASN  10  11.496  12.362  -3.483
   67    HA   ASN  10           HA       ASN  10  10.809  14.703  -4.991
   68    HB2  ASN  10           HB2      ASN  10  10.218  14.399  -2.615
   69    HB3  ASN  10           HB3      ASN  10  11.921  14.421  -2.159
   70   HD21  ASN  10          HD22      ASN  10   9.179  16.425  -3.148
   71   HD22  ASN  10          HD21      ASN  10  10.004  17.941  -2.854
   72    H    THR  11           H        THR  11  13.967  13.890  -3.437
   73    HA   THR  11           HA       THR  11  15.430  16.092  -4.457
   74    HB   THR  11           HB       THR  11  16.503  13.299  -3.892
   75    HG1  THR  11           HG1      THR  11  16.724  14.055  -1.783
   76   HG21  THR  11          HG21      THR  11  17.774  16.067  -3.654
   77   HG22  THR  11          HG22      THR  11  18.530  14.531  -3.172
   78   HG23  THR  11          HG23      THR  11  18.176  14.839  -4.876
   79    H    ARG  12           H        ARG  12  14.966  12.809  -5.827
   80    HA   ARG  12           HA       ARG  12  16.570  13.266  -8.172
   81    HB2  ARG  12           HB2      ARG  12  15.852  11.032  -7.101
   82    HB3  ARG  12           HB3      ARG  12  14.270  11.276  -7.842
   83    HG2  ARG  12           HG2      ARG  12  15.566   9.809  -9.239
   84    HG3  ARG  12           HG3      ARG  12  15.382  11.335 -10.094
   85    HD2  ARG  12           HD2      ARG  12  17.806  11.560  -8.565
   86    HD3  ARG  12           HD3      ARG  12  17.805   9.938  -9.225
   87    HE   ARG  12           HE       ARG  12  17.896  12.501 -10.753
   88   HH11  ARG  12          HH11      ARG  12  18.195   8.991 -11.075
   89   HH12  ARG  12          HH12      ARG  12  18.028   9.151 -12.821
   90   HH21  ARG  12          HH21      ARG  12  18.161  12.536 -12.783
   91   HH22  ARG  12          HH22      ARG  12  18.150  11.039 -13.761
   92    H    ALA  13           H        ALA  13  13.048  13.805  -7.629
   93    HA   ALA  13           HA       ALA  13  12.405  14.585 -10.289
   94    HB1  ALA  13           HB1      ALA  13  10.743  14.146  -8.516
   95    HB2  ALA  13           HB2      ALA  13  11.264  15.615  -7.667
   96    HB3  ALA  13           HB3      ALA  13  10.523  15.729  -9.276
   97    H    ARG  14           H        ARG  14  13.541  16.543  -7.514
   98    HA   ARG  14           HA       ARG  14  13.709  19.059  -8.898
   99    HB2  ARG  14           HB2      ARG  14  15.128  17.971  -6.427
  100    HB3  ARG  14           HB3      ARG  14  15.193  19.664  -6.928
  101    HG2  ARG  14           HG2      ARG  14  12.898  20.034  -6.481
  102    HG3  ARG  14           HG3      ARG  14  12.496  18.318  -6.556
  103    HD2  ARG  14           HD2      ARG  14  12.350  19.063  -4.280
  104    HD3  ARG  14           HD3      ARG  14  13.637  17.867  -4.473
  105    HE   ARG  14           HE       ARG  14  14.685  20.555  -4.640
  106   HH11  ARG  14          HH11      ARG  14  13.530  18.211  -2.286
  107   HH12  ARG  14          HH12      ARG  14  14.561  18.849  -1.030
  108   HH21  ARG  14          HH21      ARG  14  15.958  21.310  -2.967
  109   HH22  ARG  14          HH22      ARG  14  15.874  20.560  -1.405
  110    H    GLU  15           H        GLU  15  16.124  16.517  -8.441
  111    HA   GLU  15           HA       GLU  15  18.256  17.734  -9.928
  112    HB2  GLU  15           HB2      GLU  15  18.374  15.792  -8.349
  113    HB3  GLU  15           HB3      GLU  15  17.521  14.796  -9.511
  114    HG2  GLU  15           HG2      GLU  15  20.275  16.024  -9.870
  115    HG3  GLU  15           HG3      GLU  15  19.898  14.358  -9.392
  116    H    THR  16           H        THR  16  15.744  15.398 -11.010
  117    HA   THR  16           HA       THR  16  16.516  15.329 -13.733
  118    HB   THR  16           HB       THR  16  13.775  14.836 -12.507
  119    HG1  THR  16           HG1      THR  16  15.278  13.520 -11.621
  120   HG21  THR  16          HG21      THR  16  13.442  13.264 -14.374
  121   HG22  THR  16          HG22      THR  16  13.574  14.933 -14.967
  122   HG23  THR  16          HG23      THR  16  14.956  13.823 -15.128
  123    H    ALA  17           H        ALA  17  14.361  17.572 -12.034
  124    HA   ALA  17           HA       ALA  17  13.520  19.082 -14.301
  125    HB1  ALA  17           HB1      ALA  17  13.915  19.916 -11.395
  126    HB2  ALA  17           HB2      ALA  17  12.992  20.807 -12.616
  127    HB3  ALA  17           HB3      ALA  17  12.450  19.192 -12.085
  128    H    ALA  18           H        ALA  18  16.355  19.615 -12.100
  129    HA   ALA  18           HA       ALA  18  17.379  21.868 -13.550
  130    HB1  ALA  18           HB1      ALA  18  19.464  21.384 -12.340
  131    HB2  ALA  18           HB2      ALA  18  18.065  21.262 -11.255
  132    HB3  ALA  18           HB3      ALA  18  18.849  19.788 -11.866
  133    H    ARG  19           H        ARG  19  17.948  18.363 -13.907
  134    HA   ARG  19           HA       ARG  19  19.851  18.449 -16.015
  135    HB2  ARG  19           HB2      ARG  19  19.026  16.482 -14.501
  136    HB3  ARG  19           HB3      ARG  19  17.728  16.291 -15.664
  137    HG2  ARG  19           HG2      ARG  19  19.453  14.725 -16.196
  138    HG3  ARG  19           HG3      ARG  19  19.423  15.950 -17.468
  139    HD2  ARG  19           HD2      ARG  19  21.713  15.319 -16.856
  140    HD3  ARG  19           HD3      ARG  19  21.415  17.029 -16.525
  141    HE   ARG  19           HE       ARG  19  20.871  15.555 -14.128
  142   HH11  ARG  19          HH11      ARG  19  23.720  16.411 -16.017
  143   HH12  ARG  19          HH12      ARG  19  24.734  16.346 -14.605
  144   HH21  ARG  19          HH21      ARG  19  22.120  15.497 -12.511
  145   HH22  ARG  19          HH22      ARG  19  23.857  15.825 -12.608
  146    H    PHE  20           H        PHE  20  16.276  18.165 -16.263
  147    HA   PHE  20           HA       PHE  20  16.124  18.433 -19.097
  148    HB2  PHE  20           HB2      PHE  20  14.221  17.662 -17.841
  149    HB3  PHE  20           HB3      PHE  20  14.203  19.118 -16.856
  150    HD1  PHE  20           HD2      PHE  20  14.359  18.614 -20.622
  151    HD2  PHE  20           HD1      PHE  20  12.262  20.333 -17.262
  152    HE1  PHE  20           HE2      PHE  20  12.750  19.687 -22.163
  153    HE2  PHE  20           HE1      PHE  20  10.682  21.431 -18.825
  154    HZ   PHE  20           HZ       PHE  20  10.926  21.122 -21.276
  155    H    THR  21           H        THR  21  16.117  20.982 -16.553
  156    HA   THR  21           HA       THR  21  15.756  23.191 -18.301
  157    HB   THR  21           HB       THR  21  17.333  23.143 -15.698
  158    HG1  THR  21           HG1      THR  21  15.254  22.394 -15.403
  159   HG21  THR  21          HG21      THR  21  17.707  25.266 -16.806
  160   HG22  THR  21          HG22      THR  21  15.980  25.420 -17.216
  161   HG23  THR  21          HG23      THR  21  16.516  25.524 -15.530
  162    H    ALA  22           H        ALA  22  18.851  21.559 -17.362
  163    HA   ALA  22           HA       ALA  22  20.489  23.237 -19.007
  164    HB1  ALA  22           HB1      ALA  22  20.909  20.347 -18.116
  165    HB2  ALA  22           HB2      ALA  22  22.161  21.446 -18.729
  166    HB3  ALA  22           HB3      ALA  22  21.352  21.798 -17.190
  167    H    ALA  23           H        ALA  23  18.778  20.187 -19.793
  168    HA   ALA  23           HA       ALA  23  19.731  19.979 -22.496
  169    HB1  ALA  23           HB1      ALA  23  18.675  18.134 -21.246
  170    HB2  ALA  23           HB2      ALA  23  17.113  18.984 -21.303
  171    HB3  ALA  23           HB3      ALA  23  17.874  18.423 -22.803
  172    H    LEU  24           H        LEU  24  16.987  21.778 -21.106
  173    HA   LEU  24           HA       LEU  24  15.968  22.764 -23.606
  174    HB2  LEU  24           HB2      LEU  24  14.710  22.578 -21.465
  175    HB3  LEU  24           HB3      LEU  24  15.726  23.824 -20.769
  176    HG   LEU  24           HG       LEU  24  14.851  25.434 -22.535
  177   HD11  LEU  24          HD11      LEU  24  14.114  23.766 -24.214
  178   HD12  LEU  24          HD12      LEU  24  12.920  23.122 -23.070
  179   HD13  LEU  24          HD13      LEU  24  12.758  24.775 -23.697
  180   HD21  LEU  24          HD21      LEU  24  13.899  25.344 -20.249
  181   HD22  LEU  24          HD22      LEU  24  12.650  25.704 -21.455
  182   HD23  LEU  24          HD23      LEU  24  12.782  24.067 -20.771
  183    H    GLU  25           H        GLU  25  18.442  24.036 -21.350
  184    HA   GLU  25           HA       GLU  25  18.974  26.478 -22.762
  185    HB2  GLU  25           HB2      GLU  25  19.847  25.780 -20.455
  186    HB3  GLU  25           HB3      GLU  25  21.048  24.807 -21.294
  187    HG2  GLU  25           HG2      GLU  25  21.854  26.855 -22.476
  188    HG3  GLU  25           HG3      GLU  25  20.652  27.811 -21.609
  189    H    LEU  26           H        LEU  26  20.386  23.209 -23.123
  190    HA   LEU  26           HA       LEU  26  22.076  23.639 -25.362
  191    HB2  LEU  26           HB2      LEU  26  22.306  21.605 -24.244
  192    HB3  LEU  26           HB3      LEU  26  20.589  21.353 -24.118
  193    HG   LEU  26           HG       LEU  26  20.508  20.832 -26.600
  194   HD11  LEU  26          HD11      LEU  26  23.534  20.723 -26.242
  195   HD12  LEU  26          HD12      LEU  26  22.621  20.168 -27.664
  196   HD13  LEU  26          HD13      LEU  26  22.654  21.890 -27.254
  197   HD21  LEU  26          HD21      LEU  26  22.199  19.086 -24.782
  198   HD22  LEU  26          HD22      LEU  26  20.422  19.124 -24.878
  199   HD23  LEU  26          HD23      LEU  26  21.369  18.561 -26.266
  200    H    ALA  27           H        ALA  27  18.608  22.775 -25.313
  201    HA   ALA  27           HA       ALA  27  18.207  22.863 -28.117
  202    HB1  ALA  27           HB1      ALA  27  15.834  23.085 -27.551
  203    HB2  ALA  27           HB2      ALA  27  16.631  21.869 -26.530
  204    HB3  ALA  27           HB3      ALA  27  16.248  23.472 -25.869
  205    H    ILE  28           H        ILE  28  17.956  25.604 -25.768
  206    HA   ILE  28           HA       ILE  28  17.220  27.602 -27.715
  207    HB   ILE  28           HB       ILE  28  18.707  27.844 -25.071
  208   HG12  ILE  28          HG12      ILE  28  15.828  28.620 -25.692
  209   HG13  ILE  28          HG13      ILE  28  16.247  27.006 -25.132
  210   HG21  ILE  28          HG21      ILE  28  19.232  29.828 -26.426
  211   HG22  ILE  28          HG22      ILE  28  17.514  30.044 -26.826
  212   HG23  ILE  28          HG23      ILE  28  18.098  30.275 -25.165
  213   HD11  ILE  28          HD11      ILE  28  16.627  29.583 -23.593
  214   HD12  ILE  28          HD12      ILE  28  15.540  28.222 -23.252
  215   HD13  ILE  28          HD13      ILE  28  17.290  28.007 -23.089
  216    H    ASP  29           H        ASP  29  20.451  26.569 -26.511
  217    HA   ASP  29           HA       ASP  29  21.980  28.302 -28.161
  218    HB2  ASP  29           HB2      ASP  29  22.837  27.050 -26.206
  219    HB3  ASP  29           HB3      ASP  29  22.673  25.538 -27.096
  220    H    ARG  30           H        ARG  30  20.648  25.081 -28.874
  221    HA   ARG  30           HA       ARG  30  21.789  24.959 -31.545
  222    HB2  ARG  30           HB2      ARG  30  21.218  22.952 -30.239
  223    HB3  ARG  30           HB3      ARG  30  19.518  23.406 -30.234
  224    HG2  ARG  30           HG2      ARG  30  19.965  21.612 -31.836
  225    HG3  ARG  30           HG3      ARG  30  19.362  23.048 -32.641
  226    HD2  ARG  30           HD2      ARG  30  21.807  23.616 -33.199
  227    HD3  ARG  30           HD3      ARG  30  22.217  22.003 -32.613
  228    HE   ARG  30           HE       ARG  30  20.354  22.656 -34.890
  229   HH11  ARG  30          HH11      ARG  30  22.675  20.304 -33.580
  230   HH12  ARG  30          HH12      ARG  30  22.508  19.337 -35.056
  231   HH21  ARG  30          HH21      ARG  30  20.386  21.297 -36.686
  232   HH22  ARG  30          HH22      ARG  30  21.379  19.835 -36.588
  233    H    ALA  31           H        ALA  31  18.740  26.312 -30.316
  234    HA   ALA  31           HA       ALA  31  17.404  26.422 -32.830
  235    HB1  ALA  31           HB1      ALA  31  17.050  28.224 -30.393
  236    HB2  ALA  31           HB2      ALA  31  15.874  27.973 -31.705
  237    HB3  ALA  31           HB3      ALA  31  16.290  26.641 -30.617
  238    H    THR  32           H        THR  32  19.587  28.870 -31.397
  239    HA   THR  32           HA       THR  32  19.102  30.760 -33.552
  240    HB   THR  32           HB       THR  32  19.975  31.442 -31.344
  241    HG1  THR  32           HG1      THR  32  20.278  32.847 -32.999
  242   HG21  THR  32          HG21      THR  32  22.630  30.251 -32.262
  243   HG22  THR  32          HG22      THR  32  22.363  31.276 -30.839
  244   HG23  THR  32          HG23      THR  32  21.629  29.672 -30.905
  245    H    LEU  33           H        LEU  33  21.233  27.989 -33.209
  246    HA   LEU  33           HA       LEU  33  22.869  28.585 -35.520
  247    HB2  LEU  33           HB2      LEU  33  22.478  26.088 -33.826
  248    HB3  LEU  33           HB3      LEU  33  23.699  26.244 -35.088
  249    HG   LEU  33           HG       LEU  33  23.555  27.924 -32.549
  250   HD11  LEU  33          HD11      LEU  33  25.462  25.694 -33.374
  251   HD12  LEU  33          HD12      LEU  33  25.554  26.657 -31.882
  252   HD13  LEU  33          HD13      LEU  33  24.183  25.574 -32.144
  253   HD21  LEU  33          HD21      LEU  33  25.846  28.662 -33.188
  254   HD22  LEU  33          HD22      LEU  33  25.661  27.839 -34.752
  255   HD23  LEU  33          HD23      LEU  33  24.624  29.222 -34.328
  256    H    SER  34           H        SER  34  19.999  26.643 -34.886
  257    HA   SER  34           HA       SER  34  20.078  25.062 -37.280
  258    HB2  SER  34           HB2      SER  34  17.793  25.670 -35.368
  259    HB3  SER  34           HB3      SER  34  17.776  24.408 -36.621
  260    HG   SER  34           HG       SER  34  19.461  24.638 -34.355
  261    H    GLY  35           H        GLY  35  18.783  28.276 -36.746
  262    HA2  GLY  35           HA2      GLY  35  17.830  29.779 -38.239
  263    HA3  GLY  35           HA3      GLY  35  18.057  28.615 -39.548
  264    H    GLN  36           H        GLN  36  16.372  27.286 -36.930
  265    HA   GLN  36           HA       GLN  36  13.640  28.071 -37.608
  266    HB2  GLN  36           HB2      GLN  36  14.279  26.093 -39.153
  267    HB3  GLN  36           HB3      GLN  36  14.529  25.147 -37.691
  268    HG2  GLN  36           HG2      GLN  36  12.120  25.585 -37.059
  269    HG3  GLN  36           HG3      GLN  36  11.899  26.361 -38.629
  270   HE21  GLN  36          HE22      GLN  36  12.169  23.357 -36.838
  271   HE22  GLN  36          HE21      GLN  36  11.733  22.333 -38.208
  272    HA   PRO  37           HA       PRO  37  13.347  27.243 -33.135
  273    HB2  PRO  37           HB2      PRO  37  10.710  26.032 -34.048
  274    HB3  PRO  37           HB3      PRO  37  11.037  26.970 -32.557
  275    HG2  PRO  37           HG2      PRO  37   9.971  28.239 -34.675
  276    HG3  PRO  37           HG3      PRO  37  11.366  28.992 -33.830
  277    HD2  PRO  37           HD2      PRO  37  11.352  27.474 -36.417
  278    HD3  PRO  37           HD3      PRO  37  12.260  28.945 -35.971
  279    H    VAL  38           H        VAL  38  13.489  25.508 -31.729
  280    HA   VAL  38           HA       VAL  38  14.149  22.808 -32.889
  281    HB   VAL  38           HB       VAL  38  15.518  24.506 -30.791
  282   HG11  VAL  38          HG11      VAL  38  15.578  22.276 -29.793
  283   HG12  VAL  38          HG12      VAL  38  16.166  21.585 -31.325
  284   HG13  VAL  38          HG13      VAL  38  17.158  22.728 -30.408
  285   HG21  VAL  38          HG21      VAL  38  17.453  24.164 -32.283
  286   HG22  VAL  38          HG22      VAL  38  16.508  23.073 -33.313
  287   HG23  VAL  38          HG23      VAL  38  16.095  24.783 -33.234
  288    H    GLY  39           H        GLY  39  13.924  20.993 -31.178
  289    HA2  GLY  39           HA2      GLY  39  12.049  21.695 -29.002
  290    HA3  GLY  39           HA3      GLY  39  11.416  20.645 -30.250
  291    H    ILE  40           H        ILE  40  11.216  19.736 -27.897
  292    HA   ILE  40           HA       ILE  40  13.258  17.583 -27.661
  293    HB   ILE  40           HB       ILE  40  12.060  18.976 -25.242
  294   HG12  ILE  40          HG12      ILE  40  14.879  19.198 -26.403
  295   HG13  ILE  40          HG13      ILE  40  13.676  20.482 -26.394
  296   HG21  ILE  40          HG21      ILE  40  13.614  17.552 -23.980
  297   HG22  ILE  40          HG22      ILE  40  12.632  16.526 -25.009
  298   HG23  ILE  40          HG23      ILE  40  14.297  16.905 -25.485
  299   HD11  ILE  40          HD11      ILE  40  15.300  20.881 -24.671
  300   HD12  ILE  40          HD12      ILE  40  13.708  20.584 -23.955
  301   HD13  ILE  40          HD13      ILE  40  14.974  19.324 -23.906
  302    H    HIS  41           H        HIS  41  12.374  15.712 -27.848
  303    HA   HIS  41           HA       HIS  41   9.458  15.274 -27.749
  304    HB2  HIS  41           HB2      HIS  41  10.345  14.221 -29.624
  305    HB3  HIS  41           HB3      HIS  41  11.856  13.831 -28.822
  306    HD1  HIS  41           HD1      HIS  41  12.014  11.431 -27.709
  307    HD2  HIS  41           HD2      HIS  41   8.148  12.609 -28.877
  308    HE1  HIS  41           HE1      HIS  41  10.508   9.411 -27.333
  309    H    PHE  42           H        PHE  42   8.489  13.910 -26.359
  310    HA   PHE  42           HA       PHE  42   9.981  12.465 -24.244
  311    HB2  PHE  42           HB2      PHE  42   7.802  14.544 -23.808
  312    HB3  PHE  42           HB3      PHE  42   8.188  13.308 -22.618
  313    HD1  PHE  42           HD1      PHE  42  10.422  13.227 -21.529
  314    HD2  PHE  42           HD2      PHE  42   9.226  16.518 -24.053
  315    HE1  PHE  42           HE1      PHE  42  12.237  14.620 -20.571
  316    HE2  PHE  42           HE2      PHE  42  11.036  17.916 -23.073
  317    HZ   PHE  42           HZ       PHE  42  12.544  16.960 -21.343
  318    H    SER  43           H        SER  43   9.108  10.523 -23.836
  319    HA   SER  43           HA       SER  43   6.322   9.892 -24.678
  320    HB2  SER  43           HB2      SER  43   6.982   7.816 -25.556
  321    HB3  SER  43           HB3      SER  43   8.109   8.991 -26.236
  322    HG   SER  43           HG       SER  43   9.171   7.126 -25.431
  323    H    ASP  44           H        ASP  44   5.823   7.546 -23.723
  324    HA   ASP  44           HA       ASP  44   5.691   7.651 -20.888
  325    HB2  ASP  44           HB2      ASP  44   4.172   6.412 -22.425
  326    HB3  ASP  44           HB3      ASP  44   5.476   5.281 -22.784
  327    H    SER  45           H        SER  45   8.416   6.739 -22.864
  328    HA   SER  45           HA       SER  45   9.794   5.546 -20.494
  329    HB2  SER  45           HB2      SER  45  10.597   3.695 -21.867
  330    HB3  SER  45           HB3      SER  45   8.829   3.721 -21.799
  331    HG   SER  45           HG       SER  45   9.610   3.386 -23.929
  332    H    ALA  46           H        ALA  46  10.157   7.718 -23.183
  333    HA   ALA  46           HA       ALA  46  13.042   7.984 -22.563
  334    HB1  ALA  46           HB1      ALA  46  12.868   6.264 -24.353
  335    HB2  ALA  46           HB2      ALA  46  11.948   7.408 -25.357
  336    HB3  ALA  46           HB3      ALA  46  13.646   7.734 -24.948
  337    H    TRP  47           H        TRP  47  14.057   9.761 -23.838
  338    HA   TRP  47           HA       TRP  47  12.271  11.890 -24.840
  339    HB2  TRP  47           HB2      TRP  47  13.310  13.610 -23.541
  340    HB3  TRP  47           HB3      TRP  47  12.760  12.376 -22.422
  341    HD1  TRP  47           HD1      TRP  47  14.632  11.003 -21.113
  342    HE1  TRP  47           HE1      TRP  47  17.153  11.370 -20.686
  343    HE3  TRP  47           HE3      TRP  47  15.486  14.735 -24.506
  344    HZ2  TRP  47           HZ2      TRP  47  19.287  12.913 -21.848
  345    HZ3  TRP  47           HZ3      TRP  47  17.778  15.635 -24.823
  346    HH2  TRP  47           HH2      TRP  47  19.685  14.720 -23.528
  347    H    ARG  48           H        ARG  48  13.454  13.467 -26.212
  348    HA   ARG  48           HA       ARG  48  16.287  13.155 -26.719
  349    HB2  ARG  48           HB2      ARG  48  16.351  12.473 -28.984
  350    HB3  ARG  48           HB3      ARG  48  15.365  11.268 -28.172
  351    HG2  ARG  48           HG2      ARG  48  13.330  12.228 -29.092
  352    HG3  ARG  48           HG3      ARG  48  14.226  13.583 -29.787
  353    HD2  ARG  48           HD2      ARG  48  13.977  12.275 -31.620
  354    HD3  ARG  48           HD3      ARG  48  15.576  11.786 -31.076
  355    HE   ARG  48           HE       ARG  48  14.744   9.658 -30.564
  356   HH11  ARG  48          HH11      ARG  48  11.985  11.723 -31.308
  357   HH12  ARG  48          HH12      ARG  48  10.912  10.353 -31.486
  358   HH21  ARG  48          HH21      ARG  48  13.256   7.978 -30.791
  359   HH22  ARG  48          HH22      ARG  48  11.595   8.351 -31.194
  360    H    ILE  49           H        ILE  49  17.148  14.643 -28.249
  361    HA   ILE  49           HA       ILE  49  15.714  17.228 -28.414
  362    HB   ILE  49           HB       ILE  49  18.450  16.360 -29.452
  363   HG12  ILE  49          HG12      ILE  49  18.436  16.083 -27.043
  364   HG13  ILE  49          HG13      ILE  49  19.441  17.444 -27.507
  365   HG21  ILE  49          HG21      ILE  49  17.201  19.127 -29.119
  366   HG22  ILE  49          HG22      ILE  49  18.931  18.842 -29.407
  367   HG23  ILE  49          HG23      ILE  49  17.750  18.355 -30.620
  368   HD11  ILE  49          HD11      ILE  49  17.616  19.022 -26.809
  369   HD12  ILE  49          HD12      ILE  49  16.646  17.617 -26.295
  370   HD13  ILE  49          HD13      ILE  49  18.178  17.983 -25.493
  371    H    MET  50           H        MET  50  14.977  18.141 -30.373
  372    HA   MET  50           HA       MET  50  15.316  16.570 -32.870
  373    HB2  MET  50           HB2      MET  50  12.632  17.625 -31.899
  374    HB3  MET  50           HB3      MET  50  12.963  16.913 -33.482
  375    HG2  MET  50           HG2      MET  50  13.781  14.830 -32.217
  376    HG3  MET  50           HG3      MET  50  13.076  15.553 -30.775
  377    HE1  MET  50           HE1      MET  50  12.343  13.433 -34.053
  378    HE2  MET  50           HE2      MET  50  10.697  13.988 -34.442
  379    HE3  MET  50           HE3      MET  50  12.064  15.110 -34.559
  380    H    VAL  51           H        VAL  51  15.340  17.696 -34.734
  381    HA   VAL  51           HA       VAL  51  15.496  20.683 -34.686
  382    HB   VAL  51           HB       VAL  51  17.771  20.487 -35.768
  383   HG11  VAL  51          HG11      VAL  51  17.501  21.010 -33.357
  384   HG12  VAL  51          HG12      VAL  51  17.668  19.286 -32.979
  385   HG13  VAL  51          HG13      VAL  51  19.011  20.159 -33.728
  386   HG21  VAL  51          HG21      VAL  51  17.712  17.601 -34.842
  387   HG22  VAL  51          HG22      VAL  51  17.649  18.139 -36.536
  388   HG23  VAL  51          HG23      VAL  51  19.082  18.473 -35.558
  389    HA   PRO  52           HA       PRO  52  14.083  20.284 -38.960
  390    HB2  PRO  52           HB2      PRO  52  15.621  22.077 -40.398
  391    HB3  PRO  52           HB3      PRO  52  14.282  22.545 -39.316
  392    HG2  PRO  52           HG2      PRO  52  17.243  22.413 -38.653
  393    HG3  PRO  52           HG3      PRO  52  16.129  23.785 -38.390
  394    HD2  PRO  52           HD2      PRO  52  16.664  22.116 -36.373
  395    HD3  PRO  52           HD3      PRO  52  14.972  22.599 -36.646
  396    H    GLY  53           H        GLY  53  14.683  19.503 -41.084
  397    HA2  GLY  53           HA2      GLY  53  17.469  18.414 -41.417
  398    HA3  GLY  53           HA3      GLY  53  16.064  17.372 -41.618
  399    H    LYS  54           H        LYS  54  14.618  17.731 -43.406
  400    HA   LYS  54           HA       LYS  54  16.014  18.209 -45.868
  401    HB2  LYS  54           HB2      LYS  54  13.006  18.136 -45.445
  402    HB3  LYS  54           HB3      LYS  54  13.857  17.886 -46.960
  403    HG2  LYS  54           HG2      LYS  54  13.914  16.022 -44.543
  404    HG3  LYS  54           HG3      LYS  54  13.046  15.795 -46.050
  405    HD2  LYS  54           HD2      LYS  54  14.864  14.415 -46.334
  406    HD3  LYS  54           HD3      LYS  54  15.357  15.857 -47.224
  407    HE2  LYS  54           HE2      LYS  54  16.745  16.563 -45.255
  408    HE3  LYS  54           HE3      LYS  54  16.180  15.153 -44.361
  409    HZ1  LYS  54           HZ1      LYS  54  17.262  13.739 -46.032
  410    HZ2  LYS  54           HZ2      LYS  54  17.776  15.040 -46.870
  411    HZ3  LYS  54           HZ3      LYS  54  18.354  14.750 -45.376
  412    H    THR  55           H        THR  55  14.040  20.393 -43.969
  413    HA   THR  55           HA       THR  55  15.372  22.596 -45.267
  414    HB   THR  55           HB       THR  55  13.536  22.361 -46.854
  415    HG1  THR  55           HG1      THR  55  14.149  24.380 -46.604
  416   HG21  THR  55          HG21      THR  55  11.760  21.398 -45.363
  417   HG22  THR  55          HG22      THR  55  11.597  22.994 -44.593
  418   HG23  THR  55          HG23      THR  55  11.236  22.798 -46.314
  419    HA   PRO  56           HA       PRO  56  14.321  24.210 -41.134
  420    HB2  PRO  56           HB2      PRO  56  15.756  26.511 -41.157
  421    HB3  PRO  56           HB3      PRO  56  16.556  24.912 -41.134
  422    HG2  PRO  56           HG2      PRO  56  15.988  26.669 -43.549
  423    HG3  PRO  56           HG3      PRO  56  17.549  25.923 -43.072
  424    HD2  PRO  56           HD2      PRO  56  15.851  24.767 -44.887
  425    HD3  PRO  56           HD3      PRO  56  16.845  23.785 -43.772
  426    H    SER  57           H        SER  57  13.021  25.113 -44.071
  427    HA   SER  57           HA       SER  57  12.194  27.767 -43.759
  428    HB2  SER  57           HB2      SER  57  10.770  25.536 -45.261
  429    HB3  SER  57           HB3      SER  57  10.466  27.272 -45.453
  430    HG   SER  57           HG       SER  57  12.738  25.759 -46.119
  431    H    ALA  58           H        ALA  58  10.684  24.965 -42.193
  432    HA   ALA  58           HA       ALA  58   8.775  26.729 -40.846
  433    HB1  ALA  58           HB1      ALA  58   6.745  25.602 -41.725
  434    HB2  ALA  58           HB2      ALA  58   7.629  26.437 -43.009
  435    HB3  ALA  58           HB3      ALA  58   7.747  24.672 -42.859
  436    H    TRP  59           H        TRP  59   9.371  23.195 -41.531
  437    HA   TRP  59           HA       TRP  59   8.875  22.645 -38.640
  438    HB2  TRP  59           HB2      TRP  59   6.701  22.752 -39.777
  439    HB3  TRP  59           HB3      TRP  59   7.210  21.547 -40.935
  440    HD1  TRP  59           HD1      TRP  59   6.582  19.141 -40.365
  441    HE1  TRP  59           HE1      TRP  59   5.540  17.931 -38.361
  442    HE3  TRP  59           HE3      TRP  59   6.881  22.909 -36.901
  443    HZ2  TRP  59           HZ2      TRP  59   4.866  18.535 -35.623
  444    HZ3  TRP  59           HZ3      TRP  59   6.031  22.555 -34.592
  445    HH2  TRP  59           HH2      TRP  59   5.020  20.383 -33.944
  446    H    ARG  60           H        ARG  60   8.934  20.552 -41.488
  447    HA   ARG  60           HA       ARG  60   9.464  18.222 -40.919
  448    HB2  ARG  60           HB2      ARG  60   9.850  19.103 -43.166
  449    HB3  ARG  60           HB3      ARG  60  11.505  19.518 -42.737
  450    HG2  ARG  60           HG2      ARG  60  11.286  17.431 -44.049
  451    HG3  ARG  60           HG3      ARG  60  12.109  17.162 -42.523
  452    HD2  ARG  60           HD2      ARG  60   9.132  16.644 -42.817
  453    HD3  ARG  60           HD3      ARG  60  10.316  15.471 -43.399
  454    HE   ARG  60           HE       ARG  60  11.236  15.740 -40.898
  455   HH11  ARG  60          HH11      ARG  60   7.907  15.097 -41.919
  456   HH12  ARG  60          HH12      ARG  60   7.609  14.221 -40.427
  457   HH21  ARG  60          HH21      ARG  60  10.677  14.677 -39.104
  458   HH22  ARG  60          HH22      ARG  60   9.027  14.058 -38.914
  459    H    TRP  61           H        TRP  61   9.915  17.953 -38.797
  460    HA   TRP  61           HA       TRP  61  12.401  18.306 -37.532
  461    HB2  TRP  61           HB2      TRP  61  10.114  16.373 -36.960
  462    HB3  TRP  61           HB3      TRP  61  11.443  16.708 -35.857
  463    HD1  TRP  61           HD1      TRP  61   8.057  17.843 -36.546
  464    HE1  TRP  61           HE1      TRP  61   7.559  20.110 -35.430
  465    HE3  TRP  61           HE3      TRP  61  12.806  19.120 -35.224
  466    HZ2  TRP  61           HZ2      TRP  61   9.053  22.166 -34.018
  467    HZ3  TRP  61           HZ3      TRP  61  13.259  21.216 -33.987
  468    HH2  TRP  61           HH2      TRP  61  11.407  22.741 -33.375
  469    H    VAL  62           H        VAL  62  13.866  16.846 -36.704
  470    HA   VAL  62           HA       VAL  62  14.198  14.125 -37.866
  471    HB   VAL  62           HB       VAL  62  16.402  16.189 -37.379
  472   HG11  VAL  62          HG11      VAL  62  17.208  13.853 -37.121
  473   HG12  VAL  62          HG12      VAL  62  16.569  13.467 -38.739
  474   HG13  VAL  62          HG13      VAL  62  17.890  14.632 -38.539
  475   HG21  VAL  62          HG21      VAL  62  15.237  15.224 -40.020
  476   HG22  VAL  62          HG22      VAL  62  15.162  16.873 -39.352
  477   HG23  VAL  62          HG23      VAL  62  16.720  16.196 -39.827
  478    HA   PRO  63           HA       PRO  63  14.859  13.421 -33.393
  479    HB2  PRO  63           HB2      PRO  63  15.669  10.811 -33.404
  480    HB3  PRO  63           HB3      PRO  63  14.015  11.294 -33.862
  481    HG2  PRO  63           HG2      PRO  63  16.361  10.822 -35.732
  482    HG3  PRO  63           HG3      PRO  63  14.738  10.053 -35.789
  483    HD2  PRO  63           HD2      PRO  63  15.311  12.224 -37.283
  484    HD3  PRO  63           HD3      PRO  63  13.717  12.068 -36.496
  485    H    LEU  64           H        LEU  64  16.744  15.015 -34.540
  486    HA   LEU  64           HA       LEU  64  18.837  15.717 -34.795
  487    HB2  LEU  64           HB2      LEU  64  18.587  15.893 -32.380
  488    HB3  LEU  64           HB3      LEU  64  19.241  14.277 -32.158
  489    HG   LEU  64           HG       LEU  64  21.433  15.027 -33.051
  490   HD11  LEU  64          HD11      LEU  64  20.128  17.779 -33.211
  491   HD12  LEU  64          HD12      LEU  64  21.869  17.454 -33.351
  492   HD13  LEU  64          HD13      LEU  64  20.767  16.833 -34.577
  493   HD21  LEU  64          HD21      LEU  64  20.371  16.864 -30.870
  494   HD22  LEU  64          HD22      LEU  64  20.927  15.191 -30.625
  495   HD23  LEU  64          HD23      LEU  64  22.068  16.433 -31.163
  496    H    GLN  65           H        GLN  65  20.066  12.708 -33.389
  497    HA   GLN  65           HA       GLN  65  21.666  11.271 -34.131
  498    HB2  GLN  65           HB2      GLN  65  19.371  11.178 -36.080
  499    HB3  GLN  65           HB3      GLN  65  20.709  10.036 -36.251
  500    HG2  GLN  65           HG2      GLN  65  20.396   9.134 -34.067
  501    HG3  GLN  65           HG3      GLN  65  19.361  10.450 -33.577
  502   HE21  GLN  65          HE22      GLN  65  17.780   8.949 -32.847
  503   HE22  GLN  65          HE21      GLN  65  16.788   8.067 -34.004
  504    H    GLU  66           H        GLU  66  22.097  14.131 -35.476
  505    HA   GLU  66           HA       GLU  66  23.776  13.624 -37.729
  506    HB2  GLU  66           HB2      GLU  66  23.870  15.866 -35.665
  507    HB3  GLU  66           HB3      GLU  66  24.758  15.850 -37.195
  508    HG2  GLU  66           HG2      GLU  66  22.571  15.657 -38.420
  509    HG3  GLU  66           HG3      GLU  66  21.731  15.847 -36.876
  510    H    ASP  67           H        ASP  67  24.391  13.184 -34.347
  511    HA   ASP  67           HA       ASP  67  27.005  11.912 -34.960
  512    HB2  ASP  67           HB2      ASP  67  27.548  14.198 -34.189
  513    HB3  ASP  67           HB3      ASP  67  26.597  13.943 -32.727
  514    H    ALA  68           H        ALA  68  24.435  12.475 -32.526
  515    HA   ALA  68           HA       ALA  68  24.763   9.976 -31.125
  516    HB1  ALA  68           HB1      ALA  68  23.767  12.045 -30.159
  517    HB2  ALA  68           HB2      ALA  68  22.408  11.927 -31.299
  518    HB3  ALA  68           HB3      ALA  68  22.651  10.680 -30.060
  519    H    ALA  69           H        ALA  69  24.789   9.358 -33.824
  520    HA   ALA  69           HA       ALA  69  22.614   9.021 -35.378
  521    HB1  ALA  69           HB1      ALA  69  23.957   7.380 -36.602
  522    HB2  ALA  69           HB2      ALA  69  24.948   8.736 -36.038
  523    HB3  ALA  69           HB3      ALA  69  25.013   7.173 -35.188
  524    H    ASP  70           H        ASP  70  23.182   6.818 -32.701
  525    HA   ASP  70           HA       ASP  70  20.560   5.550 -33.288
  526    HB2  ASP  70           HB2      ASP  70  22.432   4.109 -34.196
  527    HB3  ASP  70           HB3      ASP  70  23.062   3.972 -32.557
  528    H    GLU  71           H        GLU  71  21.759   7.572 -31.346
  529    HA   GLU  71           HA       GLU  71  20.833   6.391 -28.788
  530    HB2  GLU  71           HB2      GLU  71  22.914   6.894 -27.643
  531    HB3  GLU  71           HB3      GLU  71  23.183   5.759 -28.955
  532    HG2  GLU  71           HG2      GLU  71  24.062   7.596 -30.386
  533    HG3  GLU  71           HG3      GLU  71  23.790   8.745 -29.078
  534    H    SER  72           H        SER  72  20.096   8.797 -30.689
  535    HA   SER  72           HA       SER  72  20.327  11.086 -28.913
  536    HB2  SER  72           HB2      SER  72  18.685  12.143 -30.343
  537    HB3  SER  72           HB3      SER  72  19.951  11.373 -31.309
  538    HG   SER  72           HG       SER  72  17.815  11.048 -32.071
  539    H    GLN  73           H        GLN  73  17.963   8.511 -29.342
  540    HA   GLN  73           HA       GLN  73  16.094   9.462 -27.346
  541    HB2  GLN  73           HB2      GLN  73  14.930   7.483 -27.627
  542    HB3  GLN  73           HB3      GLN  73  15.498   7.940 -29.218
  543    HG2  GLN  73           HG2      GLN  73  16.546   5.693 -27.455
  544    HG3  GLN  73           HG3      GLN  73  15.605   5.531 -28.918
  545   HE21  GLN  73          HE22      GLN  73  18.264   4.385 -28.251
  546   HE22  GLN  73          HE21      GLN  73  19.301   4.913 -29.579
  547    H    ASN  74           H        ASN  74  16.332   9.530 -25.265
  548    HA   ASN  74           HA       ASN  74  18.246   7.752 -23.804
  549    HB2  ASN  74           HB2      ASN  74  18.041  10.796 -23.790
  550    HB3  ASN  74           HB3      ASN  74  19.022   9.874 -22.651
  551   HD21  ASN  74          HD22      ASN  74  19.706   8.079 -25.222
  552   HD22  ASN  74          HD21      ASN  74  20.943   9.057 -25.952
  553    H    ASP  75           H        ASP  75  18.096   8.478 -21.379
  554    HA   ASP  75           HA       ASP  75  15.340   8.975 -20.435
  555    HB2  ASP  75           HB2      ASP  75  15.402   7.107 -18.905
  556    HB3  ASP  75           HB3      ASP  75  15.554   6.533 -20.555
  557    H    TRP  76           H        TRP  76  15.567   9.088 -17.836
  558    HA   TRP  76           HA       TRP  76  18.183  10.153 -16.951
  559    HB2  TRP  76           HB2      TRP  76  15.611  11.781 -16.880
  560    HB3  TRP  76           HB3      TRP  76  16.956  12.092 -15.803
  561    HD1  TRP  76           HD1      TRP  76  19.383  11.997 -17.753
  562    HE1  TRP  76           HE1      TRP  76  19.756  13.884 -19.441
  563    HE3  TRP  76           HE3      TRP  76  14.593  13.822 -18.013
  564    HZ2  TRP  76           HZ2      TRP  76  18.195  15.916 -20.742
  565    HZ3  TRP  76           HZ3      TRP  76  14.073  15.734 -19.514
  566    HH2  TRP  76           HH2      TRP  76  15.855  16.764 -20.902
  567    H    ASP  77           H        ASP  77  14.802   9.472 -16.008
  568    HA   ASP  77           HA       ASP  77  15.190   9.644 -13.226
  569    HB2  ASP  77           HB2      ASP  77  12.922   8.650 -13.159
  570    HB3  ASP  77           HB3      ASP  77  13.067   9.989 -14.293
  571    H    GLU  78           H        GLU  78  14.782   8.095 -11.599
  572    HA   GLU  78           HA       GLU  78  15.063   5.211 -12.199
  573    HB2  GLU  78           HB2      GLU  78  16.783   4.815 -10.578
  574    HB3  GLU  78           HB3      GLU  78  17.338   6.039 -11.717
  575    HG2  GLU  78           HG2      GLU  78  16.561   7.780  -9.954
  576    HG3  GLU  78           HG3      GLU  78  16.453   6.424  -8.836
  577    H    GLU  79           H        GLU  79  13.755   7.716 -10.144
  578    HA   GLU  79           HA       GLU  79  11.974   5.692  -8.849
  579    HB2  GLU  79           HB2      GLU  79  13.284   8.122  -7.566
  580    HB3  GLU  79           HB3      GLU  79  11.970   7.222  -6.826
  581    HG2  GLU  79           HG2      GLU  79  14.715   6.112  -7.474
  582    HG3  GLU  79           HG3      GLU  79  14.141   6.611  -5.896
  583    H    LEU  80           H        LEU  80  11.772   7.653 -11.259
  584    HA   LEU  80           HA       LEU  80   9.353   9.170 -10.356
  585    HB2  LEU  80           HB2      LEU  80  11.162   9.962 -12.647
  586    HB3  LEU  80           HB3      LEU  80   9.862  10.888 -11.940
  587    HG   LEU  80           HG       LEU  80  12.553  10.338 -10.614
  588   HD11  LEU  80          HD11      LEU  80  12.569  11.871 -12.555
  589   HD12  LEU  80          HD12      LEU  80  11.365  12.888 -11.733
  590   HD13  LEU  80          HD13      LEU  80  12.986  12.635 -11.029
  591   HD21  LEU  80          HD21      LEU  80  10.194  12.033  -9.695
  592   HD22  LEU  80          HD22      LEU  80  10.737  10.523  -8.929
  593   HD23  LEU  80          HD23      LEU  80  11.793  11.935  -8.924
  594    H    SER  81           H        SER  81   7.756   9.563 -11.857
  595    HA   SER  81           HA       SER  81   7.712   8.214 -14.511
  596    HB2  SER  81           HB2      SER  81   6.363   6.874 -12.884
  597    HB3  SER  81           HB3      SER  81   5.388   8.320 -12.537
  598    HG   SER  81           HG       SER  81   4.460   6.963 -14.167
  599    H    ILE  82           H        ILE  82   6.939   9.606 -16.099
  600    HA   ILE  82           HA       ILE  82   6.495  12.422 -15.228
  601    HB   ILE  82           HB       ILE  82   8.136  11.111 -17.348
  602   HG12  ILE  82          HG12      ILE  82   9.640  13.017 -16.894
  603   HG13  ILE  82          HG13      ILE  82   8.444  13.727 -15.811
  604   HG21  ILE  82          HG21      ILE  82   6.668  12.343 -18.827
  605   HG22  ILE  82          HG22      ILE  82   6.873  13.827 -17.860
  606   HG23  ILE  82          HG23      ILE  82   8.238  13.132 -18.753
  607   HD11  ILE  82          HD11      ILE  82  10.348  12.554 -14.671
  608   HD12  ILE  82          HD12      ILE  82   8.763  11.935 -14.198
  609   HD13  ILE  82          HD13      ILE  82   9.771  11.018 -15.350
  610    H    HIS  83           H        HIS  83   4.966  13.671 -16.069
  611    HA   HIS  83           HA       HIS  83   3.005  12.598 -18.052
  612    HB2  HIS  83           HB2      HIS  83   2.321  13.947 -15.404
  613    HB3  HIS  83           HB3      HIS  83   1.169  13.446 -16.636
  614    HD1  HIS  83           HD1      HIS  83   0.556  10.816 -16.689
  615    HD2  HIS  83           HD2      HIS  83   3.430  12.002 -13.851
  616    HE1  HIS  83           HE1      HIS  83   0.863   8.839 -15.111
  617    H    LEU  84           H        LEU  84   1.916  14.266 -19.261
  618    HA   LEU  84           HA       LEU  84   3.251  16.957 -19.183
  619    HB2  LEU  84           HB2      LEU  84   2.454  15.316 -21.609
  620    HB3  LEU  84           HB3      LEU  84   3.232  16.896 -21.629
  621    HG   LEU  84           HG       LEU  84   4.489  14.297 -20.644
  622   HD11  LEU  84          HD11      LEU  84   5.073  15.980 -23.110
  623   HD12  LEU  84          HD12      LEU  84   5.807  14.421 -22.661
  624   HD13  LEU  84          HD13      LEU  84   4.099  14.494 -23.112
  625   HD21  LEU  84          HD21      LEU  84   6.607  15.588 -20.624
  626   HD22  LEU  84          HD22      LEU  84   5.704  17.076 -20.985
  627   HD23  LEU  84          HD23      LEU  84   5.456  16.224 -19.443
  628    H    GLN  85           H        GLN  85   2.085  18.734 -19.870
  629    HA   GLN  85           HA       GLN  85  -0.811  18.455 -20.485
  630    HB2  GLN  85           HB2      GLN  85   0.264  20.460 -18.472
  631    HB3  GLN  85           HB3      GLN  85  -1.399  20.156 -18.921
  632    HG2  GLN  85           HG2      GLN  85  -1.281  19.170 -16.843
  633    HG3  GLN  85           HG3      GLN  85  -1.055  17.783 -17.894
  634   HE21  GLN  85          HE22      GLN  85   0.700  16.474 -17.285
  635   HE22  GLN  85          HE21      GLN  85   2.099  17.070 -16.395
  636    HA   PRO  86           HA       PRO  86  -2.237  19.246 -21.814
  637    HB2  PRO  86           HB2      PRO  86  -3.052  20.076 -24.241
  638    HB3  PRO  86           HB3      PRO  86  -3.126  21.162 -22.823
  639    HG2  PRO  86           HG2      PRO  86  -0.955  21.038 -24.949
  640    HG3  PRO  86           HG3      PRO  86  -1.853  22.480 -24.372
  641    HD2  PRO  86           HD2      PRO  86   0.605  21.756 -23.374
  642    HD3  PRO  86           HD3      PRO  86  -0.638  22.551 -22.367
  643    H    PHE  87           H        PHE  87   0.788  19.057 -23.359
  644    HA   PHE  87           HA       PHE  87   0.312  17.619 -25.685
  645    HB2  PHE  87           HB2      PHE  87   2.769  17.587 -23.894
  646    HB3  PHE  87           HB3      PHE  87   2.730  17.055 -25.565
  647    HD1  PHE  87           HD2      PHE  87   1.264  19.087 -27.041
  648    HD2  PHE  87           HD1      PHE  87   4.108  19.519 -23.816
  649    HE1  PHE  87           HE2      PHE  87   1.824  21.372 -27.829
  650    HE2  PHE  87           HE1      PHE  87   4.712  21.770 -24.661
  651    HZ   PHE  87           HZ       PHE  87   3.545  22.716 -26.640
  652    H    LYS  88           H        LYS  88   0.894  15.621 -26.373
  653    HA   LYS  88           HA       LYS  88   0.073  13.298 -24.725
  654    HB2  LYS  88           HB2      LYS  88   0.797  13.649 -27.668
  655    HB3  LYS  88           HB3      LYS  88   0.273  12.125 -26.950
  656    HG2  LYS  88           HG2      LYS  88  -1.925  12.931 -26.526
  657    HG3  LYS  88           HG3      LYS  88  -1.472  14.621 -26.807
  658    HD2  LYS  88           HD2      LYS  88  -1.001  14.174 -29.160
  659    HD3  LYS  88           HD3      LYS  88  -1.420  12.466 -28.966
  660    HE2  LYS  88           HE2      LYS  88  -3.315  14.812 -28.465
  661    HE3  LYS  88           HE3      LYS  88  -3.220  13.921 -29.985
  662    HZ1  LYS  88           HZ1      LYS  88  -3.879  11.905 -28.783
  663    HZ2  LYS  88           HZ2      LYS  88  -3.993  12.726 -27.375
  664    HZ3  LYS  88           HZ3      LYS  88  -5.006  13.063 -28.602
  665    HA   PRO  89           HA       PRO  89   4.562  12.358 -24.392
  666    HB2  PRO  89           HB2      PRO  89   4.470  10.317 -22.599
  667    HB3  PRO  89           HB3      PRO  89   4.187  12.016 -22.132
  668    HG2  PRO  89           HG2      PRO  89   2.109   9.887 -22.725
  669    HG3  PRO  89           HG3      PRO  89   2.178  11.014 -21.335
  670    HD2  PRO  89           HD2      PRO  89   0.660  11.476 -23.584
  671    HD3  PRO  89           HD3      PRO  89   1.386  12.801 -22.624
  672    H    ASP  90           H        ASP  90   4.515  11.769 -26.661
  673    HA   ASP  90           HA       ASP  90   4.549   8.873 -27.257
  674    HB2  ASP  90           HB2      ASP  90   2.172   9.453 -27.459
  675    HB3  ASP  90           HB3      ASP  90   2.561  10.829 -28.484
  676    H    ASP  91           H        ASP  91   5.628   8.344 -29.199
  677    HA   ASP  91           HA       ASP  91   7.460  10.389 -30.200
  678    HB2  ASP  91           HB2      ASP  91   8.084   8.018 -29.574
  679    HB3  ASP  91           HB3      ASP  91   7.281   7.484 -31.050
  680    H    SER  92           H        SER  92   5.229  11.395 -30.875
  681    HA   SER  92           HA       SER  92   3.860  10.529 -33.187
  682    HB2  SER  92           HB2      SER  92   3.858  13.366 -32.121
  683    HB3  SER  92           HB3      SER  92   2.538  12.483 -32.904
  684    HG   SER  92           HG       SER  92   2.762  11.018 -30.964
  685    H    ASN  93           H        ASN  93   6.647  10.791 -33.944
  686    HA   ASN  93           HA       ASN  93   8.111  11.627 -35.425
  687    HB2  ASN  93           HB2      ASN  93   6.221  10.833 -36.908
  688    HB3  ASN  93           HB3      ASN  93   5.694  12.510 -37.048
  689   HD21  ASN  93          HD22      ASN  93   8.585  10.413 -37.559
  690   HD22  ASN  93          HD21      ASN  93   9.129  11.304 -38.962
  691    H    GLN  94           H        GLN  94   7.006  13.570 -33.326
  692    HA   GLN  94           HA       GLN  94   8.479  15.935 -34.262
  693    HB2  GLN  94           HB2      GLN  94   6.694  17.491 -33.807
  694    HB3  GLN  94           HB3      GLN  94   6.068  16.307 -34.936
  695    HG2  GLN  94           HG2      GLN  94   4.732  15.257 -33.223
  696    HG3  GLN  94           HG3      GLN  94   5.574  16.095 -31.921
  697   HE21  GLN  94          HE22      GLN  94   5.173  18.293 -31.467
  698   HE22  GLN  94          HE21      GLN  94   3.707  19.055 -32.087
  699    HA   PRO  95           HA       PRO  95   9.255  16.176 -29.802
  700    HB2  PRO  95           HB2      PRO  95   9.831  18.811 -29.446
  701    HB3  PRO  95           HB3      PRO  95  10.945  17.692 -30.292
  702    HG2  PRO  95           HG2      PRO  95   8.925  19.611 -31.505
  703    HG3  PRO  95           HG3      PRO  95  10.647  19.388 -31.967
  704    HD2  PRO  95           HD2      PRO  95   8.614  18.194 -33.298
  705    HD3  PRO  95           HD3      PRO  95  10.182  17.373 -33.074
  706    H    GLN  96           H        GLN  96   8.270  17.006 -27.854
  707    HA   GLN  96           HA       GLN  96   5.479  17.991 -28.119
  708    HB2  GLN  96           HB2      GLN  96   7.204  16.947 -25.829
  709    HB3  GLN  96           HB3      GLN  96   5.712  17.832 -25.532
  710    HG2  GLN  96           HG2      GLN  96   5.176  15.511 -25.445
  711    HG3  GLN  96           HG3      GLN  96   4.429  16.213 -26.871
  712   HE21  GLN  96          HE22      GLN  96   4.211  13.954 -27.519
  713   HE22  GLN  96          HE21      GLN  96   5.565  13.162 -28.312
  714    H    VAL  97           H        VAL  97   8.523  18.953 -26.498
  715    HA   VAL  97           HA       VAL  97   7.532  21.699 -25.942
  716    HB   VAL  97           HB       VAL  97  10.317  20.516 -25.510
  717   HG11  VAL  97          HG11      VAL  97   8.909  22.867 -24.177
  718   HG12  VAL  97          HG12      VAL  97  10.528  22.260 -23.780
  719   HG13  VAL  97          HG13      VAL  97  10.231  22.988 -25.358
  720   HG21  VAL  97          HG21      VAL  97   8.799  19.097 -24.256
  721   HG22  VAL  97          HG22      VAL  97   9.601  20.182 -23.124
  722   HG23  VAL  97          HG23      VAL  97   7.927  20.512 -23.630
  723    H    VAL  98           H        VAL  98   8.114  23.520 -27.099
  724    HA   VAL  98           HA       VAL  98  10.230  23.212 -29.194
  725    HB   VAL  98           HB       VAL  98   7.470  24.335 -29.665
  726   HG11  VAL  98          HG11      VAL  98   8.248  24.903 -31.954
  727   HG12  VAL  98          HG12      VAL  98   9.044  25.894 -30.737
  728   HG13  VAL  98          HG13      VAL  98   9.916  24.528 -31.479
  729   HG21  VAL  98          HG21      VAL  98   9.081  22.144 -31.033
  730   HG22  VAL  98          HG22      VAL  98   7.671  21.906 -29.979
  731   HG23  VAL  98          HG23      VAL  98   7.473  22.711 -31.535
  732    H    ILE  99           H        ILE  99  11.471  24.888 -29.601
  733    HA   ILE  99           HA       ILE  99  11.532  27.169 -27.669
  734    HB   ILE  99           HB       ILE  99  13.825  25.448 -28.747
  735   HG12  ILE  99          HG12      ILE  99  14.153  24.980 -26.199
  736   HG13  ILE  99          HG13      ILE  99  12.438  25.344 -26.057
  737   HG21  ILE  99          HG21      ILE  99  13.815  27.734 -26.738
  738   HG22  ILE  99          HG22      ILE  99  15.197  26.685 -27.127
  739   HG23  ILE  99          HG23      ILE  99  14.542  27.735 -28.357
  740   HD11  ILE  99          HD11      ILE  99  13.572  23.242 -27.956
  741   HD12  ILE  99          HD12      ILE  99  13.101  22.893 -26.280
  742   HD13  ILE  99          HD13      ILE  99  11.882  23.419 -27.433
  743    H    LEU 100           H        LEU 100  11.636  29.099 -28.678
  744    HA   LEU 100           HA       LEU 100  12.366  29.320 -31.538
  745    HB2  LEU 100           HB2      LEU 100  11.808  31.595 -29.609
  746    HB3  LEU 100           HB3      LEU 100  11.834  31.640 -31.366
  747    HG   LEU 100           HG       LEU 100   9.707  30.522 -29.534
  748   HD11  LEU 100          HD11      LEU 100   9.578  32.429 -31.913
  749   HD12  LEU 100          HD12      LEU 100   8.277  32.066 -30.758
  750   HD13  LEU 100          HD13      LEU 100   9.719  32.953 -30.233
  751   HD21  LEU 100          HD21      LEU 100   9.955  28.824 -31.334
  752   HD22  LEU 100          HD22      LEU 100   8.462  29.744 -31.531
  753   HD23  LEU 100          HD23      LEU 100   9.864  30.119 -32.554
  754    H    ALA 101           H        ALA 101  13.946  30.854 -32.218
  755    HA   ALA 101           HA       ALA 101  16.561  30.416 -31.103
  756    HB1  ALA 101           HB1      ALA 101  16.163  30.781 -33.497
  757    HB2  ALA 101           HB2      ALA 101  15.580  32.432 -33.171
  758    HB3  ALA 101           HB3      ALA 101  17.275  32.013 -32.864
  759    H    ASP 102           H        ASP 102  14.207  32.915 -30.507
  760    HA   ASP 102           HA       ASP 102  16.012  34.801 -29.195
  761    HB2  ASP 102           HB2      ASP 102  14.018  35.451 -30.512
  762    HB3  ASP 102           HB3      ASP 102  12.983  34.576 -29.386
  763    H    GLY 103           H        GLY 103  14.643  31.840 -28.170
  764    HA2  GLY 103           HA2      GLY 103  14.938  30.880 -26.071
  765    HA3  GLY 103           HA3      GLY 103  15.110  32.462 -25.313
  766    H    GLN 104           H        GLN 104  12.322  32.497 -27.291
  767    HA   GLN 104           HA       GLN 104  10.439  32.224 -25.098
  768    HB2  GLN 104           HB2      GLN 104  10.060  32.389 -28.098
  769    HB3  GLN 104           HB3      GLN 104   8.767  32.514 -26.899
  770    HG2  GLN 104           HG2      GLN 104   9.700  34.593 -26.029
  771    HG3  GLN 104           HG3      GLN 104  11.158  34.396 -27.012
  772   HE21  GLN 104          HE22      GLN 104  11.227  35.861 -28.519
  773   HE22  GLN 104          HE21      GLN 104   9.885  36.286 -29.599
  774    H    ILE 105           H        ILE 105   9.064  30.500 -24.788
  775    HA   ILE 105           HA       ILE 105   9.713  27.907 -26.141
  776    HB   ILE 105           HB       ILE 105   9.207  28.042 -23.175
  777   HG12  ILE 105          HG12      ILE 105  11.144  29.505 -23.408
  778   HG13  ILE 105          HG13      ILE 105  11.498  28.026 -22.546
  779   HG21  ILE 105          HG21      ILE 105   9.069  25.834 -24.124
  780   HG22  ILE 105          HG22      ILE 105  10.577  26.070 -25.029
  781   HG23  ILE 105          HG23      ILE 105  10.597  25.917 -23.255
  782   HD11  ILE 105          HD11      ILE 105  12.681  27.125 -24.491
  783   HD12  ILE 105          HD12      ILE 105  12.229  28.570 -25.432
  784   HD13  ILE 105          HD13      ILE 105  13.312  28.717 -24.048
  785    H    THR 106           H        THR 106   8.017  26.316 -26.088
  786    HA   THR 106           HA       THR 106   5.328  27.060 -26.281
  787    HB   THR 106           HB       THR 106   5.002  24.533 -25.594
  788    HG1  THR 106           HG1      THR 106   7.061  24.333 -24.659
  789   HG21  THR 106          HG21      THR 106   4.822  25.290 -27.878
  790   HG22  THR 106          HG22      THR 106   6.585  25.462 -27.999
  791   HG23  THR 106          HG23      THR 106   5.847  23.843 -27.832
  792    HA   PRO 107           HA       PRO 107   4.557  27.793 -21.870
  793    HB2  PRO 107           HB2      PRO 107   2.070  28.882 -21.977
  794    HB3  PRO 107           HB3      PRO 107   3.544  29.738 -22.498
  795    HG2  PRO 107           HG2      PRO 107   1.553  28.268 -24.232
  796    HG3  PRO 107           HG3      PRO 107   2.273  29.895 -24.478
  797    HD2  PRO 107           HD2      PRO 107   3.219  27.623 -25.707
  798    HD3  PRO 107           HD3      PRO 107   4.275  28.997 -25.262
  799    H    PHE 108           H        PHE 108   4.722  25.434 -21.711
  800    HA   PHE 108           HA       PHE 108   2.129  23.990 -21.349
  801    HB2  PHE 108           HB2      PHE 108   3.056  22.144 -22.269
  802    HB3  PHE 108           HB3      PHE 108   3.936  23.356 -23.156
  803    HD1  PHE 108           HD2      PHE 108   6.343  23.989 -22.200
  804    HD2  PHE 108           HD1      PHE 108   4.188  20.427 -21.069
  805    HE1  PHE 108           HE2      PHE 108   8.464  22.929 -21.505
  806    HE2  PHE 108           HE1      PHE 108   6.318  19.347 -20.483
  807    HZ   PHE 108           HZ       PHE 108   8.459  20.597 -20.630
  808    H    SER 109           H        SER 109   2.586  21.912 -19.908
  809    HA   SER 109           HA       SER 109   4.357  22.546 -17.651
  810    HB2  SER 109           HB2      SER 109   1.509  21.653 -17.123
  811    HB3  SER 109           HB3      SER 109   2.753  22.059 -15.931
  812    HG   SER 109           HG       SER 109   2.643  24.174 -17.364
  813    H    LEU 110           H        LEU 110   5.050  20.828 -16.485
  814    HA   LEU 110           HA       LEU 110   4.595  18.051 -17.475
  815    HB2  LEU 110           HB2      LEU 110   6.496  18.322 -18.631
  816    HB3  LEU 110           HB3      LEU 110   6.941  19.795 -17.793
  817    HG   LEU 110           HG       LEU 110   7.924  18.402 -15.952
  818   HD11  LEU 110          HD11      LEU 110   7.654  16.154 -18.022
  819   HD12  LEU 110          HD12      LEU 110   8.546  16.069 -16.491
  820   HD13  LEU 110          HD13      LEU 110   6.787  16.178 -16.485
  821   HD21  LEU 110          HD21      LEU 110   9.257  19.439 -17.752
  822   HD22  LEU 110          HD22      LEU 110   9.942  17.870 -17.300
  823   HD23  LEU 110          HD23      LEU 110   8.993  18.027 -18.790
  824    H    LEU 111           H        LEU 111   4.649  16.514 -15.865
  825    HA   LEU 111           HA       LEU 111   5.100  17.433 -13.060
  826    HB2  LEU 111           HB2      LEU 111   2.766  17.556 -13.623
  827    HB3  LEU 111           HB3      LEU 111   2.747  15.929 -14.283
  828    HG   LEU 111           HG       LEU 111   3.582  16.321 -11.417
  829   HD11  LEU 111          HD11      LEU 111   1.555  17.658 -11.604
  830   HD12  LEU 111          HD12      LEU 111   0.704  16.316 -12.403
  831   HD13  LEU 111          HD13      LEU 111   1.222  16.160 -10.708
  832   HD21  LEU 111          HD21      LEU 111   1.864  14.166 -12.750
  833   HD22  LEU 111          HD22      LEU 111   3.596  13.992 -12.438
  834   HD23  LEU 111          HD23      LEU 111   2.480  14.147 -11.086
  835    H    MET 112           H        MET 112   5.844  15.942 -11.617
  836    HA   MET 112           HA       MET 112   6.853  13.338 -12.702
  837    HB2  MET 112           HB2      MET 112   8.234  15.265 -10.784
  838    HB3  MET 112           HB3      MET 112   8.836  13.672 -11.267
  839    HG2  MET 112           HG2      MET 112   8.949  14.425 -13.620
  840    HG3  MET 112           HG3      MET 112   8.358  16.020 -13.149
  841    HE1  MET 112           HE1      MET 112  10.999  15.515 -14.891
  842    HE2  MET 112           HE2      MET 112  10.298  17.092 -14.466
  843    HE3  MET 112           HE3      MET 112  12.023  16.780 -14.172
  844    H    ALA 113           H        ALA 113   6.257  11.626 -11.573
  845    HA   ALA 113           HA       ALA 113   5.138  11.889  -8.813
  846    HB1  ALA 113           HB1      ALA 113   3.488  10.204  -9.512
  847    HB2  ALA 113           HB2      ALA 113   3.369  11.681 -10.487
  848    HB3  ALA 113           HB3      ALA 113   4.151  10.230 -11.159
  849    H    ASN 114           H        ASN 114   5.612  10.253  -7.349
  850    HA   ASN 114           HA       ASN 114   7.864   8.631  -7.427
  851    HB2  ASN 114           HB2      ASN 114   6.510   9.086  -5.423
  852    HB3  ASN 114           HB3      ASN 114   5.154   8.187  -6.078
  853   HD21  ASN 114          HD22      ASN 114   7.293   7.937  -3.703
  854   HD22  ASN 114          HD21      ASN 114   7.522   6.198  -3.695
  855    H    ALA 115           H        ALA 115   8.478   6.957  -8.697
  856    HA   ALA 115           HA       ALA 115   7.094   6.062 -10.876
  857    HB1  ALA 115           HB1      ALA 115   9.491   5.833 -10.654
  858    HB2  ALA 115           HB2      ALA 115   9.311   4.640  -9.345
  859    HB3  ALA 115           HB3      ALA 115   8.811   4.248 -11.004
  860    H    GLY 116           H        GLY 116   6.842   4.511  -7.687
  861    HA2  GLY 116           HA2      GLY 116   5.258   2.249  -8.878
  862    HA3  GLY 116           HA3      GLY 116   6.074   2.252  -7.320
  863    H    THR 117           H        THR 117   4.951   5.058  -6.820
  864    HA   THR 117           HA       THR 117   2.410   4.048  -5.618
  865    HB   THR 117           HB       THR 117   3.938   6.482  -4.695
  866    HG1  THR 117           HG1      THR 117   5.432   4.905  -4.695
  867   HG21  THR 117          HG21      THR 117   2.221   4.443  -3.219
  868   HG22  THR 117          HG22      THR 117   3.091   5.804  -2.483
  869   HG23  THR 117          HG23      THR 117   1.758   6.114  -3.604
  870    H    GLY 118           H        GLY 118   3.544   6.511  -7.850
  871    HA2  GLY 118           HA2      GLY 118   2.268   7.677  -9.361
  872    HA3  GLY 118           HA3      GLY 118   0.793   7.108  -8.578
  873    H    GLU 119           H        GLU 119   2.509   8.424  -6.116
  874    HA   GLU 119           HA       GLU 119   0.998  10.861  -5.875
  875    HB2  GLU 119           HB2      GLU 119   3.413   9.707  -4.437
  876    HB3  GLU 119           HB3      GLU 119   2.631  11.215  -3.947
  877    HG2  GLU 119           HG2      GLU 119   1.246   8.498  -4.072
  878    HG3  GLU 119           HG3      GLU 119   1.939   9.208  -2.625
  879    HA   PRO 120           HA       PRO 120   3.841  13.455  -8.371
  880    HB2  PRO 120           HB2      PRO 120   2.274  15.593  -6.962
  881    HB3  PRO 120           HB3      PRO 120   2.744  15.483  -8.684
  882    HG2  PRO 120           HG2      PRO 120   0.211  14.904  -7.898
  883    HG3  PRO 120           HG3      PRO 120   1.031  13.870  -9.113
  884    HD2  PRO 120           HD2      PRO 120   0.704  13.374  -6.144
  885    HD3  PRO 120           HD3      PRO 120   0.462  12.249  -7.516
  886    H    LEU 121           H        LEU 121   5.782  14.401  -7.829
  887    HA   LEU 121           HA       LEU 121   6.282  15.194  -4.965
  888    HB2  LEU 121           HB2      LEU 121   8.613  14.988  -6.816
  889    HB3  LEU 121           HB3      LEU 121   8.494  14.735  -5.104
  890    HG   LEU 121           HG       LEU 121   9.225  12.739  -6.101
  891   HD11  LEU 121          HD11      LEU 121   6.302  12.268  -5.478
  892   HD12  LEU 121          HD12      LEU 121   7.626  11.086  -5.446
  893   HD13  LEU 121          HD13      LEU 121   7.602  12.418  -4.279
  894   HD21  LEU 121          HD21      LEU 121   8.405  13.313  -8.385
  895   HD22  LEU 121          HD22      LEU 121   8.344  11.602  -7.900
  896   HD23  LEU 121          HD23      LEU 121   6.868  12.581  -7.889
  897    H    LEU 122           H        LEU 122   6.558  16.107  -8.362
  898    HA   LEU 122           HA       LEU 122   6.969  18.976  -7.714
  899    HB2  LEU 122           HB2      LEU 122   9.189  17.541  -7.873
  900    HB3  LEU 122           HB3      LEU 122   8.793  17.396  -9.571
  901    HG   LEU 122           HG       LEU 122   8.770  20.010  -9.602
  902   HD11  LEU 122          HD11      LEU 122  10.307  19.532  -7.003
  903   HD12  LEU 122          HD12      LEU 122  10.117  21.085  -7.847
  904   HD13  LEU 122          HD13      LEU 122   8.720  20.298  -7.104
  905   HD21  LEU 122          HD21      LEU 122  10.551  18.586 -10.570
  906   HD22  LEU 122          HD22      LEU 122  11.184  20.079  -9.870
  907   HD23  LEU 122          HD23      LEU 122  11.355  18.541  -8.988
  908    H    THR 123           H        THR 123   6.553  20.340  -9.418
  909    HA   THR 123           HA       THR 123   5.625  19.275 -12.026
  910    HB   THR 123           HB       THR 123   4.121  21.442 -10.527
  911    HG1  THR 123           HG1      THR 123   3.790  18.661 -10.502
  912   HG21  THR 123          HG21      THR 123   3.344  19.691 -12.882
  913   HG22  THR 123          HG22      THR 123   2.296  20.872 -12.067
  914   HG23  THR 123          HG23      THR 123   3.727  21.429 -12.948
  915    H    LEU 124           H        LEU 124   6.029  20.645 -13.703
  916    HA   LEU 124           HA       LEU 124   7.783  23.009 -13.246
  917    HB2  LEU 124           HB2      LEU 124   7.975  20.892 -15.432
  918    HB3  LEU 124           HB3      LEU 124   9.030  22.292 -15.238
  919    HG   LEU 124           HG       LEU 124   8.824  19.922 -13.325
  920   HD11  LEU 124          HD11      LEU 124  11.104  20.845 -15.128
  921   HD12  LEU 124          HD12      LEU 124  11.090  19.418 -14.064
  922   HD13  LEU 124          HD13      LEU 124  10.024  19.477 -15.463
  923   HD21  LEU 124          HD21      LEU 124  10.743  20.906 -12.175
  924   HD22  LEU 124          HD22      LEU 124  10.645  22.352 -13.220
  925   HD23  LEU 124          HD23      LEU 124   9.346  21.950 -12.069
  926    H    VAL 125           H        VAL 125   7.239  24.758 -14.334
  927    HA   VAL 125           HA       VAL 125   4.925  24.651 -16.247
  928    HB   VAL 125           HB       VAL 125   5.277  26.685 -14.012
  929   HG11  VAL 125          HG11      VAL 125   2.841  25.866 -15.657
  930   HG12  VAL 125          HG12      VAL 125   2.866  27.081 -14.364
  931   HG13  VAL 125          HG13      VAL 125   3.769  27.372 -15.850
  932   HG21  VAL 125          HG21      VAL 125   5.001  24.563 -12.849
  933   HG22  VAL 125          HG22      VAL 125   3.500  25.458 -12.765
  934   HG23  VAL 125          HG23      VAL 125   3.657  24.103 -13.918
  935    H    CYS 126           H        CYS 126   4.923  26.018 -17.948
  936    HA   CYS 126           HA       CYS 126   7.241  27.893 -18.230
  937    HB2  CYS 126           HB2      CYS 126   7.116  25.886 -19.760
  938    HB3  CYS 126           HB3      CYS 126   5.574  26.503 -20.346
  939    HG   CYS 126           HG       CYS 126   7.266  27.113 -22.136
  940    H    SER 127           H        SER 127   6.819  29.999 -18.268
  941    HA   SER 127           HA       SER 127   4.169  31.168 -18.462
  942    HB2  SER 127           HB2      SER 127   5.476  33.285 -18.355
  943    HB3  SER 127           HB3      SER 127   5.935  32.142 -17.079
  944    HG   SER 127           HG       SER 127   7.767  33.044 -18.134
  945    H    GLY 128           H        GLY 128   6.452  30.163 -20.827
  946    HA2  GLY 128           HA2      GLY 128   5.787  30.422 -23.233
  947    HA3  GLY 128           HA3      GLY 128   5.501  32.127 -22.892
  948    H    SER 129           H        SER 129   8.183  31.296 -21.062
  949    HA   SER 129           HA       SER 129  10.224  31.601 -23.150
  950    HB2  SER 129           HB2      SER 129   9.261  33.917 -22.676
  951    HB3  SER 129           HB3      SER 129   9.949  33.769 -21.045
  952    HG   SER 129           HG       SER 129  11.373  34.797 -22.544
  953    H    TRP 130           H        TRP 130  12.374  31.542 -22.385
  954    HA   TRP 130           HA       TRP 130  12.940  29.485 -20.590
  955    HB2  TRP 130           HB2      TRP 130  14.417  30.024 -22.356
  956    HB3  TRP 130           HB3      TRP 130  14.530  31.707 -21.880
  957    HD1  TRP 130           HD1      TRP 130  16.466  32.432 -20.430
  958    HE1  TRP 130           HE1      TRP 130  18.372  31.289 -19.148
  959    HE3  TRP 130           HE3      TRP 130  14.985  27.560 -20.965
  960    HZ2  TRP 130           HZ2      TRP 130  19.197  28.587 -18.499
  961    HZ3  TRP 130           HZ3      TRP 130  16.338  25.737 -19.955
  962    HH2  TRP 130           HH2      TRP 130  18.428  26.240 -18.740
  963    HA   PRO 131           HA       PRO 131  13.550  28.390 -19.032
  964    HB2  PRO 131           HB2      PRO 131  14.323  27.544 -16.622
  965    HB3  PRO 131           HB3      PRO 131  15.477  28.409 -17.671
  966    HG2  PRO 131           HG2      PRO 131  13.875  29.518 -15.360
  967    HG3  PRO 131           HG3      PRO 131  15.619  29.730 -15.731
  968    HD2  PRO 131           HD2      PRO 131  13.609  31.547 -16.452
  969    HD3  PRO 131           HD3      PRO 131  15.175  31.386 -17.296
  970    H    LEU 132           H        LEU 132  12.367  26.564 -17.673
  971    HA   LEU 132           HA       LEU 132   9.670  27.394 -16.944
  972    HB2  LEU 132           HB2      LEU 132  11.167  24.743 -16.997
  973    HB3  LEU 132           HB3      LEU 132   9.689  24.911 -16.066
  974    HG   LEU 132           HG       LEU 132   8.627  25.896 -18.205
  975   HD11  LEU 132          HD11      LEU 132  10.663  26.077 -19.587
  976   HD12  LEU 132          HD12      LEU 132  10.901  24.316 -19.452
  977   HD13  LEU 132          HD13      LEU 132   9.493  24.974 -20.313
  978   HD21  LEU 132          HD21      LEU 132   7.946  23.782 -17.221
  979   HD22  LEU 132          HD22      LEU 132   8.007  23.630 -18.974
  980   HD23  LEU 132          HD23      LEU 132   9.314  22.950 -17.977
  981    H    ASP 133           H        ASP 133   8.738  26.809 -14.918
  982    HA   ASP 133           HA       ASP 133  10.469  27.548 -12.578
  983    HB2  ASP 133           HB2      ASP 133   8.898  29.298 -13.318
  984    HB3  ASP 133           HB3      ASP 133   7.549  28.172 -13.151
  985    H    GLN 134           H        GLN 134  10.410  26.334 -10.771
  986    HA   GLN 134           HA       GLN 134   9.093  23.708 -10.864
  987    HB2  GLN 134           HB2      GLN 134  11.079  24.905  -8.870
  988    HB3  GLN 134           HB3      GLN 134  10.551  23.225  -8.939
  989    HG2  GLN 134           HG2      GLN 134  11.604  23.025 -11.205
  990    HG3  GLN 134           HG3      GLN 134  12.204  24.673 -11.054
  991   HE21  GLN 134          HE22      GLN 134  12.428  21.366  -9.617
  992   HE22  GLN 134          HE21      GLN 134  14.034  21.653  -8.966
  993    H    THR 135           H        THR 135   7.641  22.979  -9.421
  994    HA   THR 135           HA       THR 135   7.123  24.375  -6.868
  995    HB   THR 135           HB       THR 135   5.522  25.373  -8.460
  996    HG1  THR 135           HG1      THR 135   4.579  25.482  -6.637
  997   HG21  THR 135          HG21      THR 135   4.206  22.638  -8.599
  998   HG22  THR 135          HG22      THR 135   3.577  24.165  -9.252
  999   HG23  THR 135          HG23      THR 135   5.038  23.458  -9.950
 1000    H    LEU 136           H        LEU 136   6.197  23.006  -5.263
 1001    HA   LEU 136           HA       LEU 136   6.563  20.107  -5.711
 1002    HB2  LEU 136           HB2      LEU 136   5.885  21.841  -3.317
 1003    HB3  LEU 136           HB3      LEU 136   5.546  20.114  -3.304
 1004    HG   LEU 136           HG       LEU 136   7.911  19.582  -3.739
 1005   HD11  LEU 136          HD11      LEU 136   8.380  22.580  -3.454
 1006   HD12  LEU 136          HD12      LEU 136   9.648  21.335  -3.397
 1007   HD13  LEU 136          HD13      LEU 136   8.732  21.578  -4.883
 1008   HD21  LEU 136          HD21      LEU 136   7.033  19.705  -1.439
 1009   HD22  LEU 136          HD22      LEU 136   8.733  20.195  -1.503
 1010   HD23  LEU 136          HD23      LEU 136   7.461  21.429  -1.359
 1011    H    ALA 137           H        ALA 137   5.002  18.766  -6.279
 1012    HA   ALA 137           HA       ALA 137   3.005  18.202  -7.328
 1013    HB1  ALA 137           HB1      ALA 137   2.338  18.536  -4.376
 1014    HB2  ALA 137           HB2      ALA 137   1.513  17.447  -5.512
 1015    HB3  ALA 137           HB3      ALA 137   3.219  17.175  -5.104
 1016    H    ARG 138           H        ARG 138   2.841  20.323  -8.509
 1017    HA   ARG 138           HA       ARG 138   1.655  21.952  -9.487
 1018    HB2  ARG 138           HB2      ARG 138  -0.860  20.878  -8.184
 1019    HB3  ARG 138           HB3      ARG 138  -0.708  21.793  -9.653
 1020    HG2  ARG 138           HG2      ARG 138  -1.218  19.686 -10.380
 1021    HG3  ARG 138           HG3      ARG 138   0.496  19.859 -10.724
 1022    HD2  ARG 138           HD2      ARG 138  -0.270  17.613  -9.878
 1023    HD3  ARG 138           HD3      ARG 138   1.081  18.308  -9.003
 1024    HE   ARG 138           HE       ARG 138  -0.450  18.920  -7.184
 1025   HH11  ARG 138          HH11      ARG 138  -1.880  16.635  -9.444
 1026   HH12  ARG 138          HH12      ARG 138  -3.014  16.064  -8.257
 1027   HH21  ARG 138          HH21      ARG 138  -1.918  18.140  -5.758
 1028   HH22  ARG 138          HH22      ARG 138  -3.035  16.901  -6.236
 1029    H    ASP 139           H        ASP 139   2.111  22.351  -6.252
 1030    HA   ASP 139           HA       ASP 139   0.082  23.963  -5.319
 1031    HB2  ASP 139           HB2      ASP 139   1.912  22.994  -4.000
 1032    HB3  ASP 139           HB3      ASP 139   3.037  24.177  -4.671
 1033    H    THR 140           H        THR 140   2.646  25.099  -7.435
 1034    HA   THR 140           HA       THR 140   1.492  27.866  -7.401
 1035    HB   THR 140           HB       THR 140   4.194  27.272  -8.570
 1036    HG1  THR 140           HG1      THR 140   3.711  27.610  -5.805
 1037   HG21  THR 140          HG21      THR 140   3.387  29.599  -8.677
 1038   HG22  THR 140          HG22      THR 140   3.094  29.597  -6.924
 1039   HG23  THR 140          HG23      THR 140   4.749  29.471  -7.561
 1040    H    ARG 141           H        ARG 141   0.973  25.236  -9.198
 1041    HA   ARG 141           HA       ARG 141   1.575  26.205 -11.877
 1042    HB2  ARG 141           HB2      ARG 141   1.521  23.796 -11.119
 1043    HB3  ARG 141           HB3      ARG 141  -0.237  23.865 -11.138
 1044    HG2  ARG 141           HG2      ARG 141   1.368  24.687 -13.580
 1045    HG3  ARG 141           HG3      ARG 141   1.174  22.979 -13.200
 1046    HD2  ARG 141           HD2      ARG 141  -1.229  23.119 -13.412
 1047    HD3  ARG 141           HD3      ARG 141  -1.159  24.880 -13.630
 1048    HE   ARG 141           HE       ARG 141   0.538  23.795 -15.591
 1049   HH11  ARG 141          HH11      ARG 141  -2.921  23.660 -15.000
 1050   HH12  ARG 141          HH12      ARG 141  -3.264  23.480 -16.695
 1051   HH21  ARG 141          HH21      ARG 141   0.061  23.598 -17.620
 1052   HH22  ARG 141          HH22      ARG 141  -1.598  23.458 -18.179
 1053    HA   PRO 142           HA       PRO 142  -3.068  27.102 -12.349
 1054    HB2  PRO 142           HB2      PRO 142  -4.688  27.580 -10.192
 1055    HB3  PRO 142           HB3      PRO 142  -4.413  25.958 -10.895
 1056    HG2  PRO 142           HG2      PRO 142  -3.054  27.202  -8.492
 1057    HG3  PRO 142           HG3      PRO 142  -3.755  25.560  -8.645
 1058    HD2  PRO 142           HD2      PRO 142  -1.108  26.050  -8.934
 1059    HD3  PRO 142           HD3      PRO 142  -1.929  24.797  -9.912
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1  10.994   2.209  -0.626
    2    H2   MET   1           H2       MET   1  11.149   2.075   1.006
    3    H3   MET   1           H3       MET   1  12.222   1.328   0.009
    4    HA   MET   1           HA       MET   1  10.705  -0.312   0.877
    5    HB2  MET   1           HB2      MET   1   8.557   1.460  -0.402
    6    HB3  MET   1           HB3      MET   1   8.299  -0.183   0.172
    7    HG2  MET   1           HG2      MET   1   7.495   1.190   1.870
    8    HG3  MET   1           HG3      MET   1   9.009   0.533   2.469
    9    HE1  MET   1           HE1      MET   1   7.364   2.945   3.786
   10    HE2  MET   1           HE2      MET   1   8.879   2.296   4.455
   11    HE3  MET   1           HE3      MET   1   8.690   4.047   4.215
   12    H    ALA   2           H        ALA   2   9.623  -2.033  -0.576
   13    HA   ALA   2           HA       ALA   2  11.142  -2.418  -2.956
   14    HB1  ALA   2           HB1      ALA   2   8.536  -3.724  -2.048
   15    HB2  ALA   2           HB2      ALA   2   9.637  -4.342  -3.297
   16    HB3  ALA   2           HB3      ALA   2  10.182  -4.243  -1.614
   17    H    TYR   3           H        TYR   3   7.752  -1.252  -2.556
   18    HA   TYR   3           HA       TYR   3   7.240  -1.004  -5.369
   19    HB2  TYR   3           HB2      TYR   3   5.263   0.277  -4.689
   20    HB3  TYR   3           HB3      TYR   3   5.424  -1.240  -3.830
   21    HD1  TYR   3           HD1      TYR   3   5.922   2.464  -3.497
   22    HD2  TYR   3           HD2      TYR   3   5.426  -1.300  -1.439
   23    HE1  TYR   3           HE1      TYR   3   5.651   3.674  -1.345
   24    HE2  TYR   3           HE2      TYR   3   5.129  -0.083   0.708
   25    HH   TYR   3           HH       TYR   3   5.000   1.965   1.736
   26    H    GLY   4           H        GLY   4   8.960   1.182  -3.198
   27    HA2  GLY   4           HA2      GLY   4   9.809   2.891  -5.306
   28    HA3  GLY   4           HA3      GLY   4   8.445   3.643  -4.502
   29    H    ARG   5           H        ARG   5  10.990   4.695  -4.644
   30    HA   ARG   5           HA       ARG   5  12.044   4.704  -1.822
   31    HB2  ARG   5           HB2      ARG   5  13.473   4.757  -4.516
   32    HB3  ARG   5           HB3      ARG   5  14.270   5.070  -2.978
   33    HG2  ARG   5           HG2      ARG   5  14.432   2.912  -2.446
   34    HG3  ARG   5           HG3      ARG   5  12.767   2.546  -2.869
   35    HD2  ARG   5           HD2      ARG   5  15.055   2.771  -4.856
   36    HD3  ARG   5           HD3      ARG   5  14.422   1.259  -4.210
   37    HE   ARG   5           HE       ARG   5  13.178   2.989  -6.259
   38   HH11  ARG   5          HH11      ARG   5  12.307   0.392  -4.028
   39   HH12  ARG   5          HH12      ARG   5  11.179  -0.262  -5.174
   40   HH21  ARG   5          HH21      ARG   5  11.682   2.305  -7.432
   41   HH22  ARG   5          HH22      ARG   5  10.761   0.835  -7.082
   42    H    GLU   6           H        GLU   6  10.681   6.485  -1.375
   43    HA   GLU   6           HA       GLU   6  10.187   8.732  -2.853
   44    HB2  GLU   6           HB2      GLU   6   9.129   8.076  -0.706
   45    HB3  GLU   6           HB3      GLU   6  10.556   8.651   0.164
   46    HG2  GLU   6           HG2      GLU   6  10.144  10.951  -0.718
   47    HG3  GLU   6           HG3      GLU   6   8.733  10.355  -1.595
   48    H    ASP   7           H        ASP   7  13.058   8.443  -0.688
   49    HA   ASP   7           HA       ASP   7  13.985  11.119  -1.138
   50    HB2  ASP   7           HB2      ASP   7  14.650   9.694   0.771
   51    HB3  ASP   7           HB3      ASP   7  15.510   8.614  -0.328
   52    H    VAL   8           H        VAL   8  14.684   8.083  -2.842
   53    HA   VAL   8           HA       VAL   8  16.654   9.229  -4.677
   54    HB   VAL   8           HB       VAL   8  14.973   6.708  -5.010
   55   HG11  VAL   8          HG11      VAL   8  16.731   6.062  -6.656
   56   HG12  VAL   8          HG12      VAL   8  15.842   7.488  -7.186
   57   HG13  VAL   8          HG13      VAL   8  17.466   7.671  -6.495
   58   HG21  VAL   8          HG21      VAL   8  17.033   5.512  -4.342
   59   HG22  VAL   8          HG22      VAL   8  17.839   7.064  -4.028
   60   HG23  VAL   8          HG23      VAL   8  16.457   6.552  -3.035
   61    H    ALA   9           H        ALA   9  13.133   8.495  -4.861
   62    HA   ALA   9           HA       ALA   9  12.716   9.454  -7.475
   63    HB1  ALA   9           HB1      ALA   9  10.749   9.651  -5.159
   64    HB2  ALA   9           HB2      ALA   9  10.386   9.505  -6.897
   65    HB3  ALA   9           HB3      ALA   9  11.127   8.147  -6.018
   66    H    ASN  10           H        ASN  10  12.373  11.291  -4.412
   67    HA   ASN  10           HA       ASN  10  11.908  13.849  -5.560
   68    HB2  ASN  10           HB2      ASN  10  11.664  13.264  -3.131
   69    HB3  ASN  10           HB3      ASN  10  13.418  13.177  -2.987
   70   HD21  ASN  10          HD22      ASN  10  10.652  15.353  -3.434
   71   HD22  ASN  10          HD21      ASN  10  11.572  16.811  -3.117
   72    H    THR  11           H        THR  11  15.091  12.445  -4.638
   73    HA   THR  11           HA       THR  11  16.696  14.593  -5.585
   74    HB   THR  11           HB       THR  11  17.403  11.626  -5.570
   75    HG1  THR  11           HG1      THR  11  16.817  12.154  -3.554
   76   HG21  THR  11          HG21      THR  11  19.716  12.465  -5.196
   77   HG22  THR  11          HG22      THR  11  19.092  12.951  -6.776
   78   HG23  THR  11          HG23      THR  11  19.145  14.131  -5.446
   79    H    ARG  12           H        ARG  12  15.631  11.650  -7.335
   80    HA   ARG  12           HA       ARG  12  16.840  12.425  -9.846
   81    HB2  ARG  12           HB2      ARG  12  14.818  10.313  -9.002
   82    HB3  ARG  12           HB3      ARG  12  15.245  10.552 -10.694
   83    HG2  ARG  12           HG2      ARG  12  17.192   9.789  -8.471
   84    HG3  ARG  12           HG3      ARG  12  16.501   8.727  -9.706
   85    HD2  ARG  12           HD2      ARG  12  17.467  10.496 -11.387
   86    HD3  ARG  12           HD3      ARG  12  18.486  10.985 -10.033
   87    HE   ARG  12           HE       ARG  12  18.951   8.288 -10.081
   88   HH11  ARG  12          HH11      ARG  12  19.052  10.577 -12.770
   89   HH12  ARG  12          HH12      ARG  12  20.386   9.713 -13.493
   90   HH21  ARG  12          HH21      ARG  12  20.468   7.271 -11.083
   91   HH22  ARG  12          HH22      ARG  12  21.175   7.857 -12.590
   92    H    ALA  13           H        ALA  13  13.586  13.120  -8.532
   93    HA   ALA  13           HA       ALA  13  12.524  14.119 -11.007
   94    HB1  ALA  13           HB1      ALA  13  11.154  13.638  -9.004
   95    HB2  ALA  13           HB2      ALA  13  11.938  14.974  -8.138
   96    HB3  ALA  13           HB3      ALA  13  10.941  15.297  -9.574
   97    H    ARG  14           H        ARG  14  14.225  15.720  -8.291
   98    HA   ARG  14           HA       ARG  14  14.433  18.347  -9.445
   99    HB2  ARG  14           HB2      ARG  14  16.050  16.876  -7.321
  100    HB3  ARG  14           HB3      ARG  14  16.246  18.596  -7.678
  101    HG2  ARG  14           HG2      ARG  14  14.092  19.159  -6.873
  102    HG3  ARG  14           HG3      ARG  14  13.486  17.510  -7.025
  103    HD2  ARG  14           HD2      ARG  14  13.756  18.027  -4.697
  104    HD3  ARG  14           HD3      ARG  14  14.872  16.745  -5.187
  105    HE   ARG  14           HE       ARG  14  16.131  19.354  -5.285
  106   HH11  ARG  14          HH11      ARG  14  15.188  16.842  -3.011
  107   HH12  ARG  14          HH12      ARG  14  16.472  17.258  -1.904
  108   HH21  ARG  14          HH21      ARG  14  17.731  19.821  -3.803
  109   HH22  ARG  14          HH22      ARG  14  17.849  18.903  -2.334
  110    H    GLU  15           H        GLU  15  16.690  15.596  -9.534
  111    HA   GLU  15           HA       GLU  15  18.695  16.803 -11.187
  112    HB2  GLU  15           HB2      GLU  15  18.852  14.645  -9.854
  113    HB3  GLU  15           HB3      GLU  15  17.819  13.896 -11.073
  114    HG2  GLU  15           HG2      GLU  15  19.972  13.251 -11.631
  115    HG3  GLU  15           HG3      GLU  15  19.576  14.511 -12.796
  116    H    THR  16           H        THR  16  15.844  14.812 -12.152
  117    HA   THR  16           HA       THR  16  16.201  15.003 -14.958
  118    HB   THR  16           HB       THR  16  13.588  14.820 -13.407
  119    HG1  THR  16           HG1      THR  16  14.902  13.128 -12.929
  120   HG21  THR  16          HG21      THR  16  13.234  15.363 -15.844
  121   HG22  THR  16          HG22      THR  16  14.206  13.934 -16.255
  122   HG23  THR  16          HG23      THR  16  12.669  13.750 -15.393
  123    H    ALA  17           H        ALA  17  14.527  17.231 -12.732
  124    HA   ALA  17           HA       ALA  17  13.677  19.070 -14.741
  125    HB1  ALA  17           HB1      ALA  17  12.685  18.980 -12.515
  126    HB2  ALA  17           HB2      ALA  17  14.231  19.422 -11.763
  127    HB3  ALA  17           HB3      ALA  17  13.385  20.598 -12.780
  128    H    ALA  18           H        ALA  18  16.648  19.146 -12.685
  129    HA   ALA  18           HA       ALA  18  17.707  21.548 -13.810
  130    HB1  ALA  18           HB1      ALA  18  19.840  20.737 -12.857
  131    HB2  ALA  18           HB2      ALA  18  18.501  20.522 -11.712
  132    HB3  ALA  18           HB3      ALA  18  19.132  19.125 -12.613
  133    H    ARG  19           H        ARG  19  18.130  18.127 -14.772
  134    HA   ARG  19           HA       ARG  19  19.899  18.709 -17.018
  135    HB2  ARG  19           HB2      ARG  19  18.299  16.246 -16.212
  136    HB3  ARG  19           HB3      ARG  19  19.248  16.331 -17.705
  137    HG2  ARG  19           HG2      ARG  19  21.277  16.922 -16.416
  138    HG3  ARG  19           HG3      ARG  19  20.381  16.772 -14.903
  139    HD2  ARG  19           HD2      ARG  19  20.501  14.512 -14.901
  140    HD3  ARG  19           HD3      ARG  19  20.100  14.380 -16.601
  141    HE   ARG  19           HE       ARG  19  22.774  14.431 -15.433
  142   HH11  ARG  19          HH21      ARG  19  21.044  14.914 -18.496
  143   HH12  ARG  19          HH22      ARG  19  22.539  14.584 -19.387
  144   HH21  ARG  19          HH11      ARG  19  24.552  14.042 -16.817
  145   HH22  ARG  19          HH12      ARG  19  24.263  14.148 -18.557
  146    H    PHE  20           H        PHE  20  16.348  18.205 -16.851
  147    HA   PHE  20           HA       PHE  20  15.822  18.630 -19.610
  148    HB2  PHE  20           HB2      PHE  20  14.040  17.895 -18.163
  149    HB3  PHE  20           HB3      PHE  20  14.250  19.272 -17.099
  150    HD1  PHE  20           HD2      PHE  20  13.459  18.558 -20.740
  151    HD2  PHE  20           HD1      PHE  20  12.965  21.182 -17.353
  152    HE1  PHE  20           HE2      PHE  20  11.750  19.869 -21.980
  153    HE2  PHE  20           HE1      PHE  20  11.328  22.532 -18.631
  154    HZ   PHE  20           HZ       PHE  20  10.697  21.864 -20.947
  155    H    THR  21           H        THR  21  16.154  21.073 -16.960
  156    HA   THR  21           HA       THR  21  15.640  23.331 -18.617
  157    HB   THR  21           HB       THR  21  17.432  23.272 -16.158
  158    HG1  THR  21           HG1      THR  21  15.431  22.427 -15.666
  159   HG21  THR  21          HG21      THR  21  17.590  25.433 -17.280
  160   HG22  THR  21          HG22      THR  21  15.824  25.514 -17.486
  161   HG23  THR  21          HG23      THR  21  16.542  25.620 -15.872
  162    H    ALA  22           H        ALA  22  18.810  21.729 -17.893
  163    HA   ALA  22           HA       ALA  22  20.313  23.420 -19.653
  164    HB1  ALA  22           HB1      ALA  22  20.815  20.535 -18.783
  165    HB2  ALA  22           HB2      ALA  22  22.015  21.637 -19.489
  166    HB3  ALA  22           HB3      ALA  22  21.316  21.993 -17.897
  167    H    ALA  23           H        ALA  23  18.605  20.339 -20.306
  168    HA   ALA  23           HA       ALA  23  19.396  20.087 -23.036
  169    HB1  ALA  23           HB1      ALA  23  17.598  18.466 -23.182
  170    HB2  ALA  23           HB2      ALA  23  18.470  18.256 -21.657
  171    HB3  ALA  23           HB3      ALA  23  16.881  19.058 -21.672
  172    H    LEU  24           H        LEU  24  16.731  21.891 -21.543
  173    HA   LEU  24           HA       LEU  24  15.503  22.755 -24.002
  174    HB2  LEU  24           HB2      LEU  24  14.399  22.568 -21.778
  175    HB3  LEU  24           HB3      LEU  24  15.418  23.856 -21.170
  176    HG   LEU  24           HG       LEU  24  14.361  25.389 -22.938
  177   HD11  LEU  24          HD11      LEU  24  12.201  24.644 -23.875
  178   HD12  LEU  24          HD12      LEU  24  13.503  23.579 -24.429
  179   HD13  LEU  24          HD13      LEU  24  12.410  23.040 -23.142
  180   HD21  LEU  24          HD21      LEU  24  12.262  25.655 -21.653
  181   HD22  LEU  24          HD22      LEU  24  12.531  24.064 -20.898
  182   HD23  LEU  24          HD23      LEU  24  13.642  25.404 -20.568
  183    H    GLU  25           H        GLU  25  18.060  24.145 -21.896
  184    HA   GLU  25           HA       GLU  25  18.470  26.558 -23.405
  185    HB2  GLU  25           HB2      GLU  25  19.480  25.963 -21.126
  186    HB3  GLU  25           HB3      GLU  25  20.651  24.975 -21.993
  187    HG2  GLU  25           HG2      GLU  25  21.357  26.984 -23.296
  188    HG3  GLU  25           HG3      GLU  25  20.186  27.957 -22.404
  189    H    LEU  26           H        LEU  26  19.957  23.317 -23.695
  190    HA   LEU  26           HA       LEU  26  21.469  23.613 -26.061
  191    HB2  LEU  26           HB2      LEU  26  21.761  21.599 -24.951
  192    HB3  LEU  26           HB3      LEU  26  20.071  21.436 -24.591
  193    HG   LEU  26           HG       LEU  26  19.691  20.810 -27.065
  194   HD11  LEU  26          HD11      LEU  26  21.903  21.592 -27.890
  195   HD12  LEU  26          HD12      LEU  26  22.700  20.370 -26.874
  196   HD13  LEU  26          HD13      LEU  26  21.640  19.867 -28.208
  197   HD21  LEU  26          HD21      LEU  26  20.345  18.480 -26.625
  198   HD22  LEU  26          HD22      LEU  26  21.272  19.013 -25.202
  199   HD23  LEU  26          HD23      LEU  26  19.504  19.216 -25.256
  200    H    ALA  27           H        ALA  27  17.984  22.843 -25.758
  201    HA   ALA  27           HA       ALA  27  17.492  22.725 -28.546
  202    HB1  ALA  27           HB1      ALA  27  15.127  22.958 -27.913
  203    HB2  ALA  27           HB2      ALA  27  15.978  21.809 -26.851
  204    HB3  ALA  27           HB3      ALA  27  15.602  23.446 -26.274
  205    H    ILE  28           H        ILE  28  17.260  25.561 -26.337
  206    HA   ILE  28           HA       ILE  28  16.370  27.443 -28.331
  207    HB   ILE  28           HB       ILE  28  17.962  27.853 -25.769
  208   HG12  ILE  28          HG12      ILE  28  15.016  28.456 -26.252
  209   HG13  ILE  28          HG13      ILE  28  15.538  26.873 -25.701
  210   HG21  ILE  28          HG21      ILE  28  17.188  30.243 -25.923
  211   HG22  ILE  28          HG22      ILE  28  18.300  29.813 -27.213
  212   HG23  ILE  28          HG23      ILE  28  16.558  29.905 -27.549
  213   HD11  ILE  28          HD11      ILE  28  14.888  28.081 -23.798
  214   HD12  ILE  28          HD12      ILE  28  16.649  27.915 -23.734
  215   HD13  ILE  28          HD13      ILE  28  15.923  29.470 -24.208
  216    H    ASP  29           H        ASP  29  19.672  26.528 -27.239
  217    HA   ASP  29           HA       ASP  29  21.096  28.225 -29.022
  218    HB2  ASP  29           HB2      ASP  29  22.078  27.058 -27.083
  219    HB3  ASP  29           HB3      ASP  29  21.851  25.508 -27.887
  220    H    ARG  30           H        ARG  30  20.057  24.821 -29.487
  221    HA   ARG  30           HA       ARG  30  20.955  24.617 -32.223
  222    HB2  ARG  30           HB2      ARG  30  18.785  23.167 -30.648
  223    HB3  ARG  30           HB3      ARG  30  19.200  22.741 -32.311
  224    HG2  ARG  30           HG2      ARG  30  21.185  22.714 -30.002
  225    HG3  ARG  30           HG3      ARG  30  20.258  21.315 -30.542
  226    HD2  ARG  30           HD2      ARG  30  21.332  21.451 -32.765
  227    HD3  ARG  30           HD3      ARG  30  22.258  22.860 -32.239
  228    HE   ARG  30           HE       ARG  30  23.354  21.481 -30.538
  229   HH11  ARG  30          HH11      ARG  30  21.956  19.642 -33.196
  230   HH12  ARG  30          HH12      ARG  30  22.929  18.233 -32.809
  231   HH21  ARG  30          HH21      ARG  30  24.499  19.650 -30.134
  232   HH22  ARG  30          HH22      ARG  30  24.274  18.240 -31.150
  233    H    ALA  31           H        ALA  31  17.958  25.972 -30.912
  234    HA   ALA  31           HA       ALA  31  16.673  26.241 -33.504
  235    HB1  ALA  31           HB1      ALA  31  16.120  27.745 -30.906
  236    HB2  ALA  31           HB2      ALA  31  15.039  27.580 -32.309
  237    HB3  ALA  31           HB3      ALA  31  15.439  26.165 -31.331
  238    H    THR  32           H        THR  32  18.613  28.483 -31.469
  239    HA   THR  32           HA       THR  32  18.324  30.679 -33.327
  240    HB   THR  32           HB       THR  32  18.960  30.613 -30.751
  241    HG1  THR  32           HG1      THR  32  18.403  32.399 -31.715
  242   HG21  THR  32          HG21      THR  32  21.699  31.075 -32.006
  243   HG22  THR  32          HG22      THR  32  21.236  31.277 -30.305
  244   HG23  THR  32          HG23      THR  32  21.248  29.665 -31.023
  245    H    LEU  33           H        LEU  33  20.555  27.965 -33.199
  246    HA   LEU  33           HA       LEU  33  22.408  29.087 -35.136
  247    HB2  LEU  33           HB2      LEU  33  21.967  26.335 -33.921
  248    HB3  LEU  33           HB3      LEU  33  23.244  26.668 -35.094
  249    HG   LEU  33           HG       LEU  33  22.997  28.010 -32.366
  250   HD11  LEU  33          HD11      LEU  33  24.938  26.606 -31.777
  251   HD12  LEU  33          HD12      LEU  33  23.538  25.614 -32.207
  252   HD13  LEU  33          HD13      LEU  33  24.868  25.821 -33.372
  253   HD21  LEU  33          HD21      LEU  33  24.192  29.471 -33.928
  254   HD22  LEU  33          HD22      LEU  33  25.338  28.741 -32.804
  255   HD23  LEU  33          HD23      LEU  33  25.211  28.113 -34.462
  256    H    SER  34           H        SER  34  19.773  26.705 -35.174
  257    HA   SER  34           HA       SER  34  20.164  26.037 -37.975
  258    HB2  SER  34           HB2      SER  34  18.403  24.456 -37.637
  259    HB3  SER  34           HB3      SER  34  19.469  24.430 -36.212
  260    HG   SER  34           HG       SER  34  18.015  25.340 -35.027
  261    H    GLY  35           H        GLY  35  18.161  28.420 -36.374
  262    HA2  GLY  35           HA2      GLY  35  16.981  30.147 -37.355
  263    HA3  GLY  35           HA3      GLY  35  17.353  29.501 -38.956
  264    H    GLN  36           H        GLN  36  15.875  27.185 -36.881
  265    HA   GLN  36           HA       GLN  36  13.115  27.989 -37.453
  266    HB2  GLN  36           HB2      GLN  36  12.418  26.061 -38.572
  267    HB3  GLN  36           HB3      GLN  36  13.901  26.494 -39.386
  268    HG2  GLN  36           HG2      GLN  36  14.884  24.556 -38.900
  269    HG3  GLN  36           HG3      GLN  36  14.449  24.601 -37.203
  270   HE21  GLN  36          HE22      GLN  36  13.016  22.975 -36.522
  271   HE22  GLN  36          HE21      GLN  36  12.181  21.954 -37.701
  272    HA   PRO  37           HA       PRO  37  12.282  26.378 -33.454
  273    HB2  PRO  37           HB2      PRO  37  10.319  24.355 -34.534
  274    HB3  PRO  37           HB3      PRO  37  10.122  25.524 -33.187
  275    HG2  PRO  37           HG2      PRO  37   9.023  26.056 -35.599
  276    HG3  PRO  37           HG3      PRO  37   9.883  27.353 -34.701
  277    HD2  PRO  37           HD2      PRO  37  10.929  25.620 -36.950
  278    HD3  PRO  37           HD3      PRO  37  11.052  27.398 -36.749
  279    H    VAL  38           H        VAL  38  12.524  24.687 -31.951
  280    HA   VAL  38           HA       VAL  38  13.583  22.032 -32.814
  281    HB   VAL  38           HB       VAL  38  14.789  23.838 -30.684
  282   HG11  VAL  38          HG11      VAL  38  14.906  21.470 -29.900
  283   HG12  VAL  38          HG12      VAL  38  15.634  21.013 -31.461
  284   HG13  VAL  38          HG13      VAL  38  16.488  22.085 -30.363
  285   HG21  VAL  38          HG21      VAL  38  16.830  23.567 -32.137
  286   HG22  VAL  38          HG22      VAL  38  15.829  22.701 -33.324
  287   HG23  VAL  38          HG23      VAL  38  15.515  24.397 -32.972
  288    H    GLY  39           H        GLY  39  13.105  20.320 -31.072
  289    HA2  GLY  39           HA2      GLY  39  11.074  21.161 -29.093
  290    HA3  GLY  39           HA3      GLY  39  10.449  20.295 -30.485
  291    H    ILE  40           H        ILE  40   9.894  19.360 -28.119
  292    HA   ILE  40           HA       ILE  40  11.652  16.991 -27.669
  293    HB   ILE  40           HB       ILE  40  10.365  18.630 -25.464
  294   HG12  ILE  40          HG12      ILE  40  13.298  18.455 -26.283
  295   HG13  ILE  40          HG13      ILE  40  12.262  19.849 -26.553
  296   HG21  ILE  40          HG21      ILE  40  11.682  17.130 -23.980
  297   HG22  ILE  40          HG22      ILE  40  10.566  16.201 -24.962
  298   HG23  ILE  40          HG23      ILE  40  12.283  16.248 -25.393
  299   HD11  ILE  40          HD11      ILE  40  11.981  20.184 -24.158
  300   HD12  ILE  40          HD12      ILE  40  13.114  18.838 -23.832
  301   HD13  ILE  40          HD13      ILE  40  13.671  20.287 -24.679
  302    H    HIS  41           H        HIS  41  10.721  15.184 -27.622
  303    HA   HIS  41           HA       HIS  41   7.835  14.909 -28.222
  304    HB2  HIS  41           HB2      HIS  41   9.803  14.520 -29.860
  305    HB3  HIS  41           HB3      HIS  41  10.168  13.088 -28.925
  306    HD1  HIS  41           HD1      HIS  41   9.746  12.315 -31.632
  307    HD2  HIS  41           HD2      HIS  41   6.412  13.270 -29.264
  308    HE1  HIS  41           HE1      HIS  41   7.733  11.278 -32.788
  309    H    PHE  42           H        PHE  42   7.884  15.088 -25.694
  310    HA   PHE  42           HA       PHE  42   8.500  12.894 -24.008
  311    HB2  PHE  42           HB2      PHE  42   6.232  14.914 -23.936
  312    HB3  PHE  42           HB3      PHE  42   6.582  13.788 -22.637
  313    HD1  PHE  42           HD1      PHE  42   8.638  13.959 -21.289
  314    HD2  PHE  42           HD2      PHE  42   7.636  16.925 -24.255
  315    HE1  PHE  42           HE1      PHE  42  10.221  15.551 -20.229
  316    HE2  PHE  42           HE2      PHE  42   9.218  18.513 -23.191
  317    HZ   PHE  42           HZ       PHE  42  10.499  17.833 -21.169
  318    H    SER  43           H        SER  43   7.481  11.024 -23.443
  319    HA   SER  43           HA       SER  43   4.960  10.207 -24.770
  320    HB2  SER  43           HB2      SER  43   6.998   9.512 -26.093
  321    HB3  SER  43           HB3      SER  43   7.423   8.464 -24.720
  322    HG   SER  43           HG       SER  43   6.150   7.353 -26.261
  323    H    ASP  44           H        ASP  44   4.538   7.789 -23.886
  324    HA   ASP  44           HA       ASP  44   3.642   8.333 -21.244
  325    HB2  ASP  44           HB2      ASP  44   2.454   6.323 -21.358
  326    HB3  ASP  44           HB3      ASP  44   2.475   6.960 -22.993
  327    H    SER  45           H        SER  45   6.612   6.816 -22.169
  328    HA   SER  45           HA       SER  45   7.234   6.215 -19.308
  329    HB2  SER  45           HB2      SER  45   8.222   4.072 -19.954
  330    HB3  SER  45           HB3      SER  45   6.506   4.132 -20.381
  331    HG   SER  45           HG       SER  45   7.790   3.300 -22.089
  332    H    ALA  46           H        ALA  46   8.256   7.871 -22.026
  333    HA   ALA  46           HA       ALA  46  10.880   8.430 -20.961
  334    HB1  ALA  46           HB1      ALA  46  11.396   6.308 -22.149
  335    HB2  ALA  46           HB2      ALA  46  10.666   6.951 -23.636
  336    HB3  ALA  46           HB3      ALA  46  12.155   7.662 -22.984
  337    H    TRP  47           H        TRP  47  12.060   9.762 -22.937
  338    HA   TRP  47           HA       TRP  47  10.207  11.363 -24.539
  339    HB2  TRP  47           HB2      TRP  47  11.146  13.506 -23.689
  340    HB3  TRP  47           HB3      TRP  47  10.221  12.635 -22.481
  341    HD1  TRP  47           HD1      TRP  47  13.805  13.707 -23.257
  342    HE1  TRP  47           HE1      TRP  47  15.182  13.636 -21.090
  343    HE3  TRP  47           HE3      TRP  47  10.395  11.409 -20.200
  344    HZ2  TRP  47           HZ2      TRP  47  14.879  12.617 -18.407
  345    HZ3  TRP  47           HZ3      TRP  47  10.957  10.940 -17.829
  346    HH2  TRP  47           HH2      TRP  47  13.180  11.566 -16.912
  347    H    ARG  48           H        ARG  48  11.440  12.766 -26.039
  348    HA   ARG  48           HA       ARG  48  14.267  12.100 -26.568
  349    HB2  ARG  48           HB2      ARG  48  12.835  10.342 -27.645
  350    HB3  ARG  48           HB3      ARG  48  12.053  11.604 -28.604
  351    HG2  ARG  48           HG2      ARG  48  14.153  12.073 -29.774
  352    HG3  ARG  48           HG3      ARG  48  15.047  11.038 -28.648
  353    HD2  ARG  48           HD2      ARG  48  14.780   9.806 -30.662
  354    HD3  ARG  48           HD3      ARG  48  13.738   9.058 -29.465
  355    HE   ARG  48           HE       ARG  48  12.956  10.543 -31.902
  356   HH11  ARG  48          HH11      ARG  48  11.618   8.997 -28.993
  357   HH12  ARG  48          HH12      ARG  48  10.036   8.920 -29.781
  358   HH21  ARG  48          HH21      ARG  48  10.888  10.127 -32.737
  359   HH22  ARG  48          HH22      ARG  48   9.681   9.484 -31.613
  360    H    ILE  49           H        ILE  49  15.254  13.655 -28.007
  361    HA   ILE  49           HA       ILE  49  13.678  16.184 -28.366
  362    HB   ILE  49           HB       ILE  49  16.683  15.908 -28.002
  363   HG12  ILE  49          HG12      ILE  49  14.442  16.498 -26.035
  364   HG13  ILE  49          HG13      ILE  49  15.689  15.267 -25.919
  365   HG21  ILE  49          HG21      ILE  49  14.868  18.369 -27.993
  366   HG22  ILE  49          HG22      ILE  49  16.623  18.365 -27.751
  367   HG23  ILE  49          HG23      ILE  49  15.964  17.915 -29.307
  368   HD11  ILE  49          HD11      ILE  49  16.030  18.258 -25.518
  369   HD12  ILE  49          HD12      ILE  49  16.171  16.963 -24.324
  370   HD13  ILE  49          HD13      ILE  49  17.391  17.103 -25.611
  371    H    MET  50           H        MET  50  13.735  17.264 -30.266
  372    HA   MET  50           HA       MET  50  15.004  15.958 -32.622
  373    HB2  MET  50           HB2      MET  50  12.074  16.625 -32.185
  374    HB3  MET  50           HB3      MET  50  12.774  16.459 -33.806
  375    HG2  MET  50           HG2      MET  50  13.467  14.203 -33.397
  376    HG3  MET  50           HG3      MET  50  13.085  14.310 -31.687
  377    HE1  MET  50           HE1      MET  50   9.899  14.001 -35.043
  378    HE2  MET  50           HE2      MET  50  10.788  15.511 -34.759
  379    HE3  MET  50           HE3      MET  50  11.655  14.058 -35.319
  380    H    VAL  51           H        VAL  51  15.366  17.223 -34.365
  381    HA   VAL  51           HA       VAL  51  15.444  20.190 -34.141
  382    HB   VAL  51           HB       VAL  51  17.315  19.081 -32.833
  383   HG11  VAL  51          HG11      VAL  51  19.195  18.059 -33.998
  384   HG12  VAL  51          HG12      VAL  51  17.716  17.129 -34.289
  385   HG13  VAL  51          HG13      VAL  51  18.361  18.200 -35.547
  386   HG21  VAL  51          HG21      VAL  51  17.598  21.357 -33.666
  387   HG22  VAL  51          HG22      VAL  51  19.110  20.456 -33.546
  388   HG23  VAL  51          HG23      VAL  51  18.381  20.709 -35.139
  389    HA   PRO  52           HA       PRO  52  15.301  19.536 -38.664
  390    HB2  PRO  52           HB2      PRO  52  16.762  21.655 -39.662
  391    HB3  PRO  52           HB3      PRO  52  15.099  21.811 -39.021
  392    HG2  PRO  52           HG2      PRO  52  17.715  22.233 -37.519
  393    HG3  PRO  52           HG3      PRO  52  16.351  23.377 -37.642
  394    HD2  PRO  52           HD2      PRO  52  16.528  21.817 -35.502
  395    HD3  PRO  52           HD3      PRO  52  14.949  21.946 -36.297
  396    H    GLY  53           H        GLY  53  16.600  18.625 -40.299
  397    HA2  GLY  53           HA2      GLY  53  19.553  18.404 -39.862
  398    HA3  GLY  53           HA3      GLY  53  18.574  16.944 -39.946
  399    H    LYS  54           H        LYS  54  17.305  19.182 -42.139
  400    HA   LYS  54           HA       LYS  54  19.119  18.421 -44.386
  401    HB2  LYS  54           HB2      LYS  54  16.134  17.862 -44.227
  402    HB3  LYS  54           HB3      LYS  54  16.965  17.969 -45.761
  403    HG2  LYS  54           HG2      LYS  54  17.535  15.952 -43.554
  404    HG3  LYS  54           HG3      LYS  54  16.679  15.656 -45.059
  405    HD2  LYS  54           HD2      LYS  54  19.644  16.269 -44.742
  406    HD3  LYS  54           HD3      LYS  54  18.897  14.755 -45.244
  407    HE2  LYS  54           HE2      LYS  54  17.995  15.909 -47.284
  408    HE3  LYS  54           HE3      LYS  54  18.833  17.387 -46.793
  409    HZ1  LYS  54           HZ1      LYS  54  20.942  16.162 -46.963
  410    HZ2  LYS  54           HZ2      LYS  54  20.166  14.802 -47.422
  411    HZ3  LYS  54           HZ3      LYS  54  20.153  16.113 -48.385
  412    H    THR  55           H        THR  55  16.859  20.800 -43.123
  413    HA   THR  55           HA       THR  55  18.065  22.731 -44.918
  414    HB   THR  55           HB       THR  55  16.414  22.062 -46.464
  415    HG1  THR  55           HG1      THR  55  15.443  23.977 -46.761
  416   HG21  THR  55          HG21      THR  55  14.737  20.953 -45.028
  417   HG22  THR  55          HG22      THR  55  14.259  22.531 -44.363
  418   HG23  THR  55          HG23      THR  55  13.999  22.169 -46.078
  419    HA   PRO  56           HA       PRO  56  16.673  25.349 -41.422
  420    HB2  PRO  56           HB2      PRO  56  18.152  27.540 -41.935
  421    HB3  PRO  56           HB3      PRO  56  18.960  26.004 -41.491
  422    HG2  PRO  56           HG2      PRO  56  18.534  27.132 -44.280
  423    HG3  PRO  56           HG3      PRO  56  20.055  26.524 -43.552
  424    HD2  PRO  56           HD2      PRO  56  18.395  24.971 -45.125
  425    HD3  PRO  56           HD3      PRO  56  19.403  24.296 -43.813
  426    H    SER  57           H        SER  57  16.106  25.719 -44.812
  427    HA   SER  57           HA       SER  57  14.979  28.412 -44.758
  428    HB2  SER  57           HB2      SER  57  16.321  27.363 -46.630
  429    HB3  SER  57           HB3      SER  57  14.913  26.345 -46.986
  430    HG   SER  57           HG       SER  57  14.993  28.277 -48.248
  431    H    ALA  58           H        ALA  58  13.687  25.191 -44.409
  432    HA   ALA  58           HA       ALA  58  10.922  26.233 -44.204
  433    HB1  ALA  58           HB1      ALA  58  11.190  25.486 -46.554
  434    HB2  ALA  58           HB2      ALA  58  11.758  23.899 -45.990
  435    HB3  ALA  58           HB3      ALA  58  10.088  24.416 -45.669
  436    H    TRP  59           H        TRP  59   9.464  24.688 -43.198
  437    HA   TRP  59           HA       TRP  59  10.311  23.588 -40.768
  438    HB2  TRP  59           HB2      TRP  59   8.038  24.226 -41.243
  439    HB3  TRP  59           HB3      TRP  59   7.910  23.041 -42.532
  440    HD1  TRP  59           HD1      TRP  59   7.411  20.560 -41.913
  441    HE1  TRP  59           HE1      TRP  59   6.312  19.484 -39.860
  442    HE3  TRP  59           HE3      TRP  59   8.169  24.327 -38.515
  443    HZ2  TRP  59           HZ2      TRP  59   5.679  20.230 -37.147
  444    HZ3  TRP  59           HZ3      TRP  59   7.326  24.097 -36.188
  445    HH2  TRP  59           HH2      TRP  59   6.065  22.071 -35.499
  446    H    ARG  60           H        ARG  60  11.509  21.878 -40.275
  447    HA   ARG  60           HA       ARG  60  11.073  19.261 -41.564
  448    HB2  ARG  60           HB2      ARG  60  13.015  20.803 -42.661
  449    HB3  ARG  60           HB3      ARG  60  13.935  20.265 -41.280
  450    HG2  ARG  60           HG2      ARG  60  14.328  18.954 -43.334
  451    HG3  ARG  60           HG3      ARG  60  13.769  17.930 -42.017
  452    HD2  ARG  60           HD2      ARG  60  12.780  17.463 -44.335
  453    HD3  ARG  60           HD3      ARG  60  11.629  17.629 -43.018
  454    HE   ARG  60           HE       ARG  60  10.993  19.807 -43.775
  455   HH11  ARG  60          HH11      ARG  60  13.083  18.302 -46.162
  456   HH12  ARG  60          HH12      ARG  60  12.625  19.462 -47.373
  457   HH21  ARG  60          HH21      ARG  60  10.469  21.161 -45.279
  458   HH22  ARG  60          HH22      ARG  60  11.134  21.050 -46.892
  459    H    TRP  61           H        TRP  61  12.108  17.480 -40.422
  460    HA   TRP  61           HA       TRP  61  12.997  17.995 -37.649
  461    HB2  TRP  61           HB2      TRP  61  10.537  16.385 -38.440
  462    HB3  TRP  61           HB3      TRP  61  11.358  16.186 -36.899
  463    HD1  TRP  61           HD1      TRP  61   8.515  17.950 -38.208
  464    HE1  TRP  61           HE1      TRP  61   7.895  20.025 -36.832
  465    HE3  TRP  61           HE3      TRP  61  12.781  18.373 -35.410
  466    HZ2  TRP  61           HZ2      TRP  61   9.117  21.700 -34.820
  467    HZ3  TRP  61           HZ3      TRP  61  13.047  20.244 -33.825
  468    HH2  TRP  61           HH2      TRP  61  11.252  21.917 -33.529
  469    H    VAL  62           H        VAL  62  14.217  16.529 -36.736
  470    HA   VAL  62           HA       VAL  62  14.842  13.860 -37.768
  471    HB   VAL  62           HB       VAL  62  16.352  16.277 -38.436
  472   HG11  VAL  62          HG11      VAL  62  17.711  15.919 -36.439
  473   HG12  VAL  62          HG12      VAL  62  18.081  14.258 -36.981
  474   HG13  VAL  62          HG13      VAL  62  18.612  15.658 -37.926
  475   HG21  VAL  62          HG21      VAL  62  15.813  14.488 -39.996
  476   HG22  VAL  62          HG22      VAL  62  17.553  14.777 -39.922
  477   HG23  VAL  62          HG23      VAL  62  16.862  13.364 -39.100
  478    HA   PRO  63           HA       PRO  63  15.501  13.539 -33.292
  479    HB2  PRO  63           HB2      PRO  63  17.215  11.426 -33.054
  480    HB3  PRO  63           HB3      PRO  63  15.499  11.241 -33.523
  481    HG2  PRO  63           HG2      PRO  63  17.928  11.334 -35.338
  482    HG3  PRO  63           HG3      PRO  63  16.567  10.169 -35.365
  483    HD2  PRO  63           HD2      PRO  63  16.675  12.332 -37.029
  484    HD3  PRO  63           HD3      PRO  63  15.124  11.736 -36.369
  485    H    LEU  64           H        LEU  64  16.854  14.604 -31.845
  486    HA   LEU  64           HA       LEU  64  19.279  15.887 -32.864
  487    HB2  LEU  64           HB2      LEU  64  17.516  16.784 -31.170
  488    HB3  LEU  64           HB3      LEU  64  18.382  15.828 -29.970
  489    HG   LEU  64           HG       LEU  64  19.521  18.096 -31.686
  490   HD11  LEU  64          HD11      LEU  64  18.827  17.929 -28.736
  491   HD12  LEU  64          HD12      LEU  64  19.628  19.302 -29.532
  492   HD13  LEU  64          HD13      LEU  64  17.978  18.882 -29.989
  493   HD21  LEU  64          HD21      LEU  64  21.434  17.912 -29.934
  494   HD22  LEU  64          HD22      LEU  64  20.811  16.259 -29.677
  495   HD23  LEU  64          HD23      LEU  64  21.397  16.773 -31.277
  496    H    GLN  65           H        GLN  65  18.373  13.165 -31.009
  497    HA   GLN  65           HA       GLN  65  20.660  12.003 -30.042
  498    HB2  GLN  65           HB2      GLN  65  18.100  11.277 -30.152
  499    HB3  GLN  65           HB3      GLN  65  18.642  10.301 -31.530
  500    HG2  GLN  65           HG2      GLN  65  20.313   9.222 -30.103
  501    HG3  GLN  65           HG3      GLN  65  19.880  10.293 -28.753
  502   HE21  GLN  65          HE22      GLN  65  19.865   7.899 -27.919
  503   HE22  GLN  65          HE21      GLN  65  18.278   7.120 -27.960
  504    H    GLU  66           H        GLU  66  20.168  12.710 -33.367
  505    HA   GLU  66           HA       GLU  66  21.859  10.907 -34.743
  506    HB2  GLU  66           HB2      GLU  66  20.460  12.509 -35.884
  507    HB3  GLU  66           HB3      GLU  66  21.164  13.852 -34.988
  508    HG2  GLU  66           HG2      GLU  66  21.888  13.891 -37.276
  509    HG3  GLU  66           HG3      GLU  66  23.233  13.717 -36.168
  510    H    ASP  67           H        ASP  67  22.668  13.629 -32.607
  511    HA   ASP  67           HA       ASP  67  25.554  12.883 -32.827
  512    HB2  ASP  67           HB2      ASP  67  26.255  15.121 -33.099
  513    HB3  ASP  67           HB3      ASP  67  25.010  14.825 -34.301
  514    H    ALA  68           H        ALA  68  23.028  13.696 -30.641
  515    HA   ALA  68           HA       ALA  68  24.991  13.392 -28.397
  516    HB1  ALA  68           HB1      ALA  68  22.509  15.130 -28.513
  517    HB2  ALA  68           HB2      ALA  68  23.376  14.721 -27.014
  518    HB3  ALA  68           HB3      ALA  68  24.185  15.638 -28.300
  519    H    ALA  69           H        ALA  69  24.532  11.243 -29.422
  520    HA   ALA  69           HA       ALA  69  22.268   9.837 -29.550
  521    HB1  ALA  69           HB1      ALA  69  25.022   8.770 -28.869
  522    HB2  ALA  69           HB2      ALA  69  23.699   7.849 -29.616
  523    HB3  ALA  69           HB3      ALA  69  24.425   9.208 -30.490
  524    H    ASP  70           H        ASP  70  23.777  10.396 -26.449
  525    HA   ASP  70           HA       ASP  70  22.073   8.277 -25.190
  526    HB2  ASP  70           HB2      ASP  70  24.560   7.924 -25.282
  527    HB3  ASP  70           HB3      ASP  70  24.758   9.362 -24.281
  528    H    GLU  71           H        GLU  71  22.260  11.613 -25.407
  529    HA   GLU  71           HA       GLU  71  20.863  11.952 -22.774
  530    HB2  GLU  71           HB2      GLU  71  22.957  13.813 -23.957
  531    HB3  GLU  71           HB3      GLU  71  21.933  14.178 -22.562
  532    HG2  GLU  71           HG2      GLU  71  22.852  12.136 -21.410
  533    HG3  GLU  71           HG3      GLU  71  24.006  11.956 -22.736
  534    H    SER  72           H        SER  72  20.591  12.328 -26.131
  535    HA   SER  72           HA       SER  72  18.676  14.548 -26.120
  536    HB2  SER  72           HB2      SER  72  19.120  12.373 -28.189
  537    HB3  SER  72           HB3      SER  72  18.219  13.883 -28.422
  538    HG   SER  72           HG       SER  72  20.984  13.555 -27.927
  539    H    GLN  73           H        GLN  73  18.243  11.947 -24.400
  540    HA   GLN  73           HA       GLN  73  15.403  11.688 -24.853
  541    HB2  GLN  73           HB2      GLN  73  15.278   9.482 -25.629
  542    HB3  GLN  73           HB3      GLN  73  16.593  10.134 -26.567
  543    HG2  GLN  73           HG2      GLN  73  16.694   8.184 -24.257
  544    HG3  GLN  73           HG3      GLN  73  17.198   7.931 -25.912
  545   HE21  GLN  73          HE22      GLN  73  18.351   8.375 -22.855
  546   HE22  GLN  73          HE21      GLN  73  19.937   9.064 -23.257
  547    H    ASN  74           H        ASN  74  14.597   9.754 -23.286
  548    HA   ASN  74           HA       ASN  74  15.170  10.458 -20.632
  549    HB2  ASN  74           HB2      ASN  74  13.185   9.202 -21.218
  550    HB3  ASN  74           HB3      ASN  74  14.164   7.806 -21.723
  551   HD21  ASN  74          HD22      ASN  74  13.283   9.814 -18.863
  552   HD22  ASN  74          HD21      ASN  74  13.653   8.561 -17.691
  553    H    ASP  75           H        ASP  75  16.652  10.102 -19.234
  554    HA   ASP  75           HA       ASP  75  18.421   7.843 -18.976
  555    HB2  ASP  75           HB2      ASP  75  19.566   8.900 -20.895
  556    HB3  ASP  75           HB3      ASP  75  19.589  10.450 -20.062
  557    H    TRP  76           H        TRP  76  17.556  11.160 -18.230
  558    HA   TRP  76           HA       TRP  76  19.218  11.685 -16.065
  559    HB2  TRP  76           HB2      TRP  76  16.498  12.914 -16.555
  560    HB3  TRP  76           HB3      TRP  76  17.913  13.678 -15.854
  561    HD1  TRP  76           HD1      TRP  76  19.844  12.529 -18.373
  562    HE1  TRP  76           HE1      TRP  76  19.692  13.655 -20.668
  563    HE3  TRP  76           HE3      TRP  76  15.414  15.070 -17.788
  564    HZ2  TRP  76           HZ2      TRP  76  17.891  15.350 -22.096
  565    HZ3  TRP  76           HZ3      TRP  76  14.461  16.333 -19.693
  566    HH2  TRP  76           HH2      TRP  76  15.690  16.505 -21.839
  567    H    ASP  77           H        ASP  77  16.731   9.450 -15.927
  568    HA   ASP  77           HA       ASP  77  16.489   9.669 -12.981
  569    HB2  ASP  77           HB2      ASP  77  14.254   9.725 -12.946
  570    HB3  ASP  77           HB3      ASP  77  14.449  10.529 -14.491
  571    H    GLU  78           H        GLU  78  15.691   7.691 -11.930
  572    HA   GLU  78           HA       GLU  78  15.876   5.152 -13.436
  573    HB2  GLU  78           HB2      GLU  78  17.409   4.128 -11.897
  574    HB3  GLU  78           HB3      GLU  78  18.144   5.630 -12.448
  575    HG2  GLU  78           HG2      GLU  78  17.277   6.725 -10.313
  576    HG3  GLU  78           HG3      GLU  78  16.807   5.131  -9.744
  577    H    GLU  79           H        GLU  79  13.781   6.895 -11.978
  578    HA   GLU  79           HA       GLU  79  12.462   4.858 -10.306
  579    HB2  GLU  79           HB2      GLU  79  14.270   5.773  -8.857
  580    HB3  GLU  79           HB3      GLU  79  13.677   7.394  -9.125
  581    HG2  GLU  79           HG2      GLU  79  13.167   6.629  -6.916
  582    HG3  GLU  79           HG3      GLU  79  11.694   6.950  -7.796
  583    H    LEU  80           H        LEU  80  12.080   7.320 -12.523
  584    HA   LEU  80           HA       LEU  80   9.555   8.376 -11.308
  585    HB2  LEU  80           HB2      LEU  80  11.711   9.699 -12.989
  586    HB3  LEU  80           HB3      LEU  80  10.120  10.386 -12.844
  587    HG   LEU  80           HG       LEU  80  11.735  11.492 -11.423
  588   HD11  LEU  80          HD11      LEU  80   9.636  10.015  -9.773
  589   HD12  LEU  80          HD12      LEU  80  10.412  11.545  -9.360
  590   HD13  LEU  80          HD13      LEU  80   9.330  11.458 -10.764
  591   HD21  LEU  80          HD21      LEU  80  12.716  10.599  -9.529
  592   HD22  LEU  80          HD22      LEU  80  11.828   9.078  -9.619
  593   HD23  LEU  80          HD23      LEU  80  13.091   9.447 -10.825
  594    H    SER  81           H        SER  81   7.968   9.141 -12.703
  595    HA   SER  81           HA       SER  81   7.938   8.286 -15.549
  596    HB2  SER  81           HB2      SER  81   6.624   6.644 -14.166
  597    HB3  SER  81           HB3      SER  81   5.576   7.985 -13.650
  598    HG   SER  81           HG       SER  81   4.771   6.853 -15.503
  599    H    ILE  82           H        ILE  82   6.827   9.762 -16.878
  600    HA   ILE  82           HA       ILE  82   6.414  12.456 -15.658
  601    HB   ILE  82           HB       ILE  82   8.058  11.462 -17.947
  602   HG12  ILE  82          HG12      ILE  82   9.530  13.314 -17.331
  603   HG13  ILE  82          HG13      ILE  82   8.340  13.932 -16.190
  604   HG21  ILE  82          HG21      ILE  82   6.530  12.799 -19.250
  605   HG22  ILE  82          HG22      ILE  82   6.677  14.161 -18.104
  606   HG23  ILE  82          HG23      ILE  82   8.061  13.654 -19.083
  607   HD11  ILE  82          HD11      ILE  82   9.655  11.197 -15.897
  608   HD12  ILE  82          HD12      ILE  82  10.318  12.689 -15.203
  609   HD13  ILE  82          HD13      ILE  82   8.738  12.110 -14.672
  610    H    HIS  83           H        HIS  83   4.787  13.742 -16.360
  611    HA   HIS  83           HA       HIS  83   2.815  12.714 -18.355
  612    HB2  HIS  83           HB2      HIS  83   2.139  13.696 -15.549
  613    HB3  HIS  83           HB3      HIS  83   0.986  13.212 -16.787
  614    HD1  HIS  83           HD1      HIS  83   0.750  10.519 -17.204
  615    HD2  HIS  83           HD2      HIS  83   3.393  11.751 -14.169
  616    HE1  HIS  83           HE1      HIS  83   1.300   8.436 -15.844
  617    H    LEU  84           H        LEU  84   1.916  14.346 -19.616
  618    HA   LEU  84           HA       LEU  84   2.790  17.140 -19.001
  619    HB2  LEU  84           HB2      LEU  84   2.831  15.556 -21.550
  620    HB3  LEU  84           HB3      LEU  84   2.396  17.251 -21.641
  621    HG   LEU  84           HG       LEU  84   4.478  17.843 -20.356
  622   HD11  LEU  84          HD11      LEU  84   5.197  14.944 -20.944
  623   HD12  LEU  84          HD12      LEU  84   6.359  16.207 -20.489
  624   HD13  LEU  84          HD13      LEU  84   5.103  15.726 -19.349
  625   HD21  LEU  84          HD21      LEU  84   4.747  16.462 -23.049
  626   HD22  LEU  84          HD22      LEU  84   4.274  18.149 -22.750
  627   HD23  LEU  84          HD23      LEU  84   5.908  17.622 -22.351
  628    H    GLN  85           H        GLN  85   1.603  18.845 -19.604
  629    HA   GLN  85           HA       GLN  85  -1.339  18.568 -19.965
  630    HB2  GLN  85           HB2      GLN  85   0.121  20.054 -17.719
  631    HB3  GLN  85           HB3      GLN  85  -1.582  20.205 -18.091
  632    HG2  GLN  85           HG2      GLN  85  -1.439  18.844 -16.191
  633    HG3  GLN  85           HG3      GLN  85  -1.933  17.808 -17.525
  634   HE21  GLN  85          HE22      GLN  85   1.557  18.711 -16.962
  635   HE22  GLN  85          HE21      GLN  85   1.970  17.067 -16.511
  636    HA   PRO  86           HA       PRO  86  -3.044  19.975 -20.428
  637    HB2  PRO  86           HB2      PRO  86  -4.333  21.281 -22.410
  638    HB3  PRO  86           HB3      PRO  86  -3.809  22.128 -20.925
  639    HG2  PRO  86           HG2      PRO  86  -2.370  22.015 -23.600
  640    HG3  PRO  86           HG3      PRO  86  -2.781  23.468 -22.631
  641    HD2  PRO  86           HD2      PRO  86  -0.326  22.240 -22.492
  642    HD3  PRO  86           HD3      PRO  86  -1.077  23.029 -21.079
  643    H    PHE  87           H        PHE  87  -0.708  19.530 -22.895
  644    HA   PHE  87           HA       PHE  87  -2.471  17.839 -24.585
  645    HB2  PHE  87           HB2      PHE  87  -0.673  18.167 -26.294
  646    HB3  PHE  87           HB3      PHE  87  -1.586  19.584 -25.830
  647    HD1  PHE  87           HD1      PHE  87   1.681  17.837 -25.121
  648    HD2  PHE  87           HD2      PHE  87  -0.480  21.570 -25.234
  649    HE1  PHE  87           HE1      PHE  87   3.799  19.088 -24.776
  650    HE2  PHE  87           HE2      PHE  87   1.640  22.807 -24.873
  651    HZ   PHE  87           HZ       PHE  87   3.786  21.564 -24.670
  652    H    LYS  88           H        LYS  88  -1.676  15.964 -25.542
  653    HA   LYS  88           HA       LYS  88  -1.000  14.117 -23.553
  654    HB2  LYS  88           HB2      LYS  88  -0.984  12.450 -25.543
  655    HB3  LYS  88           HB3      LYS  88  -2.446  13.254 -25.027
  656    HG2  LYS  88           HG2      LYS  88  -2.357  13.100 -27.419
  657    HG3  LYS  88           HG3      LYS  88  -2.403  14.777 -26.901
  658    HD2  LYS  88           HD2      LYS  88  -0.006  15.032 -27.422
  659    HD3  LYS  88           HD3      LYS  88   0.097  13.308 -27.863
  660    HE2  LYS  88           HE2      LYS  88  -1.614  13.739 -29.657
  661    HE3  LYS  88           HE3      LYS  88  -1.644  15.441 -29.184
  662    HZ1  LYS  88           HZ1      LYS  88   0.815  15.465 -29.711
  663    HZ2  LYS  88           HZ2      LYS  88   0.650  13.979 -30.379
  664    HZ3  LYS  88           HZ3      LYS  88  -0.158  15.242 -31.015
  665    HA   PRO  89           HA       PRO  89   3.421  13.370 -24.259
  666    HB2  PRO  89           HB2      PRO  89   3.870  11.589 -22.270
  667    HB3  PRO  89           HB3      PRO  89   3.570  13.315 -21.930
  668    HG2  PRO  89           HG2      PRO  89   1.616  11.008 -21.731
  669    HG3  PRO  89           HG3      PRO  89   1.860  12.362 -20.594
  670    HD2  PRO  89           HD2      PRO  89  -0.116  12.278 -22.566
  671    HD3  PRO  89           HD3      PRO  89   0.544  13.789 -21.872
  672    H    ASP  90           H        ASP  90   3.367  12.338 -26.282
  673    HA   ASP  90           HA       ASP  90   3.342   9.419 -26.267
  674    HB2  ASP  90           HB2      ASP  90   0.941  10.036 -26.703
  675    HB3  ASP  90           HB3      ASP  90   1.467  10.932 -28.130
  676    H    ASP  91           H        ASP  91   4.299   8.501 -28.131
  677    HA   ASP  91           HA       ASP  91   6.311  10.121 -29.511
  678    HB2  ASP  91           HB2      ASP  91   6.724   7.847 -28.577
  679    HB3  ASP  91           HB3      ASP  91   5.598   7.174 -29.754
  680    H    SER  92           H        SER  92   3.847  11.142 -30.200
  681    HA   SER  92           HA       SER  92   2.583   9.851 -32.452
  682    HB2  SER  92           HB2      SER  92   0.958  11.576 -32.349
  683    HB3  SER  92           HB3      SER  92   1.372  11.121 -30.695
  684    HG   SER  92           HG       SER  92   2.297  13.374 -32.150
  685    H    ASN  93           H        ASN  93   5.201  10.292 -33.200
  686    HA   ASN  93           HA       ASN  93   6.559  11.024 -34.847
  687    HB2  ASN  93           HB2      ASN  93   4.559   9.994 -36.069
  688    HB3  ASN  93           HB3      ASN  93   4.018  11.648 -36.377
  689   HD21  ASN  93          HD22      ASN  93   4.293  11.683 -38.623
  690   HD22  ASN  93          HD21      ASN  93   5.853  11.452 -39.387
  691    H    GLN  94           H        GLN  94   5.588  13.182 -32.928
  692    HA   GLN  94           HA       GLN  94   6.526  15.569 -34.378
  693    HB2  GLN  94           HB2      GLN  94   4.223  15.522 -35.064
  694    HB3  GLN  94           HB3      GLN  94   3.670  15.110 -33.446
  695    HG2  GLN  94           HG2      GLN  94   3.129  17.407 -34.022
  696    HG3  GLN  94           HG3      GLN  94   4.172  17.321 -32.613
  697   HE21  GLN  94          HE22      GLN  94   5.627  19.026 -32.631
  698   HE22  GLN  94          HE21      GLN  94   6.359  19.665 -34.101
  699    HA   PRO  95           HA       PRO  95   7.816  16.108 -30.036
  700    HB2  PRO  95           HB2      PRO  95   8.832  18.681 -30.289
  701    HB3  PRO  95           HB3      PRO  95   9.737  17.163 -30.591
  702    HG2  PRO  95           HG2      PRO  95   8.387  18.981 -32.586
  703    HG3  PRO  95           HG3      PRO  95   9.976  18.166 -32.719
  704    HD2  PRO  95           HD2      PRO  95   7.768  17.189 -33.943
  705    HD3  PRO  95           HD3      PRO  95   8.969  16.086 -33.215
  706    H    GLN  96           H        GLN  96   6.603  16.785 -28.371
  707    HA   GLN  96           HA       GLN  96   4.048  18.109 -28.956
  708    HB2  GLN  96           HB2      GLN  96   5.088  17.215 -26.244
  709    HB3  GLN  96           HB3      GLN  96   3.421  17.479 -26.738
  710    HG2  GLN  96           HG2      GLN  96   5.233  15.199 -27.610
  711    HG3  GLN  96           HG3      GLN  96   3.904  15.108 -26.473
  712   HE21  GLN  96          HE22      GLN  96   4.023  13.349 -28.625
  713   HE22  GLN  96          HE21      GLN  96   2.877  13.802 -29.851
  714    H    VAL  97           H        VAL  97   7.024  18.808 -27.155
  715    HA   VAL  97           HA       VAL  97   6.120  21.574 -26.434
  716    HB   VAL  97           HB       VAL  97   8.466  19.846 -25.536
  717   HG11  VAL  97          HG11      VAL  97   7.682  22.611 -24.532
  718   HG12  VAL  97          HG12      VAL  97   8.935  21.566 -23.845
  719   HG13  VAL  97          HG13      VAL  97   9.144  22.223 -25.468
  720   HG21  VAL  97          HG21      VAL  97   6.299  19.121 -24.587
  721   HG22  VAL  97          HG22      VAL  97   7.330  19.835 -23.355
  722   HG23  VAL  97          HG23      VAL  97   5.992  20.781 -24.026
  723    H    VAL  98           H        VAL  98   7.112  23.332 -27.386
  724    HA   VAL  98           HA       VAL  98   9.295  22.793 -29.369
  725    HB   VAL  98           HB       VAL  98   6.721  24.267 -30.012
  726   HG11  VAL  98          HG11      VAL  98   9.170  23.684 -31.728
  727   HG12  VAL  98          HG12      VAL  98   7.626  24.323 -32.330
  728   HG13  VAL  98          HG13      VAL  98   8.585  25.290 -31.219
  729   HG21  VAL  98          HG21      VAL  98   6.343  21.843 -30.036
  730   HG22  VAL  98          HG22      VAL  98   6.400  22.448 -31.687
  731   HG23  VAL  98          HG23      VAL  98   7.808  21.599 -31.012
  732    H    ILE  99           H        ILE  99  10.647  24.371 -29.807
  733    HA   ILE  99           HA       ILE  99  10.786  26.754 -28.010
  734    HB   ILE  99           HB       ILE  99  12.998  24.883 -29.016
  735   HG12  ILE  99          HG12      ILE  99  13.365  24.593 -26.452
  736   HG13  ILE  99          HG13      ILE  99  11.682  25.064 -26.291
  737   HG21  ILE  99          HG21      ILE  99  13.130  27.280 -27.143
  738   HG22  ILE  99          HG22      ILE  99  14.465  26.179 -27.548
  739   HG23  ILE  99          HG23      ILE  99  13.785  27.199 -28.793
  740   HD11  ILE  99          HD11      ILE  99  12.102  22.595 -26.270
  741   HD12  ILE  99          HD12      ILE  99  10.998  23.059 -27.558
  742   HD13  ILE  99          HD13      ILE  99  12.699  22.699 -27.935
  743    H    LEU 100           H        LEU 100  11.096  28.643 -29.085
  744    HA   LEU 100           HA       LEU 100  11.646  28.589 -32.010
  745    HB2  LEU 100           HB2      LEU 100  10.949  31.014 -30.339
  746    HB3  LEU 100           HB3      LEU 100  10.914  30.851 -32.085
  747    HG   LEU 100           HG       LEU 100   8.953  29.803 -30.047
  748   HD11  LEU 100          HD11      LEU 100   8.679  32.072 -31.043
  749   HD12  LEU 100          HD12      LEU 100   8.588  31.339 -32.651
  750   HD13  LEU 100          HD13      LEU 100   7.341  30.983 -31.435
  751   HD21  LEU 100          HD21      LEU 100   7.738  28.649 -31.917
  752   HD22  LEU 100          HD22      LEU 100   9.126  28.951 -32.985
  753   HD23  LEU 100          HD23      LEU 100   9.283  27.872 -31.584
  754    H    ALA 101           H        ALA 101  13.034  30.205 -32.908
  755    HA   ALA 101           HA       ALA 101  15.708  29.887 -32.093
  756    HB1  ALA 101           HB1      ALA 101  14.938  30.184 -34.409
  757    HB2  ALA 101           HB2      ALA 101  14.477  31.868 -34.042
  758    HB3  ALA 101           HB3      ALA 101  16.183  31.378 -33.999
  759    H    ASP 102           H        ASP 102  13.568  32.221 -30.794
  760    HA   ASP 102           HA       ASP 102  15.843  33.854 -29.765
  761    HB2  ASP 102           HB2      ASP 102  14.481  35.754 -29.843
  762    HB3  ASP 102           HB3      ASP 102  14.250  34.959 -31.395
  763    H    GLY 103           H        GLY 103  14.121  31.373 -28.715
  764    HA2  GLY 103           HA2      GLY 103  14.182  30.610 -26.501
  765    HA3  GLY 103           HA3      GLY 103  14.356  32.251 -25.897
  766    H    GLN 104           H        GLN 104  11.667  31.963 -28.048
  767    HA   GLN 104           HA       GLN 104   9.687  32.031 -25.878
  768    HB2  GLN 104           HB2      GLN 104   9.436  31.897 -28.902
  769    HB3  GLN 104           HB3      GLN 104   8.067  32.009 -27.791
  770    HG2  GLN 104           HG2      GLN 104   8.837  34.190 -27.000
  771    HG3  GLN 104           HG3      GLN 104  10.297  34.065 -27.996
  772   HE21  GLN 104          HE22      GLN 104  10.187  34.399 -30.226
  773   HE22  GLN 104          HE21      GLN 104   8.728  35.041 -31.007
  774    H    ILE 105           H        ILE 105   8.422  30.327 -25.306
  775    HA   ILE 105           HA       ILE 105   8.975  27.631 -26.483
  776    HB   ILE 105           HB       ILE 105   8.592  27.982 -23.513
  777   HG12  ILE 105          HG12      ILE 105  10.539  29.399 -23.926
  778   HG13  ILE 105          HG13      ILE 105  10.908  27.980 -22.975
  779   HG21  ILE 105          HG21      ILE 105   9.923  25.826 -23.513
  780   HG22  ILE 105          HG22      ILE 105   8.373  25.730 -24.354
  781   HG23  ILE 105          HG23      ILE 105   9.871  25.881 -25.292
  782   HD11  ILE 105          HD11      ILE 105  12.655  28.590 -24.623
  783   HD12  ILE 105          HD12      ILE 105  12.046  26.941 -24.845
  784   HD13  ILE 105          HD13      ILE 105  11.518  28.252 -25.928
  785    H    THR 106           H        THR 106   7.208  26.175 -26.448
  786    HA   THR 106           HA       THR 106   4.542  27.080 -26.434
  787    HB   THR 106           HB       THR 106   4.070  24.573 -25.981
  788    HG1  THR 106           HG1      THR 106   6.118  24.220 -25.006
  789   HG21  THR 106          HG21      THR 106   4.043  25.477 -28.235
  790   HG22  THR 106          HG22      THR 106   5.816  25.436 -28.306
  791   HG23  THR 106          HG23      THR 106   4.886  23.916 -28.229
  792    HA   PRO 107           HA       PRO 107   4.023  27.396 -21.928
  793    HB2  PRO 107           HB2      PRO 107   1.439  28.274 -21.813
  794    HB3  PRO 107           HB3      PRO 107   2.836  29.311 -22.224
  795    HG2  PRO 107           HG2      PRO 107   0.874  27.996 -24.103
  796    HG3  PRO 107           HG3      PRO 107   1.534  29.665 -24.151
  797    HD2  PRO 107           HD2      PRO 107   2.500  27.598 -25.694
  798    HD3  PRO 107           HD3      PRO 107   3.526  28.950 -25.126
  799    H    PHE 108           H        PHE 108   3.989  25.491 -20.939
  800    HA   PHE 108           HA       PHE 108   1.627  23.748 -20.882
  801    HB2  PHE 108           HB2      PHE 108   2.593  21.905 -21.845
  802    HB3  PHE 108           HB3      PHE 108   3.275  23.154 -22.848
  803    HD1  PHE 108           HD1      PHE 108   5.675  24.081 -21.996
  804    HD2  PHE 108           HD2      PHE 108   3.999  20.256 -20.948
  805    HE1  PHE 108           HE1      PHE 108   7.945  23.215 -21.564
  806    HE2  PHE 108           HE2      PHE 108   6.278  19.369 -20.599
  807    HZ   PHE 108           HZ       PHE 108   8.258  20.851 -20.837
  808    H    SER 109           H        SER 109   2.283  21.722 -19.453
  809    HA   SER 109           HA       SER 109   4.270  22.439 -17.407
  810    HB2  SER 109           HB2      SER 109   1.512  21.465 -16.587
  811    HB3  SER 109           HB3      SER 109   2.864  21.885 -15.523
  812    HG   SER 109           HG       SER 109   2.644  24.011 -16.845
  813    H    LEU 110           H        LEU 110   5.283  20.842 -16.496
  814    HA   LEU 110           HA       LEU 110   5.133  18.082 -17.642
  815    HB2  LEU 110           HB2      LEU 110   6.964  19.146 -18.608
  816    HB3  LEU 110           HB3      LEU 110   7.301  20.137 -17.209
  817    HG   LEU 110           HG       LEU 110   8.393  18.311 -16.069
  818   HD11  LEU 110          HD11      LEU 110   7.092  16.356 -16.899
  819   HD12  LEU 110          HD12      LEU 110   7.732  16.630 -18.536
  820   HD13  LEU 110          HD13      LEU 110   8.815  16.146 -17.218
  821   HD21  LEU 110          HD21      LEU 110   9.678  19.687 -17.652
  822   HD22  LEU 110          HD22      LEU 110  10.303  18.033 -17.566
  823   HD23  LEU 110          HD23      LEU 110   9.317  18.537 -18.954
  824    H    LEU 111           H        LEU 111   4.271  16.821 -16.039
  825    HA   LEU 111           HA       LEU 111   5.034  17.292 -13.202
  826    HB2  LEU 111           HB2      LEU 111   2.673  17.342 -13.757
  827    HB3  LEU 111           HB3      LEU 111   2.741  15.743 -14.480
  828    HG   LEU 111           HG       LEU 111   3.655  16.031 -11.623
  829   HD11  LEU 111          HD11      LEU 111   1.345  15.841 -10.792
  830   HD12  LEU 111          HD12      LEU 111   1.629  17.363 -11.647
  831   HD13  LEU 111          HD13      LEU 111   0.729  16.053 -12.451
  832   HD21  LEU 111          HD21      LEU 111   3.650  13.779 -12.796
  833   HD22  LEU 111          HD22      LEU 111   2.604  13.826 -11.379
  834   HD23  LEU 111          HD23      LEU 111   1.899  13.938 -13.002
  835    H    MET 112           H        MET 112   5.850  15.682 -11.939
  836    HA   MET 112           HA       MET 112   6.934  13.223 -13.253
  837    HB2  MET 112           HB2      MET 112   8.340  14.990 -11.202
  838    HB3  MET 112           HB3      MET 112   8.981  13.529 -11.963
  839    HG2  MET 112           HG2      MET 112   8.876  14.681 -14.175
  840    HG3  MET 112           HG3      MET 112   8.344  16.155 -13.360
  841    HE1  MET 112           HE1      MET 112  11.966  17.058 -14.481
  842    HE2  MET 112           HE2      MET 112  10.820  16.015 -15.353
  843    HE3  MET 112           HE3      MET 112  10.244  17.495 -14.547
  844    H    ALA 113           H        ALA 113   6.606  11.389 -12.109
  845    HA   ALA 113           HA       ALA 113   5.700  11.494  -9.264
  846    HB1  ALA 113           HB1      ALA 113   3.720  11.449 -10.778
  847    HB2  ALA 113           HB2      ALA 113   4.390  10.033 -11.614
  848    HB3  ALA 113           HB3      ALA 113   3.886   9.904  -9.918
  849    H    ASN 114           H        ASN 114   5.984   9.500  -8.097
  850    HA   ASN 114           HA       ASN 114   8.422   8.077  -8.701
  851    HB2  ASN 114           HB2      ASN 114   7.535   8.384  -6.417
  852    HB3  ASN 114           HB3      ASN 114   6.150   7.363  -6.809
  853   HD21  ASN 114          HD22      ASN 114   9.255   7.324  -5.484
  854   HD22  ASN 114          HD21      ASN 114   9.732   5.691  -5.956
  855    H    ALA 115           H        ALA 115   8.707   6.342 -10.040
  856    HA   ALA 115           HA       ALA 115   6.785   5.504 -11.903
  857    HB1  ALA 115           HB1      ALA 115   8.510   3.863 -12.568
  858    HB2  ALA 115           HB2      ALA 115   9.222   5.447 -12.242
  859    HB3  ALA 115           HB3      ALA 115   9.375   4.146 -11.042
  860    H    GLY 116           H        GLY 116   7.201   4.172  -8.687
  861    HA2  GLY 116           HA2      GLY 116   5.504   1.788  -9.413
  862    HA3  GLY 116           HA3      GLY 116   6.852   1.731  -8.292
  863    H    THR 117           H        THR 117   6.218   4.210  -6.801
  864    HA   THR 117           HA       THR 117   4.016   3.406  -5.121
  865    HB   THR 117           HB       THR 117   5.101   6.226  -5.347
  866    HG1  THR 117           HG1      THR 117   6.614   5.557  -3.793
  867   HG21  THR 117          HG21      THR 117   3.213   6.017  -3.803
  868   HG22  THR 117          HG22      THR 117   3.991   4.630  -3.007
  869   HG23  THR 117          HG23      THR 117   4.712   6.253  -2.898
  870    H    GLY 118           H        GLY 118   4.201   5.353  -8.078
  871    HA2  GLY 118           HA2      GLY 118   2.546   6.119  -9.456
  872    HA3  GLY 118           HA3      GLY 118   1.354   5.253  -8.475
  873    H    GLU 119           H        GLU 119   3.578   7.829  -7.372
  874    HA   GLU 119           HA       GLU 119   1.279   9.590  -6.689
  875    HB2  GLU 119           HB2      GLU 119   1.953   8.129  -4.824
  876    HB3  GLU 119           HB3      GLU 119   3.631   8.669  -4.976
  877    HG2  GLU 119           HG2      GLU 119   2.967  10.954  -4.405
  878    HG3  GLU 119           HG3      GLU 119   1.268  10.462  -4.333
  879    HA   PRO 120           HA       PRO 120   3.915  12.564  -8.713
  880    HB2  PRO 120           HB2      PRO 120   2.812  14.945  -7.945
  881    HB3  PRO 120           HB3      PRO 120   2.055  13.821  -9.107
  882    HG2  PRO 120           HG2      PRO 120   1.499  14.050  -6.135
  883    HG3  PRO 120           HG3      PRO 120   0.315  14.009  -7.483
  884    HD2  PRO 120           HD2      PRO 120   0.915  11.782  -6.076
  885    HD3  PRO 120           HD3      PRO 120   0.675  11.694  -7.844
  886    H    LEU 121           H        LEU 121   5.596  13.929  -8.409
  887    HA   LEU 121           HA       LEU 121   6.724  14.216  -5.654
  888    HB2  LEU 121           HB2      LEU 121   7.651  12.962  -8.185
  889    HB3  LEU 121           HB3      LEU 121   8.773  14.174  -7.638
  890    HG   LEU 121           HG       LEU 121   9.427  12.028  -6.893
  891   HD11  LEU 121          HD11      LEU 121   9.770  14.103  -5.463
  892   HD12  LEU 121          HD12      LEU 121   8.415  13.566  -4.455
  893   HD13  LEU 121          HD13      LEU 121   9.853  12.547  -4.579
  894   HD21  LEU 121          HD21      LEU 121   7.218  10.926  -6.726
  895   HD22  LEU 121          HD22      LEU 121   8.188  10.701  -5.255
  896   HD23  LEU 121          HD23      LEU 121   6.852  11.868  -5.270
  897    H    LEU 122           H        LEU 122   6.910  15.551  -8.939
  898    HA   LEU 122           HA       LEU 122   7.387  18.316  -7.938
  899    HB2  LEU 122           HB2      LEU 122   9.576  16.900  -8.158
  900    HB3  LEU 122           HB3      LEU 122   9.220  16.857  -9.881
  901    HG   LEU 122           HG       LEU 122   9.223  19.489  -9.701
  902   HD11  LEU 122          HD11      LEU 122   9.357  19.458  -7.157
  903   HD12  LEU 122          HD12      LEU 122  10.976  18.768  -7.306
  904   HD13  LEU 122          HD13      LEU 122  10.631  20.392  -7.951
  905   HD21  LEU 122          HD21      LEU 122  10.880  18.098 -10.912
  906   HD22  LEU 122          HD22      LEU 122  11.608  19.503 -10.141
  907   HD23  LEU 122          HD23      LEU 122  11.794  17.895  -9.402
  908    H    THR 123           H        THR 123   7.053  19.893  -9.630
  909    HA   THR 123           HA       THR 123   6.194  18.931 -12.285
  910    HB   THR 123           HB       THR 123   4.394  20.738 -10.631
  911    HG1  THR 123           HG1      THR 123   4.607  18.032 -10.814
  912   HG21  THR 123          HG21      THR 123   3.967  19.391 -13.331
  913   HG22  THR 123          HG22      THR 123   2.736  20.274 -12.420
  914   HG23  THR 123          HG23      THR 123   4.138  21.141 -13.052
  915    H    LEU 124           H        LEU 124   6.654  20.271 -13.856
  916    HA   LEU 124           HA       LEU 124   7.941  22.873 -13.259
  917    HB2  LEU 124           HB2      LEU 124   8.484  20.652 -15.230
  918    HB3  LEU 124           HB3      LEU 124   8.790  22.305 -15.745
  919    HG   LEU 124           HG       LEU 124  10.300  22.676 -13.869
  920   HD11  LEU 124          HD11      LEU 124  11.138  20.835 -12.499
  921   HD12  LEU 124          HD12      LEU 124   9.422  21.006 -12.231
  922   HD13  LEU 124          HD13      LEU 124  10.007  19.692 -13.274
  923   HD21  LEU 124          HD21      LEU 124  11.005  20.211 -15.497
  924   HD22  LEU 124          HD22      LEU 124  11.128  21.903 -16.040
  925   HD23  LEU 124          HD23      LEU 124  12.143  21.334 -14.710
  926    H    VAL 125           H        VAL 125   7.437  24.643 -14.533
  927    HA   VAL 125           HA       VAL 125   4.949  24.498 -16.183
  928    HB   VAL 125           HB       VAL 125   5.330  26.341 -13.790
  929   HG11  VAL 125          HG11      VAL 125   2.955  26.025 -15.682
  930   HG12  VAL 125          HG12      VAL 125   2.959  26.978 -14.187
  931   HG13  VAL 125          HG13      VAL 125   3.995  27.461 -15.523
  932   HG21  VAL 125          HG21      VAL 125   3.470  23.952 -14.179
  933   HG22  VAL 125          HG22      VAL 125   4.776  24.104 -12.983
  934   HG23  VAL 125          HG23      VAL 125   3.347  25.121 -12.851
  935    H    CYS 126           H        CYS 126   4.756  25.859 -17.821
  936    HA   CYS 126           HA       CYS 126   6.915  27.878 -18.306
  937    HB2  CYS 126           HB2      CYS 126   6.790  25.801 -19.790
  938    HB3  CYS 126           HB3      CYS 126   5.184  26.320 -20.256
  939    HG   CYS 126           HG       CYS 126   6.671  26.890 -22.234
  940    H    SER 127           H        SER 127   6.347  29.828 -19.301
  941    HA   SER 127           HA       SER 127   3.456  30.627 -19.315
  942    HB2  SER 127           HB2      SER 127   5.808  32.276 -18.321
  943    HB3  SER 127           HB3      SER 127   4.109  32.782 -18.363
  944    HG   SER 127           HG       SER 127   4.740  32.018 -16.299
  945    H    GLY 128           H        GLY 128   5.732  30.003 -21.461
  946    HA2  GLY 128           HA2      GLY 128   5.178  30.671 -23.753
  947    HA3  GLY 128           HA3      GLY 128   5.098  32.346 -23.229
  948    H    SER 129           H        SER 129   7.724  31.360 -21.566
  949    HA   SER 129           HA       SER 129   9.738  31.506 -23.703
  950    HB2  SER 129           HB2      SER 129  10.705  33.608 -22.900
  951    HB3  SER 129           HB3      SER 129   9.056  33.839 -23.496
  952    HG   SER 129           HG       SER 129   9.405  34.908 -21.500
  953    H    TRP 130           H        TRP 130  11.895  31.391 -23.001
  954    HA   TRP 130           HA       TRP 130  12.512  29.464 -21.115
  955    HB2  TRP 130           HB2      TRP 130  13.918  29.932 -22.950
  956    HB3  TRP 130           HB3      TRP 130  14.041  31.633 -22.558
  957    HD1  TRP 130           HD1      TRP 130  16.028  32.449 -21.252
  958    HE1  TRP 130           HE1      TRP 130  18.010  31.399 -20.009
  959    HE3  TRP 130           HE3      TRP 130  14.596  27.537 -21.455
  960    HZ2  TRP 130           HZ2      TRP 130  18.893  28.748 -19.235
  961    HZ3  TRP 130           HZ3      TRP 130  16.012  25.790 -20.391
  962    HH2  TRP 130           HH2      TRP 130  18.141  26.387 -19.296
  963    HA   PRO 131           HA       PRO 131  13.196  28.432 -19.548
  964    HB2  PRO 131           HB2      PRO 131  14.128  27.674 -17.167
  965    HB3  PRO 131           HB3      PRO 131  15.207  28.517 -18.307
  966    HG2  PRO 131           HG2      PRO 131  13.738  29.678 -15.943
  967    HG3  PRO 131           HG3      PRO 131  15.453  29.889 -16.428
  968    HD2  PRO 131           HD2      PRO 131  13.379  31.672 -17.081
  969    HD3  PRO 131           HD3      PRO 131  14.894  31.501 -18.013
  970    H    LEU 132           H        LEU 132  12.141  26.654 -18.041
  971    HA   LEU 132           HA       LEU 132   9.488  27.492 -17.133
  972    HB2  LEU 132           HB2      LEU 132  10.982  24.839 -17.290
  973    HB3  LEU 132           HB3      LEU 132   9.559  25.016 -16.276
  974    HG   LEU 132           HG       LEU 132   8.359  25.974 -18.320
  975   HD11  LEU 132          HD11      LEU 132   9.088  25.139 -20.511
  976   HD12  LEU 132          HD12      LEU 132  10.253  26.280 -19.845
  977   HD13  LEU 132          HD13      LEU 132  10.587  24.532 -19.781
  978   HD21  LEU 132          HD21      LEU 132   9.124  23.033 -18.323
  979   HD22  LEU 132          HD22      LEU 132   7.847  23.784 -17.346
  980   HD23  LEU 132          HD23      LEU 132   7.697  23.754 -19.093
  981    H    ASP 133           H        ASP 133   8.723  26.951 -15.035
  982    HA   ASP 133           HA       ASP 133  10.665  27.491 -12.805
  983    HB2  ASP 133           HB2      ASP 133   8.770  29.137 -13.131
  984    HB3  ASP 133           HB3      ASP 133   7.636  27.812 -12.843
  985    H    GLN 134           H        GLN 134  10.012  26.232 -10.755
  986    HA   GLN 134           HA       GLN 134   8.636  23.681 -11.297
  987    HB2  GLN 134           HB2      GLN 134  10.387  22.243 -10.591
  988    HB3  GLN 134           HB3      GLN 134  11.004  23.274 -11.889
  989    HG2  GLN 134           HG2      GLN 134  12.106  24.690 -10.121
  990    HG3  GLN 134           HG3      GLN 134  11.628  23.456  -8.937
  991   HE21  GLN 134          HE22      GLN 134  12.529  21.180  -9.289
  992   HE22  GLN 134          HE21      GLN 134  14.057  21.069 -10.148
  993    H    THR 135           H        THR 135   7.936  22.490  -9.535
  994    HA   THR 135           HA       THR 135   8.296  23.485  -6.776
  995    HB   THR 135           HB       THR 135   6.470  24.845  -7.859
  996    HG1  THR 135           HG1      THR 135   5.286  24.740  -6.028
  997   HG21  THR 135          HG21      THR 135   4.246  23.842  -8.072
  998   HG22  THR 135          HG22      THR 135   5.366  23.156  -9.254
  999   HG23  THR 135          HG23      THR 135   4.896  22.222  -7.818
 1000    H    LEU 136           H        LEU 136   6.975  22.123  -5.233
 1001    HA   LEU 136           HA       LEU 136   7.173  19.249  -5.847
 1002    HB2  LEU 136           HB2      LEU 136   6.182  20.825  -3.431
 1003    HB3  LEU 136           HB3      LEU 136   6.067  19.083  -3.550
 1004    HG   LEU 136           HG       LEU 136   7.907  19.681  -2.157
 1005   HD11  LEU 136          HD11      LEU 136   9.687  18.378  -3.132
 1006   HD12  LEU 136          HD12      LEU 136   8.130  17.649  -3.557
 1007   HD13  LEU 136          HD13      LEU 136   9.029  18.592  -4.765
 1008   HD21  LEU 136          HD21      LEU 136   9.877  20.854  -2.828
 1009   HD22  LEU 136          HD22      LEU 136   9.302  21.028  -4.492
 1010   HD23  LEU 136          HD23      LEU 136   8.483  21.892  -3.166
 1011    H    ALA 137           H        ALA 137   5.566  17.945  -6.363
 1012    HA   ALA 137           HA       ALA 137   3.687  17.562  -7.733
 1013    HB1  ALA 137           HB1      ALA 137   3.707  16.344  -5.610
 1014    HB2  ALA 137           HB2      ALA 137   2.808  17.660  -4.822
 1015    HB3  ALA 137           HB3      ALA 137   2.041  16.700  -6.106
 1016    H    ARG 138           H        ARG 138   3.509  19.537  -8.893
 1017    HA   ARG 138           HA       ARG 138   2.565  21.447  -9.678
 1018    HB2  ARG 138           HB2      ARG 138   0.539  20.946 -10.737
 1019    HB3  ARG 138           HB3      ARG 138   1.484  19.475 -10.641
 1020    HG2  ARG 138           HG2      ARG 138   0.054  18.673  -8.762
 1021    HG3  ARG 138           HG3      ARG 138  -0.914  20.158  -8.896
 1022    HD2  ARG 138           HD2      ARG 138  -1.266  19.557 -11.358
 1023    HD3  ARG 138           HD3      ARG 138  -0.509  18.009 -11.010
 1024    HE   ARG 138           HE       ARG 138  -2.392  17.324  -9.775
 1025   HH11  ARG 138          HH11      ARG 138  -2.831  20.679 -10.745
 1026   HH12  ARG 138          HH12      ARG 138  -4.518  20.675 -10.311
 1027   HH21  ARG 138          HH21      ARG 138  -4.573  17.403  -9.268
 1028   HH22  ARG 138          HH22      ARG 138  -5.466  18.868  -9.543
 1029    H    ASP 139           H        ASP 139   2.650  21.902  -6.793
 1030    HA   ASP 139           HA       ASP 139   0.376  23.276  -5.902
 1031    HB2  ASP 139           HB2      ASP 139   2.431  22.797  -4.599
 1032    HB3  ASP 139           HB3      ASP 139   3.286  24.039  -5.512
 1033    H    THR 140           H        THR 140   2.549  24.320  -8.459
 1034    HA   THR 140           HA       THR 140   1.381  27.036  -8.650
 1035    HB   THR 140           HB       THR 140   3.118  27.283 -10.459
 1036    HG1  THR 140           HG1      THR 140   4.650  25.640 -10.586
 1037   HG21  THR 140          HG21      THR 140   5.063  27.334  -8.979
 1038   HG22  THR 140          HG22      THR 140   3.638  27.968  -8.138
 1039   HG23  THR 140          HG23      THR 140   4.222  26.329  -7.781
 1040    H    ARG 141           H        ARG 141   0.455  24.042  -9.741
 1041    HA   ARG 141           HA       ARG 141  -1.113  25.189 -11.964
 1042    HB2  ARG 141           HB2      ARG 141   1.002  24.145 -12.922
 1043    HB3  ARG 141           HB3      ARG 141   0.447  22.599 -12.306
 1044    HG2  ARG 141           HG2      ARG 141  -0.180  22.622 -14.584
 1045    HG3  ARG 141           HG3      ARG 141  -1.680  22.949 -13.721
 1046    HD2  ARG 141           HD2      ARG 141  -1.154  25.458 -14.114
 1047    HD3  ARG 141           HD3      ARG 141   0.085  24.914 -15.238
 1048    HE   ARG 141           HE       ARG 141  -2.845  24.802 -15.542
 1049   HH11  ARG 141          HH11      ARG 141   0.167  23.658 -16.963
 1050   HH12  ARG 141          HH12      ARG 141  -0.615  23.296 -18.477
 1051   HH21  ARG 141          HH21      ARG 141  -3.736  24.311 -17.481
 1052   HH22  ARG 141          HH22      ARG 141  -2.763  23.659 -18.758
 1053    HA   PRO 142           HA       PRO 142  -3.473  22.486  -8.936
 1054    HB2  PRO 142           HB2      PRO 142  -5.302  24.318  -8.068
 1055    HB3  PRO 142           HB3      PRO 142  -3.666  24.149  -7.361
 1056    HG2  PRO 142           HG2      PRO 142  -4.584  26.129  -9.470
 1057    HG3  PRO 142           HG3      PRO 142  -3.650  26.456  -7.975
 1058    HD2  PRO 142           HD2      PRO 142  -2.433  26.154 -10.390
 1059    HD3  PRO 142           HD3      PRO 142  -1.689  25.543  -8.882
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1   5.204  -6.696  -2.019
    2    H2   MET   1           H2       MET   1   6.361  -7.593  -2.759
    3    H3   MET   1           H3       MET   1   6.693  -6.809  -1.365
    4    HA   MET   1           HA       MET   1   7.700  -5.643  -3.163
    5    HB2  MET   1           HB2      MET   1   6.448  -4.684  -4.986
    6    HB3  MET   1           HB3      MET   1   6.204  -6.415  -4.935
    7    HG2  MET   1           HG2      MET   1   4.130  -5.492  -5.490
    8    HG3  MET   1           HG3      MET   1   3.960  -6.001  -3.820
    9    HE1  MET   1           HE1      MET   1   1.541  -2.926  -4.099
   10    HE2  MET   1           HE2      MET   1   1.879  -4.154  -5.338
   11    HE3  MET   1           HE3      MET   1   1.706  -4.634  -3.633
   12    H    ALA   2           H        ALA   2   7.614  -3.217  -3.475
   13    HA   ALA   2           HA       ALA   2   5.872  -1.696  -1.692
   14    HB1  ALA   2           HB1      ALA   2   7.669  -2.445  -0.141
   15    HB2  ALA   2           HB2      ALA   2   8.897  -1.777  -1.239
   16    HB3  ALA   2           HB3      ALA   2   7.750  -0.699  -0.413
   17    H    TYR   3           H        TYR   3   6.258   0.653  -1.928
   18    HA   TYR   3           HA       TYR   3   7.459   1.441  -4.558
   19    HB2  TYR   3           HB2      TYR   3   4.849   2.400  -3.346
   20    HB3  TYR   3           HB3      TYR   3   5.535   2.917  -4.876
   21    HD1  TYR   3           HD1      TYR   3   6.313   0.426  -6.242
   22    HD2  TYR   3           HD2      TYR   3   2.834   1.328  -3.846
   23    HE1  TYR   3           HE1      TYR   3   4.999  -1.238  -7.526
   24    HE2  TYR   3           HE2      TYR   3   1.522  -0.349  -5.135
   25    HH   TYR   3           HH       TYR   3   2.955  -2.226  -7.830
   26    H    GLY   4           H        GLY   4   8.351   1.735  -1.623
   27    HA2  GLY   4           HA2      GLY   4   8.260   4.498  -0.887
   28    HA3  GLY   4           HA3      GLY   4   9.295   3.252  -0.194
   29    H    ARG   5           H        ARG   5   9.287   4.341  -3.574
   30    HA   ARG   5           HA       ARG   5  12.130   4.666  -3.804
   31    HB2  ARG   5           HB2      ARG   5   9.888   5.784  -5.537
   32    HB3  ARG   5           HB3      ARG   5  11.590   5.734  -5.975
   33    HG2  ARG   5           HG2      ARG   5  11.582   3.288  -5.989
   34    HG3  ARG   5           HG3      ARG   5   9.871   3.266  -5.498
   35    HD2  ARG   5           HD2      ARG   5   9.242   4.508  -7.520
   36    HD3  ARG   5           HD3      ARG   5  10.919   4.643  -8.011
   37    HE   ARG   5           HE       ARG   5   9.225   2.183  -8.042
   38   HH11  ARG   5          HH11      ARG   5  12.413   3.480  -8.752
   39   HH12  ARG   5          HH12      ARG   5  12.654   2.375 -10.081
   40   HH21  ARG   5          HH21      ARG   5   9.694   0.687  -9.621
   41   HH22  ARG   5          HH22      ARG   5  11.217   0.758 -10.448
   42    H    GLU   6           H        GLU   6   9.891   6.855  -2.388
   43    HA   GLU   6           HA       GLU   6  10.702   9.365  -3.230
   44    HB2  GLU   6           HB2      GLU   6   9.815  10.233  -1.153
   45    HB3  GLU   6           HB3      GLU   6   8.780   8.969  -1.815
   46    HG2  GLU   6           HG2      GLU   6   9.734   7.340  -0.184
   47    HG3  GLU   6           HG3      GLU   6  10.757   8.613   0.483
   48    H    ASP   7           H        ASP   7  12.565   7.325  -1.038
   49    HA   ASP   7           HA       ASP   7  14.421   9.276  -0.083
   50    HB2  ASP   7           HB2      ASP   7  14.037   6.975   0.818
   51    HB3  ASP   7           HB3      ASP   7  14.807   6.306  -0.621
   52    H    VAL   8           H        VAL   8  14.010   8.068  -3.241
   53    HA   VAL   8           HA       VAL   8  16.660   9.108  -4.181
   54    HB   VAL   8           HB       VAL   8  15.235   6.780  -5.504
   55   HG11  VAL   8          HG11      VAL   8  17.018   8.013  -6.747
   56   HG12  VAL   8          HG12      VAL   8  18.164   7.628  -5.450
   57   HG13  VAL   8          HG13      VAL   8  17.446   6.330  -6.432
   58   HG21  VAL   8          HG21      VAL   8  15.647   5.904  -3.282
   59   HG22  VAL   8          HG22      VAL   8  16.815   5.219  -4.406
   60   HG23  VAL   8          HG23      VAL   8  17.319   6.523  -3.305
   61    H    ALA   9           H        ALA   9  13.276   8.337  -5.096
   62    HA   ALA   9           HA       ALA   9  13.213   9.510  -7.628
   63    HB1  ALA   9           HB1      ALA   9  10.773   9.501  -7.339
   64    HB2  ALA   9           HB2      ALA   9  11.481   8.005  -6.710
   65    HB3  ALA   9           HB3      ALA   9  10.957   9.280  -5.587
   66    H    ASN  10           H        ASN  10  12.601  11.171  -4.471
   67    HA   ASN  10           HA       ASN  10  11.819  13.655  -5.676
   68    HB2  ASN  10           HB2      ASN  10  12.981  12.992  -2.929
   69    HB3  ASN  10           HB3      ASN  10  12.423  14.591  -3.409
   70   HD21  ASN  10          HD22      ASN  10  10.469  14.979  -2.448
   71   HD22  ASN  10          HD21      ASN  10   9.173  13.801  -2.380
   72    H    THR  11           H        THR  11  15.064  12.535  -4.559
   73    HA   THR  11           HA       THR  11  16.516  14.845  -5.431
   74    HB   THR  11           HB       THR  11  17.435  11.954  -5.236
   75    HG1  THR  11           HG1      THR  11  18.045  12.603  -3.164
   76   HG21  THR  11          HG21      THR  11  19.670  12.971  -4.802
   77   HG22  THR  11          HG22      THR  11  19.097  13.353  -6.430
   78   HG23  THR  11          HG23      THR  11  18.999  14.581  -5.147
   79    H    ARG  12           H        ARG  12  15.772  11.770  -7.141
   80    HA   ARG  12           HA       ARG  12  17.035  12.452  -9.620
   81    HB2  ARG  12           HB2      ARG  12  14.681  10.638  -8.963
   82    HB3  ARG  12           HB3      ARG  12  15.369  10.749 -10.577
   83    HG2  ARG  12           HG2      ARG  12  17.320  10.235  -8.340
   84    HG3  ARG  12           HG3      ARG  12  16.167   8.966  -8.695
   85    HD2  ARG  12           HD2      ARG  12  18.305   8.669  -9.899
   86    HD3  ARG  12           HD3      ARG  12  16.886   8.734 -10.935
   87    HE   ARG  12           HE       ARG  12  17.813  10.525 -12.050
   88   HH11  ARG  12          HH11      ARG  12  19.428  10.502  -8.927
   89   HH12  ARG  12          HH12      ARG  12  20.448  11.847  -9.392
   90   HH21  ARG  12          HH21      ARG  12  19.236  11.926 -12.628
   91   HH22  ARG  12          HH22      ARG  12  20.442  12.564 -11.501
   92    H    ALA  13           H        ALA  13  13.685  13.172  -8.515
   93    HA   ALA  13           HA       ALA  13  12.777  14.401 -10.886
   94    HB1  ALA  13           HB1      ALA  13  11.394  13.780  -8.926
   95    HB2  ALA  13           HB2      ALA  13  12.075  15.165  -8.042
   96    HB3  ALA  13           HB3      ALA  13  11.116  15.425  -9.517
   97    H    ARG  14           H        ARG  14  14.514  15.858  -8.101
   98    HA   ARG  14           HA       ARG  14  14.555  18.581  -9.103
   99    HB2  ARG  14           HB2      ARG  14  16.428  17.123  -7.171
  100    HB3  ARG  14           HB3      ARG  14  16.388  18.869  -7.394
  101    HG2  ARG  14           HG2      ARG  14  14.238  19.078  -6.376
  102    HG3  ARG  14           HG3      ARG  14  13.927  17.341  -6.470
  103    HD2  ARG  14           HD2      ARG  14  15.881  16.953  -4.943
  104    HD3  ARG  14           HD3      ARG  14  16.023  18.702  -4.733
  105    HE   ARG  14           HE       ARG  14  13.576  18.554  -3.918
  106   HH11  ARG  14          HH11      ARG  14  15.886  15.979  -3.265
  107   HH12  ARG  14          HH12      ARG  14  15.042  15.484  -1.834
  108   HH21  ARG  14          HH21      ARG  14  12.604  17.873  -2.044
  109   HH22  ARG  14          HH22      ARG  14  13.261  16.534  -1.162
  110    H    GLU  15           H        GLU  15  16.873  15.908  -9.352
  111    HA   GLU  15           HA       GLU  15  18.810  17.353 -10.954
  112    HB2  GLU  15           HB2      GLU  15  18.146  14.398 -10.635
  113    HB3  GLU  15           HB3      GLU  15  19.371  14.994 -11.765
  114    HG2  GLU  15           HG2      GLU  15  20.397  16.217  -9.699
  115    HG3  GLU  15           HG3      GLU  15  19.349  15.145  -8.743
  116    H    THR  16           H        THR  16  16.182  15.116 -11.966
  117    HA   THR  16           HA       THR  16  16.556  15.334 -14.747
  118    HB   THR  16           HB       THR  16  13.958  14.878 -13.230
  119    HG1  THR  16           HG1      THR  16  15.439  13.394 -12.626
  120   HG21  THR  16          HG21      THR  16  14.718  13.763 -15.949
  121   HG22  THR  16          HG22      THR  16  13.177  13.616 -15.094
  122   HG23  THR  16          HG23      THR  16  13.669  15.189 -15.763
  123    H    ALA  17           H        ALA  17  14.663  17.448 -12.599
  124    HA   ALA  17           HA       ALA  17  13.700  19.243 -14.580
  125    HB1  ALA  17           HB1      ALA  17  14.369  19.613 -11.639
  126    HB2  ALA  17           HB2      ALA  17  13.519  20.805 -12.633
  127    HB3  ALA  17           HB3      ALA  17  12.790  19.206 -12.342
  128    H    ALA  18           H        ALA  18  16.757  19.413 -12.661
  129    HA   ALA  18           HA       ALA  18  17.712  21.821 -13.904
  130    HB1  ALA  18           HB1      ALA  18  19.860  21.176 -12.905
  131    HB2  ALA  18           HB2      ALA  18  18.540  20.936 -11.744
  132    HB3  ALA  18           HB3      ALA  18  19.253  19.540 -12.583
  133    H    ARG  19           H        ARG  19  18.166  18.357 -14.722
  134    HA   ARG  19           HA       ARG  19  20.021  18.810 -16.904
  135    HB2  ARG  19           HB2      ARG  19  18.102  16.469 -16.687
  136    HB3  ARG  19           HB3      ARG  19  19.604  16.582 -17.597
  137    HG2  ARG  19           HG2      ARG  19  19.179  15.991 -14.710
  138    HG3  ARG  19           HG3      ARG  19  20.165  15.178 -15.886
  139    HD2  ARG  19           HD2      ARG  19  21.849  16.950 -15.794
  140    HD3  ARG  19           HD3      ARG  19  20.844  17.882 -14.663
  141    HE   ARG  19           HE       ARG  19  21.150  15.382 -13.458
  142   HH11  ARG  19          HH11      ARG  19  23.393  17.889 -14.433
  143   HH12  ARG  19          HH12      ARG  19  24.517  17.486 -13.169
  144   HH21  ARG  19          HH21      ARG  19  22.584  14.965 -11.833
  145   HH22  ARG  19          HH22      ARG  19  24.083  15.861 -11.764
  146    H    PHE  20           H        PHE  20  16.444  18.424 -16.864
  147    HA   PHE  20           HA       PHE  20  16.032  18.891 -19.635
  148    HB2  PHE  20           HB2      PHE  20  14.253  18.084 -18.165
  149    HB3  PHE  20           HB3      PHE  20  14.287  19.582 -17.245
  150    HD1  PHE  20           HD1      PHE  20  13.819  18.336 -20.785
  151    HD2  PHE  20           HD2      PHE  20  12.893  21.382 -17.873
  152    HE1  PHE  20           HE1      PHE  20  12.172  19.341 -22.343
  153    HE2  PHE  20           HE2      PHE  20  11.305  22.427 -19.472
  154    HZ   PHE  20           HZ       PHE  20  10.946  21.403 -21.714
  155    H    THR  21           H        THR  21  16.266  21.293 -16.956
  156    HA   THR  21           HA       THR  21  15.819  23.587 -18.585
  157    HB   THR  21           HB       THR  21  17.570  23.446 -16.100
  158    HG1  THR  21           HG1      THR  21  15.530  22.640 -15.663
  159   HG21  THR  21          HG21      THR  21  16.042  25.747 -17.417
  160   HG22  THR  21          HG22      THR  21  16.733  25.809 -15.788
  161   HG23  THR  21          HG23      THR  21  17.801  25.620 -17.180
  162    H    ALA  22           H        ALA  22  18.942  21.891 -17.878
  163    HA   ALA  22           HA       ALA  22  20.509  23.612 -19.555
  164    HB1  ALA  22           HB1      ALA  22  20.951  20.695 -18.772
  165    HB2  ALA  22           HB2      ALA  22  22.177  21.804 -19.419
  166    HB3  ALA  22           HB3      ALA  22  21.454  22.115 -17.828
  167    H    ALA  23           H        ALA  23  18.766  20.579 -20.332
  168    HA   ALA  23           HA       ALA  23  19.583  20.406 -23.061
  169    HB1  ALA  23           HB1      ALA  23  18.554  18.566 -21.790
  170    HB2  ALA  23           HB2      ALA  23  17.002  19.440 -21.776
  171    HB3  ALA  23           HB3      ALA  23  17.693  18.880 -23.310
  172    H    LEU  24           H        LEU  24  16.916  22.213 -21.550
  173    HA   LEU  24           HA       LEU  24  15.754  23.185 -23.983
  174    HB2  LEU  24           HB2      LEU  24  14.727  23.029 -21.658
  175    HB3  LEU  24           HB3      LEU  24  15.724  24.391 -21.194
  176    HG   LEU  24           HG       LEU  24  14.555  25.710 -23.090
  177   HD11  LEU  24          HD11      LEU  24  13.648  23.709 -24.294
  178   HD12  LEU  24          HD12      LEU  24  12.650  23.320 -22.885
  179   HD13  LEU  24          HD13      LEU  24  12.358  24.815 -23.794
  180   HD21  LEU  24          HD21      LEU  24  12.893  24.606 -20.790
  181   HD22  LEU  24          HD22      LEU  24  13.990  25.995 -20.698
  182   HD23  LEU  24          HD23      LEU  24  12.536  26.091 -21.708
  183    H    GLU  25           H        GLU  25  18.384  24.467 -21.898
  184    HA   GLU  25           HA       GLU  25  18.835  26.883 -23.402
  185    HB2  GLU  25           HB2      GLU  25  19.803  26.292 -21.123
  186    HB3  GLU  25           HB3      GLU  25  20.951  25.248 -21.958
  187    HG2  GLU  25           HG2      GLU  25  21.760  27.213 -23.267
  188    HG3  GLU  25           HG3      GLU  25  20.603  28.240 -22.418
  189    H    LEU  26           H        LEU  26  20.239  23.605 -23.718
  190    HA   LEU  26           HA       LEU  26  21.808  23.919 -26.048
  191    HB2  LEU  26           HB2      LEU  26  22.077  21.877 -25.031
  192    HB3  LEU  26           HB3      LEU  26  20.406  21.747 -24.592
  193    HG   LEU  26           HG       LEU  26  19.884  21.160 -27.043
  194   HD11  LEU  26          HD11      LEU  26  21.742  20.209 -28.323
  195   HD12  LEU  26          HD12      LEU  26  22.050  21.924 -28.006
  196   HD13  LEU  26          HD13      LEU  26  22.895  20.683 -27.055
  197   HD21  LEU  26          HD21      LEU  26  20.542  18.817 -26.696
  198   HD22  LEU  26          HD22      LEU  26  21.569  19.310 -25.328
  199   HD23  LEU  26          HD23      LEU  26  19.802  19.530 -25.259
  200    H    ALA  27           H        ALA  27  18.306  23.265 -25.825
  201    HA   ALA  27           HA       ALA  27  17.819  23.265 -28.630
  202    HB1  ALA  27           HB1      ALA  27  16.259  22.332 -26.990
  203    HB2  ALA  27           HB2      ALA  27  15.954  23.942 -26.316
  204    HB3  ALA  27           HB3      ALA  27  15.465  23.577 -27.980
  205    H    ILE  28           H        ILE  28  17.693  26.025 -26.306
  206    HA   ILE  28           HA       ILE  28  16.880  28.018 -28.209
  207    HB   ILE  28           HB       ILE  28  18.538  28.272 -25.667
  208   HG12  ILE  28          HG12      ILE  28  15.608  28.984 -26.121
  209   HG13  ILE  28          HG13      ILE  28  16.118  27.413 -25.525
  210   HG21  ILE  28          HG21      ILE  28  17.235  30.451 -27.365
  211   HG22  ILE  28          HG22      ILE  28  17.900  30.702 -25.737
  212   HG23  ILE  28          HG23      ILE  28  18.971  30.250 -27.051
  213   HD11  ILE  28          HD11      ILE  28  17.256  28.527 -23.596
  214   HD12  ILE  28          HD12      ILE  28  16.469  30.044 -24.102
  215   HD13  ILE  28          HD13      ILE  28  15.490  28.629 -23.648
  216    H    ASP  29           H        ASP  29  20.159  26.949 -27.210
  217    HA   ASP  29           HA       ASP  29  21.634  28.699 -28.879
  218    HB2  ASP  29           HB2      ASP  29  22.494  27.338 -26.959
  219    HB3  ASP  29           HB3      ASP  29  22.374  25.894 -27.968
  220    H    ARG  30           H        ARG  30  19.930  25.760 -29.743
  221    HA   ARG  30           HA       ARG  30  21.272  25.646 -32.400
  222    HB2  ARG  30           HB2      ARG  30  21.263  23.650 -30.983
  223    HB3  ARG  30           HB3      ARG  30  19.495  23.618 -30.986
  224    HG2  ARG  30           HG2      ARG  30  19.431  23.171 -33.351
  225    HG3  ARG  30           HG3      ARG  30  21.157  23.535 -33.546
  226    HD2  ARG  30           HD2      ARG  30  21.711  21.562 -32.174
  227    HD3  ARG  30           HD3      ARG  30  19.987  21.186 -32.004
  228    HE   ARG  30           HE       ARG  30  20.032  21.184 -34.617
  229   HH11  ARG  30          HH11      ARG  30  22.755  20.016 -32.733
  230   HH12  ARG  30          HH12      ARG  30  23.227  18.878 -33.982
  231   HH21  ARG  30          HH21      ARG  30  20.678  19.659 -36.111
  232   HH22  ARG  30          HH22      ARG  30  22.005  18.583 -35.726
  233    H    ALA  31           H        ALA  31  18.068  26.436 -31.106
  234    HA   ALA  31           HA       ALA  31  16.644  26.251 -33.570
  235    HB1  ALA  31           HB1      ALA  31  15.041  27.774 -32.457
  236    HB2  ALA  31           HB2      ALA  31  15.579  26.491 -31.360
  237    HB3  ALA  31           HB3      ALA  31  16.244  28.126 -31.193
  238    H    THR  32           H        THR  32  18.781  28.870 -32.465
  239    HA   THR  32           HA       THR  32  18.086  30.650 -34.666
  240    HB   THR  32           HB       THR  32  19.094  31.404 -32.529
  241    HG1  THR  32           HG1      THR  32  20.372  32.930 -33.535
  242   HG21  THR  32          HG21      THR  32  21.735  30.383 -33.668
  243   HG22  THR  32          HG22      THR  32  21.495  31.318 -32.180
  244   HG23  THR  32          HG23      THR  32  20.882  29.664 -32.280
  245    H    LEU  33           H        LEU  33  20.271  27.933 -34.354
  246    HA   LEU  33           HA       LEU  33  21.725  28.473 -36.810
  247    HB2  LEU  33           HB2      LEU  33  21.661  26.084 -34.925
  248    HB3  LEU  33           HB3      LEU  33  22.809  26.295 -36.244
  249    HG   LEU  33           HG       LEU  33  22.591  28.071 -33.774
  250   HD11  LEU  33          HD11      LEU  33  23.493  25.827 -33.306
  251   HD12  LEU  33          HD12      LEU  33  24.704  26.038 -34.593
  252   HD13  LEU  33          HD13      LEU  33  24.733  27.072 -33.143
  253   HD21  LEU  33          HD21      LEU  33  23.409  29.392 -35.667
  254   HD22  LEU  33          HD22      LEU  33  24.738  29.043 -34.558
  255   HD23  LEU  33          HD23      LEU  33  24.589  28.124 -36.074
  256    H    SER  34           H        SER  34  18.972  26.526 -35.835
  257    HA   SER  34           HA       SER  34  19.116  24.691 -38.080
  258    HB2  SER  34           HB2      SER  34  16.961  25.076 -35.973
  259    HB3  SER  34           HB3      SER  34  17.103  23.706 -37.097
  260    HG   SER  34           HG       SER  34  18.931  24.497 -35.076
  261    H    GLY  35           H        GLY  35  17.532  27.762 -37.769
  262    HA2  GLY  35           HA2      GLY  35  16.423  28.973 -39.421
  263    HA3  GLY  35           HA3      GLY  35  16.493  27.578 -40.492
  264    H    GLN  36           H        GLN  36  15.164  26.251 -37.938
  265    HA   GLN  36           HA       GLN  36  12.418  27.287 -37.914
  266    HB2  GLN  36           HB2      GLN  36  12.175  25.512 -39.535
  267    HB3  GLN  36           HB3      GLN  36  13.219  24.435 -38.640
  268    HG2  GLN  36           HG2      GLN  36  11.465  24.331 -36.806
  269    HG3  GLN  36           HG3      GLN  36  10.412  25.299 -37.845
  270   HE21  GLN  36          HE22      GLN  36  10.638  22.239 -36.772
  271   HE22  GLN  36          HE21      GLN  36  10.039  21.422 -38.209
  272    HA   PRO  37           HA       PRO  37  13.044  26.762 -33.452
  273    HB2  PRO  37           HB2      PRO  37  10.407  25.286 -33.825
  274    HB3  PRO  37           HB3      PRO  37  10.906  26.287 -32.428
  275    HG2  PRO  37           HG2      PRO  37   9.415  27.429 -34.331
  276    HG3  PRO  37           HG3      PRO  37  10.893  28.288 -33.778
  277    HD2  PRO  37           HD2      PRO  37  10.477  26.681 -36.274
  278    HD3  PRO  37           HD3      PRO  37  11.395  28.195 -36.052
  279    H    VAL  38           H        VAL  38  13.493  25.208 -31.865
  280    HA   VAL  38           HA       VAL  38  13.991  22.385 -32.789
  281    HB   VAL  38           HB       VAL  38  15.422  24.077 -30.714
  282   HG11  VAL  38          HG11      VAL  38  16.926  22.089 -30.379
  283   HG12  VAL  38          HG12      VAL  38  15.318  21.870 -29.695
  284   HG13  VAL  38          HG13      VAL  38  15.742  21.090 -31.232
  285   HG21  VAL  38          HG21      VAL  38  16.077  24.271 -33.158
  286   HG22  VAL  38          HG22      VAL  38  17.368  23.642 -32.125
  287   HG23  VAL  38          HG23      VAL  38  16.432  22.551 -33.169
  288    H    GLY  39           H        GLY  39  13.545  20.705 -31.039
  289    HA2  GLY  39           HA2      GLY  39  11.679  21.593 -28.943
  290    HA3  GLY  39           HA3      GLY  39  10.971  20.634 -30.232
  291    H    ILE  40           H        ILE  40  10.599  19.688 -27.918
  292    HA   ILE  40           HA       ILE  40  12.415  17.337 -27.660
  293    HB   ILE  40           HB       ILE  40  11.365  18.928 -25.292
  294   HG12  ILE  40          HG12      ILE  40  14.229  18.632 -26.326
  295   HG13  ILE  40          HG13      ILE  40  13.250  20.087 -26.481
  296   HG21  ILE  40          HG21      ILE  40  13.184  16.471 -25.443
  297   HG22  ILE  40          HG22      ILE  40  12.702  17.313 -23.956
  298   HG23  ILE  40          HG23      ILE  40  11.495  16.471 -24.904
  299   HD11  ILE  40          HD11      ILE  40  14.208  18.947 -23.846
  300   HD12  ILE  40          HD12      ILE  40  14.808  20.382 -24.689
  301   HD13  ILE  40          HD13      ILE  40  13.149  20.369 -24.068
  302    H    HIS  41           H        HIS  41  11.328  15.589 -27.950
  303    HA   HIS  41           HA       HIS  41   8.411  15.412 -27.832
  304    HB2  HIS  41           HB2      HIS  41   9.586  14.332 -29.673
  305    HB3  HIS  41           HB3      HIS  41  10.634  13.472 -28.549
  306    HD1  HIS  41           HD1      HIS  41   9.667  11.233 -27.488
  307    HD2  HIS  41           HD2      HIS  41   6.921  13.512 -29.708
  308    HE1  HIS  41           HE1      HIS  41   7.539   9.856 -27.631
  309    H    PHE  42           H        PHE  42   7.351  13.904 -26.468
  310    HA   PHE  42           HA       PHE  42   8.768  12.964 -24.010
  311    HB2  PHE  42           HB2      PHE  42   6.573  15.019 -24.234
  312    HB3  PHE  42           HB3      PHE  42   6.642  13.979 -22.829
  313    HD1  PHE  42           HD2      PHE  42   8.531  13.965 -21.296
  314    HD2  PHE  42           HD1      PHE  42   8.292  16.862 -24.490
  315    HE1  PHE  42           HE2      PHE  42  10.178  15.401 -20.115
  316    HE2  PHE  42           HE1      PHE  42   9.979  18.264 -23.323
  317    HZ   PHE  42           HZ       PHE  42  10.892  17.547 -21.124
  318    H    SER  43           H        SER  43   7.885  11.293 -22.936
  319    HA   SER  43           HA       SER  43   5.307  10.089 -23.798
  320    HB2  SER  43           HB2      SER  43   6.224   7.944 -24.011
  321    HB3  SER  43           HB3      SER  43   7.341   8.989 -24.900
  322    HG   SER  43           HG       SER  43   8.420   7.523 -23.503
  323    H    ASP  44           H        ASP  44   5.042   8.039 -22.141
  324    HA   ASP  44           HA       ASP  44   4.424   9.110 -19.591
  325    HB2  ASP  44           HB2      ASP  44   3.361   7.166 -20.712
  326    HB3  ASP  44           HB3      ASP  44   4.837   6.231 -20.483
  327    H    SER  45           H        SER  45   7.450   7.694 -20.716
  328    HA   SER  45           HA       SER  45   8.651   7.981 -17.993
  329    HB2  SER  45           HB2      SER  45   9.670   5.761 -18.194
  330    HB3  SER  45           HB3      SER  45   7.902   5.666 -18.223
  331    HG   SER  45           HG       SER  45   8.862   4.373 -19.856
  332    H    ALA  46           H        ALA  46   9.002   8.790 -21.240
  333    HA   ALA  46           HA       ALA  46  11.850   9.412 -20.818
  334    HB1  ALA  46           HB1      ALA  46  10.831   7.858 -23.241
  335    HB2  ALA  46           HB2      ALA  46  12.507   8.363 -22.954
  336    HB3  ALA  46           HB3      ALA  46  11.762   7.158 -21.901
  337    H    TRP  47           H        TRP  47  12.658  10.454 -22.964
  338    HA   TRP  47           HA       TRP  47  10.837  12.312 -24.253
  339    HB2  TRP  47           HB2      TRP  47  12.282  14.278 -23.597
  340    HB3  TRP  47           HB3      TRP  47  11.336  13.606 -22.283
  341    HD1  TRP  47           HD1      TRP  47  12.558  12.748 -20.201
  342    HE1  TRP  47           HE1      TRP  47  15.002  12.496 -19.449
  343    HE3  TRP  47           HE3      TRP  47  14.923  14.001 -24.588
  344    HZ2  TRP  47           HZ2      TRP  47  17.614  12.681 -20.620
  345    HZ3  TRP  47           HZ3      TRP  47  17.402  13.890 -24.723
  346    HH2  TRP  47           HH2      TRP  47  18.750  13.229 -22.767
  347    H    ARG  48           H        ARG  48  12.018  13.464 -26.011
  348    HA   ARG  48           HA       ARG  48  14.726  12.486 -26.687
  349    HB2  ARG  48           HB2      ARG  48  12.500  12.324 -28.773
  350    HB3  ARG  48           HB3      ARG  48  14.192  11.901 -28.984
  351    HG2  ARG  48           HG2      ARG  48  13.880  10.028 -27.345
  352    HG3  ARG  48           HG3      ARG  48  12.153  10.393 -27.287
  353    HD2  ARG  48           HD2      ARG  48  13.688   9.699 -29.828
  354    HD3  ARG  48           HD3      ARG  48  12.820   8.528 -28.852
  355    HE   ARG  48           HE       ARG  48  11.584  10.787 -30.397
  356   HH11  ARG  48          HH11      ARG  48  11.095   7.627 -28.870
  357   HH12  ARG  48          HH12      ARG  48   9.511   7.495 -29.646
  358   HH21  ARG  48          HH21      ARG  48   9.481  10.414 -31.218
  359   HH22  ARG  48          HH22      ARG  48   8.730   8.869 -30.814
  360    H    ILE  49           H        ILE  49  15.955  14.019 -27.515
  361    HA   ILE  49           HA       ILE  49  14.894  16.712 -28.016
  362    HB   ILE  49           HB       ILE  49  17.637  15.655 -28.790
  363   HG12  ILE  49          HG12      ILE  49  17.346  15.072 -26.472
  364   HG13  ILE  49          HG13      ILE  49  18.523  16.363 -26.648
  365   HG21  ILE  49          HG21      ILE  49  17.133  17.832 -29.737
  366   HG22  ILE  49          HG22      ILE  49  16.555  18.444 -28.177
  367   HG23  ILE  49          HG23      ILE  49  18.272  18.063 -28.405
  368   HD11  ILE  49          HD11      ILE  49  16.834  18.021 -25.863
  369   HD12  ILE  49          HD12      ILE  49  15.644  16.706 -25.688
  370   HD13  ILE  49          HD13      ILE  49  17.100  16.727 -24.684
  371    H    MET  50           H        MET  50  14.229  17.534 -29.972
  372    HA   MET  50           HA       MET  50  14.723  15.928 -32.431
  373    HB2  MET  50           HB2      MET  50  12.006  16.980 -31.559
  374    HB3  MET  50           HB3      MET  50  12.397  16.242 -33.116
  375    HG2  MET  50           HG2      MET  50  13.298  14.359 -31.249
  376    HG3  MET  50           HG3      MET  50  11.817  14.966 -30.534
  377    HE1  MET  50           HE1      MET  50   9.214  14.041 -33.435
  378    HE2  MET  50           HE2      MET  50   9.372  14.722 -31.805
  379    HE3  MET  50           HE3      MET  50  10.052  15.590 -33.197
  380    H    VAL  51           H        VAL  51  14.668  16.991 -34.340
  381    HA   VAL  51           HA       VAL  51  14.840  19.967 -34.278
  382    HB   VAL  51           HB       VAL  51  17.027  19.777 -35.510
  383   HG11  VAL  51          HG11      VAL  51  17.093  18.576 -32.720
  384   HG12  VAL  51          HG12      VAL  51  18.386  19.460 -33.549
  385   HG13  VAL  51          HG13      VAL  51  16.896  20.299 -33.094
  386   HG21  VAL  51          HG21      VAL  51  17.025  16.878 -34.575
  387   HG22  VAL  51          HG22      VAL  51  16.867  17.412 -36.259
  388   HG23  VAL  51          HG23      VAL  51  18.356  17.746 -35.362
  389    HA   PRO  52           HA       PRO  52  13.201  19.845 -38.444
  390    HB2  PRO  52           HB2      PRO  52  15.383  21.740 -39.273
  391    HB3  PRO  52           HB3      PRO  52  13.607  21.893 -39.463
  392    HG2  PRO  52           HG2      PRO  52  14.912  23.315 -37.559
  393    HG3  PRO  52           HG3      PRO  52  13.332  22.545 -37.198
  394    HD2  PRO  52           HD2      PRO  52  16.091  21.545 -36.520
  395    HD3  PRO  52           HD3      PRO  52  14.630  21.659 -35.490
  396    H    GLY  53           H        GLY  53  16.630  19.266 -37.984
  397    HA2  GLY  53           HA2      GLY  53  17.960  17.550 -38.699
  398    HA3  GLY  53           HA3      GLY  53  16.584  16.903 -39.584
  399    H    LYS  54           H        LYS  54  16.055  18.568 -41.534
  400    HA   LYS  54           HA       LYS  54  18.541  18.965 -43.168
  401    HB2  LYS  54           HB2      LYS  54  17.732  16.629 -43.394
  402    HB3  LYS  54           HB3      LYS  54  16.158  17.222 -43.940
  403    HG2  LYS  54           HG2      LYS  54  17.181  18.197 -45.946
  404    HG3  LYS  54           HG3      LYS  54  18.804  17.774 -45.360
  405    HD2  LYS  54           HD2      LYS  54  18.246  15.378 -45.527
  406    HD3  LYS  54           HD3      LYS  54  16.588  15.784 -46.032
  407    HE2  LYS  54           HE2      LYS  54  17.486  16.993 -48.006
  408    HE3  LYS  54           HE3      LYS  54  19.133  16.596 -47.511
  409    HZ1  LYS  54           HZ1      LYS  54  18.580  14.232 -47.799
  410    HZ2  LYS  54           HZ2      LYS  54  17.057  14.599 -48.258
  411    HZ3  LYS  54           HZ3      LYS  54  18.318  15.036 -49.189
  412    H    THR  55           H        THR  55  15.218  19.930 -42.571
  413    HA   THR  55           HA       THR  55  15.461  21.925 -44.775
  414    HB   THR  55           HB       THR  55  14.099  20.345 -45.729
  415    HG1  THR  55           HG1      THR  55  12.326  21.573 -46.062
  416   HG21  THR  55          HG21      THR  55  11.998  19.492 -44.829
  417   HG22  THR  55          HG22      THR  55  13.333  19.007 -43.784
  418   HG23  THR  55          HG23      THR  55  12.265  20.339 -43.295
  419    HA   PRO  56           HA       PRO  56  13.831  24.674 -41.537
  420    HB2  PRO  56           HB2      PRO  56  14.660  27.027 -42.547
  421    HB3  PRO  56           HB3      PRO  56  15.850  25.840 -41.928
  422    HG2  PRO  56           HG2      PRO  56  15.010  26.287 -44.813
  423    HG3  PRO  56           HG3      PRO  56  16.672  26.212 -44.146
  424    HD2  PRO  56           HD2      PRO  56  15.364  24.045 -45.266
  425    HD3  PRO  56           HD3      PRO  56  16.599  23.880 -43.983
  426    H    SER  57           H        SER  57  12.823  23.949 -44.658
  427    HA   SER  57           HA       SER  57  10.823  26.147 -44.915
  428    HB2  SER  57           HB2      SER  57  11.978  24.240 -46.980
  429    HB3  SER  57           HB3      SER  57  10.856  25.572 -47.308
  430    HG   SER  57           HG       SER  57  12.436  27.031 -46.614
  431    H    ALA  58           H        ALA  58  10.885  22.887 -43.996
  432    HA   ALA  58           HA       ALA  58   7.939  22.772 -44.248
  433    HB1  ALA  58           HB1      ALA  58   8.800  21.494 -46.184
  434    HB2  ALA  58           HB2      ALA  58   9.808  20.512 -45.098
  435    HB3  ALA  58           HB3      ALA  58   8.037  20.417 -44.999
  436    H    TRP  59           H        TRP  59   6.944  21.672 -42.605
  437    HA   TRP  59           HA       TRP  59   7.902  21.987 -40.055
  438    HB2  TRP  59           HB2      TRP  59   5.573  21.787 -40.639
  439    HB3  TRP  59           HB3      TRP  59   5.785  20.131 -41.178
  440    HD1  TRP  59           HD1      TRP  59   4.869  18.428 -39.621
  441    HE1  TRP  59           HE1      TRP  59   4.206  18.287 -37.150
  442    HE3  TRP  59           HE3      TRP  59   6.734  22.931 -38.017
  443    HZ2  TRP  59           HZ2      TRP  59   4.383  19.942 -34.796
  444    HZ3  TRP  59           HZ3      TRP  59   6.484  23.607 -35.641
  445    HH2  TRP  59           HH2      TRP  59   5.300  22.135 -34.027
  446    H    ARG  60           H        ARG  60   8.204  19.050 -41.935
  447    HA   ARG  60           HA       ARG  60   8.426  16.932 -40.465
  448    HB2  ARG  60           HB2      ARG  60   8.948  17.031 -42.849
  449    HB3  ARG  60           HB3      ARG  60  10.538  17.705 -42.508
  450    HG2  ARG  60           HG2      ARG  60  10.596  15.310 -43.087
  451    HG3  ARG  60           HG3      ARG  60  11.277  15.605 -41.489
  452    HD2  ARG  60           HD2      ARG  60   9.348  14.710 -40.382
  453    HD3  ARG  60           HD3      ARG  60   8.383  14.782 -41.858
  454    HE   ARG  60           HE       ARG  60   9.628  12.949 -42.794
  455   HH11  ARG  60          HH11      ARG  60  10.390  13.294 -39.346
  456   HH12  ARG  60          HH12      ARG  60  10.684  11.585 -39.214
  457   HH21  ARG  60          HH21      ARG  60  10.155  10.852 -42.501
  458   HH22  ARG  60          HH22      ARG  60  10.637  10.278 -40.936
  459    H    TRP  61           H        TRP  61   8.877  16.983 -38.366
  460    HA   TRP  61           HA       TRP  61  11.491  17.635 -37.256
  461    HB2  TRP  61           HB2      TRP  61   9.077  16.114 -36.182
  462    HB3  TRP  61           HB3      TRP  61  10.513  16.508 -35.244
  463    HD1  TRP  61           HD1      TRP  61   7.317  18.067 -36.521
  464    HE1  TRP  61           HE1      TRP  61   7.110  20.475 -35.651
  465    HE3  TRP  61           HE3      TRP  61  11.992  18.595 -34.541
  466    HZ2  TRP  61           HZ2      TRP  61   8.749  22.367 -34.197
  467    HZ3  TRP  61           HZ3      TRP  61  12.648  20.702 -33.412
  468    HH2  TRP  61           HH2      TRP  61  11.043  22.578 -33.224
  469    H    VAL  62           H        VAL  62  13.004  16.206 -36.413
  470    HA   VAL  62           HA       VAL  62  12.659  13.285 -36.724
  471    HB   VAL  62           HB       VAL  62  15.008  13.044 -37.496
  472   HG11  VAL  62          HG11      VAL  62  14.652  13.517 -39.839
  473   HG12  VAL  62          HG12      VAL  62  13.143  12.932 -39.122
  474   HG13  VAL  62          HG13      VAL  62  13.355  14.665 -39.464
  475   HG21  VAL  62          HG21      VAL  62  15.934  15.247 -36.837
  476   HG22  VAL  62          HG22      VAL  62  16.218  14.877 -38.538
  477   HG23  VAL  62          HG23      VAL  62  14.942  16.029 -38.087
  478    HA   PRO  63           HA       PRO  63  14.660  13.494 -32.670
  479    HB2  PRO  63           HB2      PRO  63  15.750  10.993 -32.435
  480    HB3  PRO  63           HB3      PRO  63  13.997  11.319 -32.277
  481    HG2  PRO  63           HG2      PRO  63  15.495  10.342 -34.726
  482    HG3  PRO  63           HG3      PRO  63  13.977   9.695 -34.026
  483    HD2  PRO  63           HD2      PRO  63  13.986  11.425 -36.132
  484    HD3  PRO  63           HD3      PRO  63  12.714  11.497 -34.877
  485    H    LEU  64           H        LEU  64  16.699  13.989 -31.899
  486    HA   LEU  64           HA       LEU  64  18.402  15.155 -33.721
  487    HB2  LEU  64           HB2      LEU  64  18.148  15.876 -31.442
  488    HB3  LEU  64           HB3      LEU  64  18.854  14.387 -30.821
  489    HG   LEU  64           HG       LEU  64  21.054  15.007 -31.800
  490   HD11  LEU  64          HD11      LEU  64  19.636  17.590 -32.585
  491   HD12  LEU  64          HD12      LEU  64  21.391  17.314 -32.636
  492   HD13  LEU  64          HD13      LEU  64  20.329  16.397 -33.707
  493   HD21  LEU  64          HD21      LEU  64  19.809  17.203 -30.101
  494   HD22  LEU  64          HD22      LEU  64  20.454  15.660 -29.492
  495   HD23  LEU  64          HD23      LEU  64  21.541  16.836 -30.250
  496    H    GLN  65           H        GLN  65  19.698  12.557 -31.654
  497    HA   GLN  65           HA       GLN  65  21.282  11.016 -31.865
  498    HB2  GLN  65           HB2      GLN  65  19.411  10.349 -34.151
  499    HB3  GLN  65           HB3      GLN  65  20.577   9.215 -33.462
  500    HG2  GLN  65           HG2      GLN  65  19.527   9.525 -31.207
  501    HG3  GLN  65           HG3      GLN  65  18.274  10.519 -31.956
  502   HE21  GLN  65          HE21      GLN  65  19.294   7.254 -31.287
  503   HE22  GLN  65          HE22      GLN  65  17.988   6.483 -32.182
  504    H    GLU  66           H        GLU  66  21.801  13.275 -34.213
  505    HA   GLU  66           HA       GLU  66  23.477  12.128 -36.083
  506    HB2  GLU  66           HB2      GLU  66  24.375  14.401 -36.403
  507    HB3  GLU  66           HB3      GLU  66  22.618  14.370 -36.235
  508    HG2  GLU  66           HG2      GLU  66  22.828  15.106 -33.862
  509    HG3  GLU  66           HG3      GLU  66  24.586  15.109 -34.023
  510    H    ASP  67           H        ASP  67  24.302  12.618 -32.792
  511    HA   ASP  67           HA       ASP  67  26.786  11.108 -33.127
  512    HB2  ASP  67           HB2      ASP  67  27.600  13.442 -33.366
  513    HB3  ASP  67           HB3      ASP  67  26.839  13.872 -31.836
  514    H    ALA  68           H        ALA  68  24.644  12.899 -30.916
  515    HA   ALA  68           HA       ALA  68  24.926  11.207 -28.616
  516    HB1  ALA  68           HB1      ALA  68  22.948  12.542 -27.865
  517    HB2  ALA  68           HB2      ALA  68  24.225  13.566 -28.534
  518    HB3  ALA  68           HB3      ALA  68  22.780  13.200 -29.501
  519    H    ALA  69           H        ALA  69  24.610   9.398 -30.685
  520    HA   ALA  69           HA       ALA  69  22.126   8.726 -31.642
  521    HB1  ALA  69           HB1      ALA  69  23.109   6.527 -32.134
  522    HB2  ALA  69           HB2      ALA  69  24.262   7.837 -32.447
  523    HB3  ALA  69           HB3      ALA  69  24.420   6.845 -30.977
  524    H    ASP  70           H        ASP  70  23.300   7.745 -28.456
  525    HA   ASP  70           HA       ASP  70  20.506   6.996 -27.775
  526    HB2  ASP  70           HB2      ASP  70  21.872   4.926 -28.156
  527    HB3  ASP  70           HB3      ASP  70  22.920   5.420 -26.824
  528    H    GLU  71           H        GLU  71  22.162   9.399 -27.458
  529    HA   GLU  71           HA       GLU  71  21.745   9.832 -24.517
  530    HB2  GLU  71           HB2      GLU  71  23.869  11.066 -26.309
  531    HB3  GLU  71           HB3      GLU  71  23.495  11.600 -24.666
  532    HG2  GLU  71           HG2      GLU  71  24.055   9.330 -23.809
  533    HG3  GLU  71           HG3      GLU  71  24.493   8.827 -25.443
  534    H    SER  72           H        SER  72  20.740  10.572 -27.655
  535    HA   SER  72           HA       SER  72  19.565  13.186 -27.248
  536    HB2  SER  72           HB2      SER  72  18.773  10.937 -29.147
  537    HB3  SER  72           HB3      SER  72  18.223  12.618 -29.236
  538    HG   SER  72           HG       SER  72  20.904  11.693 -29.478
  539    H    GLN  73           H        GLN  73  18.861  10.376 -25.589
  540    HA   GLN  73           HA       GLN  73  16.071  11.154 -25.085
  541    HB2  GLN  73           HB2      GLN  73  15.193   8.962 -25.420
  542    HB3  GLN  73           HB3      GLN  73  16.040   9.450 -26.889
  543    HG2  GLN  73           HG2      GLN  73  17.969   8.022 -26.261
  544    HG3  GLN  73           HG3      GLN  73  17.140   7.543 -24.774
  545   HE21  GLN  73          HE22      GLN  73  17.960   5.514 -26.517
  546   HE22  GLN  73          HE21      GLN  73  16.501   4.849 -27.250
  547    H    ASN  74           H        ASN  74  15.104   9.860 -23.252
  548    HA   ASN  74           HA       ASN  74  16.394  10.649 -21.013
  549    HB2  ASN  74           HB2      ASN  74  13.976  10.128 -21.188
  550    HB3  ASN  74           HB3      ASN  74  14.365   8.416 -20.944
  551   HD21  ASN  74          HD22      ASN  74  12.990   8.579 -18.899
  552   HD22  ASN  74          HD21      ASN  74  13.758   9.298 -17.487
  553    H    ASP  75           H        ASP  75  18.073  10.281 -19.996
  554    HA   ASP  75           HA       ASP  75  18.611   7.621 -18.851
  555    HB2  ASP  75           HB2      ASP  75  20.879   7.606 -19.344
  556    HB3  ASP  75           HB3      ASP  75  20.141   8.072 -20.867
  557    H    TRP  76           H        TRP  76  17.537  10.514 -18.117
  558    HA   TRP  76           HA       TRP  76  19.434  11.477 -16.094
  559    HB2  TRP  76           HB2      TRP  76  16.604  12.333 -16.823
  560    HB3  TRP  76           HB3      TRP  76  17.645  13.164 -15.683
  561    HD1  TRP  76           HD1      TRP  76  20.254  12.725 -17.816
  562    HE1  TRP  76           HE1      TRP  76  20.485  14.416 -19.710
  563    HE3  TRP  76           HE3      TRP  76  15.479  14.608 -17.824
  564    HZ2  TRP  76           HZ2      TRP  76  18.815  16.295 -21.109
  565    HZ3  TRP  76           HZ3      TRP  76  14.810  16.274 -19.521
  566    HH2  TRP  76           HH2      TRP  76  16.454  17.114 -21.179
  567    H    ASP  77           H        ASP  77  16.840   9.189 -16.092
  568    HA   ASP  77           HA       ASP  77  17.062   8.927 -13.175
  569    HB2  ASP  77           HB2      ASP  77  14.885   9.434 -12.637
  570    HB3  ASP  77           HB3      ASP  77  15.161  10.632 -13.886
  571    H    GLU  78           H        GLU  78  15.840   7.143 -12.290
  572    HA   GLU  78           HA       GLU  78  14.810   5.040 -14.046
  573    HB2  GLU  78           HB2      GLU  78  16.126   3.264 -12.981
  574    HB3  GLU  78           HB3      GLU  78  17.145   4.391 -13.861
  575    HG2  GLU  78           HG2      GLU  78  17.784   5.507 -11.729
  576    HG3  GLU  78           HG3      GLU  78  16.771   4.378 -10.834
  577    H    GLU  79           H        GLU  79  13.649   7.005 -12.313
  578    HA   GLU  79           HA       GLU  79  12.382   5.386 -10.146
  579    HB2  GLU  79           HB2      GLU  79  13.744   8.072  -9.697
  580    HB3  GLU  79           HB3      GLU  79  12.810   7.192  -8.500
  581    HG2  GLU  79           HG2      GLU  79  15.473   6.322  -9.678
  582    HG3  GLU  79           HG3      GLU  79  15.189   7.026  -8.094
  583    H    LEU  80           H        LEU  80  11.947   7.641 -12.660
  584    HA   LEU  80           HA       LEU  80   9.585   8.903 -11.356
  585    HB2  LEU  80           HB2      LEU  80  11.204   9.865 -13.736
  586    HB3  LEU  80           HB3      LEU  80   9.926  10.737 -12.913
  587    HG   LEU  80           HG       LEU  80  12.672  10.117 -11.744
  588   HD11  LEU  80          HD11      LEU  80  11.408  12.735 -12.610
  589   HD12  LEU  80          HD12      LEU  80  13.048  12.473 -11.966
  590   HD13  LEU  80          HD13      LEU  80  12.612  11.811 -13.538
  591   HD21  LEU  80          HD21      LEU  80  10.323  11.680 -10.587
  592   HD22  LEU  80          HD22      LEU  80  10.975  10.151  -9.952
  593   HD23  LEU  80          HD23      LEU  80  11.965  11.611  -9.911
  594    H    SER  81           H        SER  81   7.859   9.505 -12.614
  595    HA   SER  81           HA       SER  81   7.318   8.269 -15.272
  596    HB2  SER  81           HB2      SER  81   6.115   6.984 -13.521
  597    HB3  SER  81           HB3      SER  81   5.416   8.491 -12.892
  598    HG   SER  81           HG       SER  81   4.015   7.371 -14.352
  599    H    ILE  82           H        ILE  82   6.413   9.799 -16.685
  600    HA   ILE  82           HA       ILE  82   6.304  12.603 -15.638
  601    HB   ILE  82           HB       ILE  82   7.790  11.343 -17.897
  602   HG12  ILE  82          HG12      ILE  82   9.343  13.257 -17.472
  603   HG13  ILE  82          HG13      ILE  82   8.249  13.866 -16.234
  604   HG21  ILE  82          HG21      ILE  82   6.281  12.701 -19.230
  605   HG22  ILE  82          HG22      ILE  82   6.624  14.133 -18.219
  606   HG23  ILE  82          HG23      ILE  82   7.891  13.401 -19.218
  607   HD11  ILE  82          HD11      ILE  82   9.628  11.145 -16.124
  608   HD12  ILE  82          HD12      ILE  82  10.268  12.628 -15.394
  609   HD13  ILE  82          HD13      ILE  82   8.738  11.960 -14.808
  610    H    HIS  83           H        HIS  83   4.812  13.971 -16.332
  611    HA   HIS  83           HA       HIS  83   2.829  13.201 -18.415
  612    HB2  HIS  83           HB2      HIS  83   2.127  14.382 -15.690
  613    HB3  HIS  83           HB3      HIS  83   1.000  14.055 -17.001
  614    HD1  HIS  83           HD1      HIS  83   0.346  11.420 -17.379
  615    HD2  HIS  83           HD2      HIS  83   2.885  12.324 -14.146
  616    HE1  HIS  83           HE1      HIS  83   0.399   9.340 -15.908
  617    H    LEU  84           H        LEU  84   1.766  15.147 -19.351
  618    HA   LEU  84           HA       LEU  84   2.569  17.762 -18.446
  619    HB2  LEU  84           HB2      LEU  84   3.573  18.524 -20.600
  620    HB3  LEU  84           HB3      LEU  84   4.561  17.467 -19.626
  621    HG   LEU  84           HG       LEU  84   4.204  15.599 -21.159
  622   HD11  LEU  84          HD11      LEU  84   1.979  16.011 -22.055
  623   HD12  LEU  84          HD12      LEU  84   2.498  17.569 -22.734
  624   HD13  LEU  84          HD13      LEU  84   3.134  16.039 -23.385
  625   HD21  LEU  84          HD21      LEU  84   5.412  16.593 -23.079
  626   HD22  LEU  84          HD22      LEU  84   4.976  18.219 -22.526
  627   HD23  LEU  84          HD23      LEU  84   6.044  17.194 -21.541
  628    H    GLN  85           H        GLN  85   1.695  19.521 -19.814
  629    HA   GLN  85           HA       GLN  85  -0.560  18.987 -21.574
  630    HB2  GLN  85           HB2      GLN  85  -2.206  20.210 -20.142
  631    HB3  GLN  85           HB3      GLN  85  -1.781  18.622 -19.557
  632    HG2  GLN  85           HG2      GLN  85  -0.513  21.170 -18.479
  633    HG3  GLN  85           HG3      GLN  85  -2.020  20.520 -17.854
  634   HE21  GLN  85          HE22      GLN  85   1.069  20.714 -16.949
  635   HE22  GLN  85          HE21      GLN  85   1.216  19.165 -16.117
  636    HA   PRO  86           HA       PRO  86  -2.466  20.685 -22.230
  637    HB2  PRO  86           HB2      PRO  86  -2.927  22.107 -24.482
  638    HB3  PRO  86           HB3      PRO  86  -2.961  22.862 -22.861
  639    HG2  PRO  86           HG2      PRO  86  -0.649  22.819 -24.835
  640    HG3  PRO  86           HG3      PRO  86  -1.362  24.240 -24.003
  641    HD2  PRO  86           HD2      PRO  86   0.845  22.957 -23.042
  642    HD3  PRO  86           HD3      PRO  86  -0.387  23.643 -21.945
  643    H    PHE  87           H        PHE  87   0.515  20.345 -23.952
  644    HA   PHE  87           HA       PHE  87  -0.328  18.621 -26.101
  645    HB2  PHE  87           HB2      PHE  87   2.339  18.860 -24.646
  646    HB3  PHE  87           HB3      PHE  87   2.071  18.084 -26.199
  647    HD1  PHE  87           HD2      PHE  87   1.520  19.420 -28.227
  648    HD2  PHE  87           HD1      PHE  87   2.496  21.296 -24.464
  649    HE1  PHE  87           HE2      PHE  87   1.901  21.580 -29.394
  650    HE2  PHE  87           HE1      PHE  87   2.855  23.454 -25.633
  651    HZ   PHE  87           HZ       PHE  87   2.564  23.595 -28.099
  652    H    LYS  88           H        LYS  88   0.880  16.270 -25.999
  653    HA   LYS  88           HA       LYS  88   0.073  14.906 -23.489
  654    HB2  LYS  88           HB2      LYS  88  -1.140  13.153 -24.897
  655    HB3  LYS  88           HB3      LYS  88  -1.915  14.683 -24.561
  656    HG2  LYS  88           HG2      LYS  88  -2.449  14.046 -26.767
  657    HG3  LYS  88           HG3      LYS  88  -1.454  15.489 -26.850
  658    HD2  LYS  88           HD2      LYS  88   0.462  14.185 -27.634
  659    HD3  LYS  88           HD3      LYS  88  -0.404  12.662 -27.306
  660    HE2  LYS  88           HE2      LYS  88  -2.144  13.401 -28.979
  661    HE3  LYS  88           HE3      LYS  88  -1.137  14.803 -29.359
  662    HZ1  LYS  88           HZ1      LYS  88  -0.303  11.959 -29.667
  663    HZ2  LYS  88           HZ2      LYS  88  -0.763  12.937 -30.900
  664    HZ3  LYS  88           HZ3      LYS  88   0.620  13.237 -30.087
  665    HA   PRO  89           HA       PRO  89   3.723  12.486 -24.193
  666    HB2  PRO  89           HB2      PRO  89   3.257  10.347 -22.527
  667    HB3  PRO  89           HB3      PRO  89   3.718  11.978 -21.943
  668    HG2  PRO  89           HG2      PRO  89   0.956  10.747 -22.109
  669    HG3  PRO  89           HG3      PRO  89   1.687  11.661 -20.752
  670    HD2  PRO  89           HD2      PRO  89  -0.007  12.811 -22.563
  671    HD3  PRO  89           HD3      PRO  89   1.354  13.716 -21.836
  672    H    ASP  90           H        ASP  90   4.246  11.077 -25.811
  673    HA   ASP  90           HA       ASP  90   2.410   8.979 -26.769
  674    HB2  ASP  90           HB2      ASP  90   1.711  11.477 -27.511
  675    HB3  ASP  90           HB3      ASP  90   2.967  11.245 -28.697
  676    H    ASP  91           H        ASP  91   3.402   8.988 -29.421
  677    HA   ASP  91           HA       ASP  91   6.361   8.940 -29.372
  678    HB2  ASP  91           HB2      ASP  91   5.492   6.613 -29.015
  679    HB3  ASP  91           HB3      ASP  91   4.676   6.722 -30.580
  680    H    SER  92           H        SER  92   4.364  10.848 -30.267
  681    HA   SER  92           HA       SER  92   3.578  10.717 -32.945
  682    HB2  SER  92           HB2      SER  92   4.057  13.137 -31.154
  683    HB3  SER  92           HB3      SER  92   3.132  13.158 -32.666
  684    HG   SER  92           HG       SER  92   1.755  11.553 -31.723
  685    H    ASN  93           H        ASN  93   4.105  11.939 -34.780
  686    HA   ASN  93           HA       ASN  93   6.896  12.164 -35.461
  687    HB2  ASN  93           HB2      ASN  93   6.061  12.743 -37.665
  688    HB3  ASN  93           HB3      ASN  93   5.134  11.400 -37.018
  689   HD21  ASN  93          HD22      ASN  93   5.050  14.942 -37.497
  690   HD22  ASN  93          HD21      ASN  93   3.294  15.019 -37.660
  691    H    GLN  94           H        GLN  94   5.939  14.053 -33.307
  692    HA   GLN  94           HA       GLN  94   7.342  16.426 -34.202
  693    HB2  GLN  94           HB2      GLN  94   5.608  18.029 -33.664
  694    HB3  GLN  94           HB3      GLN  94   4.994  16.956 -34.905
  695    HG2  GLN  94           HG2      GLN  94   3.513  15.869 -33.385
  696    HG3  GLN  94           HG3      GLN  94   4.372  16.451 -31.959
  697   HE21  GLN  94          HE22      GLN  94   4.101  18.587 -31.199
  698   HE22  GLN  94          HE21      GLN  94   2.766  19.577 -31.792
  699    HA   PRO  95           HA       PRO  95   8.159  16.351 -29.748
  700    HB2  PRO  95           HB2      PRO  95   8.852  18.918 -29.197
  701    HB3  PRO  95           HB3      PRO  95   9.876  17.862 -30.217
  702    HG2  PRO  95           HG2      PRO  95   7.775  19.862 -31.141
  703    HG3  PRO  95           HG3      PRO  95   9.496  19.770 -31.659
  704    HD2  PRO  95           HD2      PRO  95   7.551  18.622 -33.101
  705    HD3  PRO  95           HD3      PRO  95   9.105  17.773 -32.864
  706    H    GLN  96           H        GLN  96   7.468  17.395 -27.677
  707    HA   GLN  96           HA       GLN  96   4.692  18.526 -27.729
  708    HB2  GLN  96           HB2      GLN  96   6.161  16.842 -25.659
  709    HB3  GLN  96           HB3      GLN  96   4.714  17.765 -25.297
  710    HG2  GLN  96           HG2      GLN  96   3.862  15.688 -25.666
  711    HG3  GLN  96           HG3      GLN  96   3.533  16.499 -27.191
  712   HE21  GLN  96          HE22      GLN  96   3.361  13.790 -27.210
  713   HE22  GLN  96          HE21      GLN  96   4.797  13.108 -28.001
  714    H    VAL  97           H        VAL  97   7.980  19.304 -27.054
  715    HA   VAL  97           HA       VAL  97   7.067  21.975 -26.038
  716    HB   VAL  97           HB       VAL  97   9.701  20.605 -25.356
  717   HG11  VAL  97          HG11      VAL  97   9.897  22.501 -23.724
  718   HG12  VAL  97          HG12      VAL  97   9.931  23.047 -25.397
  719   HG13  VAL  97          HG13      VAL  97   8.445  23.234 -24.438
  720   HG21  VAL  97          HG21      VAL  97   7.877  19.492 -24.143
  721   HG22  VAL  97          HG22      VAL  97   8.808  20.502 -23.039
  722   HG23  VAL  97          HG23      VAL  97   7.230  21.065 -23.638
  723    H    VAL  98           H        VAL  98   7.931  23.735 -27.106
  724    HA   VAL  98           HA       VAL  98   9.820  23.278 -29.367
  725    HB   VAL  98           HB       VAL  98   7.169  24.764 -29.558
  726   HG11  VAL  98          HG11      VAL  98   9.374  24.325 -31.623
  727   HG12  VAL  98          HG12      VAL  98   7.763  24.983 -31.978
  728   HG13  VAL  98          HG13      VAL  98   8.857  25.889 -30.940
  729   HG21  VAL  98          HG21      VAL  98   6.623  23.050 -31.280
  730   HG22  VAL  98          HG22      VAL  98   8.140  22.205 -30.903
  731   HG23  VAL  98          HG23      VAL  98   6.843  22.320 -29.691
  732    H    ILE  99           H        ILE  99  11.212  24.858 -29.723
  733    HA   ILE  99           HA       ILE  99  11.301  27.210 -27.878
  734    HB   ILE  99           HB       ILE  99  13.608  25.433 -28.804
  735   HG12  ILE  99          HG12      ILE  99  13.785  25.017 -26.235
  736   HG13  ILE  99          HG13      ILE  99  12.081  25.431 -26.179
  737   HG21  ILE  99          HG21      ILE  99  14.231  27.801 -28.387
  738   HG22  ILE  99          HG22      ILE  99  13.489  27.715 -26.779
  739   HG23  ILE  99          HG23      ILE  99  14.901  26.716 -27.186
  740   HD11  ILE  99          HD11      ILE  99  11.527  23.471 -27.522
  741   HD12  ILE  99          HD12      ILE  99  13.232  23.212 -27.934
  742   HD13  ILE  99          HD13      ILE  99  12.655  22.954 -26.280
  743    H    LEU 100           H        LEU 100  11.400  29.062 -28.904
  744    HA   LEU 100           HA       LEU 100  11.769  29.324 -31.786
  745    HB2  LEU 100           HB2      LEU 100  11.366  31.269 -29.477
  746    HB3  LEU 100           HB3      LEU 100  11.615  31.821 -31.107
  747    HG   LEU 100           HG       LEU 100   9.292  31.900 -30.385
  748   HD11  LEU 100          HD11      LEU 100   9.897  31.768 -32.785
  749   HD12  LEU 100          HD12      LEU 100   9.725  29.999 -32.723
  750   HD13  LEU 100          HD13      LEU 100   8.319  31.041 -32.448
  751   HD21  LEU 100          HD21      LEU 100   9.215  28.865 -30.571
  752   HD22  LEU 100          HD22      LEU 100   9.123  29.805 -29.061
  753   HD23  LEU 100          HD23      LEU 100   7.855  29.963 -30.282
  754    H    ALA 101           H        ALA 101  13.366  30.470 -32.818
  755    HA   ALA 101           HA       ALA 101  16.083  30.336 -32.037
  756    HB1  ALA 101           HB1      ALA 101  15.330  30.564 -34.362
  757    HB2  ALA 101           HB2      ALA 101  14.660  32.176 -34.015
  758    HB3  ALA 101           HB3      ALA 101  16.408  31.916 -33.949
  759    H    ASP 102           H        ASP 102  13.716  32.830 -31.326
  760    HA   ASP 102           HA       ASP 102  15.614  34.836 -30.393
  761    HB2  ASP 102           HB2      ASP 102  13.442  35.332 -31.493
  762    HB3  ASP 102           HB3      ASP 102  12.591  34.574 -30.150
  763    H    GLY 103           H        GLY 103  14.436  31.965 -28.955
  764    HA2  GLY 103           HA2      GLY 103  14.973  31.193 -26.832
  765    HA3  GLY 103           HA3      GLY 103  15.215  32.836 -26.235
  766    H    GLN 104           H        GLN 104  12.230  32.576 -27.912
  767    HA   GLN 104           HA       GLN 104  10.634  32.570 -25.455
  768    HB2  GLN 104           HB2      GLN 104   9.617  32.318 -28.292
  769    HB3  GLN 104           HB3      GLN 104   8.722  32.809 -26.877
  770    HG2  GLN 104           HG2      GLN 104  10.861  34.386 -28.343
  771    HG3  GLN 104           HG3      GLN 104   9.138  34.724 -28.296
  772   HE21  GLN 104          HE22      GLN 104  11.769  36.139 -27.329
  773   HE22  GLN 104          HE21      GLN 104  11.324  36.655 -25.697
  774    H    ILE 105           H        ILE 105   9.126  30.914 -25.027
  775    HA   ILE 105           HA       ILE 105   9.720  28.210 -26.176
  776    HB   ILE 105           HB       ILE 105   9.121  28.536 -23.243
  777   HG12  ILE 105          HG12      ILE 105  11.115  29.917 -23.466
  778   HG13  ILE 105          HG13      ILE 105  11.389  28.462 -22.532
  779   HG21  ILE 105          HG21      ILE 105  10.376  26.354 -23.163
  780   HG22  ILE 105          HG22      ILE 105   8.919  26.309 -24.170
  781   HG23  ILE 105          HG23      ILE 105  10.519  26.434 -24.933
  782   HD11  ILE 105          HD11      ILE 105  12.598  27.448 -24.432
  783   HD12  ILE 105          HD12      ILE 105  12.278  28.917 -25.391
  784   HD13  ILE 105          HD13      ILE 105  13.284  29.010 -23.954
  785    H    THR 106           H        THR 106   7.902  26.962 -26.541
  786    HA   THR 106           HA       THR 106   5.367  28.190 -26.655
  787    HB   THR 106           HB       THR 106   6.080  26.173 -27.912
  788    HG1  THR 106           HG1      THR 106   4.003  25.491 -28.039
  789   HG21  THR 106          HG21      THR 106   5.736  23.957 -27.085
  790   HG22  THR 106          HG22      THR 106   6.859  24.763 -25.959
  791   HG23  THR 106          HG23      THR 106   5.154  24.543 -25.519
  792    HA   PRO 107           HA       PRO 107   4.114  27.970 -22.305
  793    HB2  PRO 107           HB2      PRO 107   1.307  28.104 -23.385
  794    HB3  PRO 107           HB3      PRO 107   2.077  29.057 -22.081
  795    HG2  PRO 107           HG2      PRO 107   1.694  30.124 -24.559
  796    HG3  PRO 107           HG3      PRO 107   3.211  30.435 -23.655
  797    HD2  PRO 107           HD2      PRO 107   2.730  28.425 -25.873
  798    HD3  PRO 107           HD3      PRO 107   4.099  29.558 -25.635
  799    H    PHE 108           H        PHE 108   4.282  26.048 -21.290
  800    HA   PHE 108           HA       PHE 108   2.118  24.112 -21.383
  801    HB2  PHE 108           HB2      PHE 108   3.262  22.233 -22.108
  802    HB3  PHE 108           HB3      PHE 108   3.847  23.435 -23.229
  803    HD1  PHE 108           HD1      PHE 108   6.130  24.611 -22.570
  804    HD2  PHE 108           HD2      PHE 108   4.786  20.864 -20.930
  805    HE1  PHE 108           HE1      PHE 108   8.439  24.108 -21.860
  806    HE2  PHE 108           HE2      PHE 108   7.117  20.349 -20.244
  807    HZ   PHE 108           HZ       PHE 108   8.931  21.982 -20.654
  808    H    SER 109           H        SER 109   2.651  22.256 -19.811
  809    HA   SER 109           HA       SER 109   4.591  22.939 -17.731
  810    HB2  SER 109           HB2      SER 109   2.914  22.437 -15.896
  811    HB3  SER 109           HB3      SER 109   2.738  23.995 -16.715
  812    HG   SER 109           HG       SER 109   1.150  23.001 -18.063
  813    H    LEU 110           H        LEU 110   5.144  21.166 -16.402
  814    HA   LEU 110           HA       LEU 110   4.641  18.439 -17.511
  815    HB2  LEU 110           HB2      LEU 110   6.512  18.857 -18.731
  816    HB3  LEU 110           HB3      LEU 110   7.019  20.199 -17.720
  817    HG   LEU 110           HG       LEU 110   7.982  18.588 -16.072
  818   HD11  LEU 110          HD11      LEU 110   6.761  16.482 -16.782
  819   HD12  LEU 110          HD12      LEU 110   7.576  16.572 -18.348
  820   HD13  LEU 110          HD13      LEU 110   8.512  16.297 -16.863
  821   HD21  LEU 110          HD21      LEU 110   9.339  19.768 -17.741
  822   HD22  LEU 110          HD22      LEU 110   9.971  18.144 -17.444
  823   HD23  LEU 110          HD23      LEU 110   9.043  18.475 -18.922
  824    H    LEU 111           H        LEU 111   4.630  16.867 -15.955
  825    HA   LEU 111           HA       LEU 111   5.319  17.616 -13.147
  826    HB2  LEU 111           HB2      LEU 111   2.949  17.823 -13.568
  827    HB3  LEU 111           HB3      LEU 111   2.855  16.219 -14.272
  828    HG   LEU 111           HG       LEU 111   3.900  16.465 -11.461
  829   HD11  LEU 111          HD11      LEU 111   0.951  16.690 -12.192
  830   HD12  LEU 111          HD12      LEU 111   1.595  16.444 -10.552
  831   HD13  LEU 111          HD13      LEU 111   1.954  17.942 -11.419
  832   HD21  LEU 111          HD21      LEU 111   2.641  14.335 -11.176
  833   HD22  LEU 111          HD22      LEU 111   1.990  14.489 -12.814
  834   HD23  LEU 111          HD23      LEU 111   3.722  14.209 -12.561
  835    H    MET 112           H        MET 112   6.233  16.087 -11.888
  836    HA   MET 112           HA       MET 112   7.094  13.511 -13.155
  837    HB2  MET 112           HB2      MET 112   8.597  15.355 -11.243
  838    HB3  MET 112           HB3      MET 112   9.154  13.769 -11.791
  839    HG2  MET 112           HG2      MET 112   9.189  14.574 -14.122
  840    HG3  MET 112           HG3      MET 112   8.630  16.165 -13.592
  841    HE1  MET 112           HE1      MET 112  12.304  16.868 -14.688
  842    HE2  MET 112           HE2      MET 112  11.222  15.656 -15.410
  843    HE3  MET 112           HE3      MET 112  10.585  17.250 -14.931
  844    H    ALA 113           H        ALA 113   6.534  11.753 -12.089
  845    HA   ALA 113           HA       ALA 113   5.660  11.883  -9.238
  846    HB1  ALA 113           HB1      ALA 113   3.933  10.247  -9.889
  847    HB2  ALA 113           HB2      ALA 113   3.752  11.782 -10.759
  848    HB3  ALA 113           HB3      ALA 113   4.453  10.368 -11.582
  849    H    ASN 114           H        ASN 114   6.148  10.150  -7.914
  850    HA   ASN 114           HA       ASN 114   8.420   8.493  -8.364
  851    HB2  ASN 114           HB2      ASN 114   7.786   8.932  -6.169
  852    HB3  ASN 114           HB3      ASN 114   6.097   8.579  -6.440
  853   HD21  ASN 114          HD22      ASN 114   7.529   7.696  -4.205
  854   HD22  ASN 114          HD21      ASN 114   7.510   5.929  -4.304
  855    H    ALA 115           H        ALA 115   8.693   6.749  -9.619
  856    HA   ALA 115           HA       ALA 115   6.781   5.836 -11.432
  857    HB1  ALA 115           HB1      ALA 115   9.188   5.702 -11.783
  858    HB2  ALA 115           HB2      ALA 115   9.350   4.501 -10.482
  859    HB3  ALA 115           HB3      ALA 115   8.475   4.098 -11.974
  860    H    GLY 116           H        GLY 116   6.895   4.804  -8.148
  861    HA2  GLY 116           HA2      GLY 116   5.502   2.208  -8.712
  862    HA3  GLY 116           HA3      GLY 116   6.287   2.689  -7.209
  863    H    THR 117           H        THR 117   5.201   5.142  -6.542
  864    HA   THR 117           HA       THR 117   2.503   4.403  -5.720
  865    HB   THR 117           HB       THR 117   2.565   6.632  -4.604
  866    HG1  THR 117           HG1      THR 117   4.578   7.714  -4.695
  867   HG21  THR 117          HG21      THR 117   4.314   6.196  -3.003
  868   HG22  THR 117          HG22      THR 117   3.601   4.641  -3.467
  869   HG23  THR 117          HG23      THR 117   5.169   5.144  -4.144
  870    H    GLY 118           H        GLY 118   3.874   6.496  -8.221
  871    HA2  GLY 118           HA2      GLY 118   2.858   7.720  -9.899
  872    HA3  GLY 118           HA3      GLY 118   1.259   7.192  -9.352
  873    H    GLU 119           H        GLU 119   3.136   8.434  -6.748
  874    HA   GLU 119           HA       GLU 119   1.450  10.796  -6.493
  875    HB2  GLU 119           HB2      GLU 119   2.128   9.255  -4.622
  876    HB3  GLU 119           HB3      GLU 119   3.792   9.834  -4.793
  877    HG2  GLU 119           HG2      GLU 119   3.049  12.128  -4.269
  878    HG3  GLU 119           HG3      GLU 119   1.374  11.572  -4.177
  879    HA   PRO 120           HA       PRO 120   4.445  13.434  -8.581
  880    HB2  PRO 120           HB2      PRO 120   3.607  15.923  -7.799
  881    HB3  PRO 120           HB3      PRO 120   2.758  14.913  -9.000
  882    HG2  PRO 120           HG2      PRO 120   2.139  15.188  -6.049
  883    HG3  PRO 120           HG3      PRO 120   1.003  15.278  -7.435
  884    HD2  PRO 120           HD2      PRO 120   1.322  13.001  -6.001
  885    HD3  PRO 120           HD3      PRO 120   1.097  12.937  -7.774
  886    H    LEU 121           H        LEU 121   6.416  14.311  -8.151
  887    HA   LEU 121           HA       LEU 121   7.120  15.010  -5.309
  888    HB2  LEU 121           HB2      LEU 121   9.323  14.711  -7.305
  889    HB3  LEU 121           HB3      LEU 121   9.309  14.470  -5.590
  890    HG   LEU 121           HG       LEU 121   9.841  12.395  -6.543
  891   HD11  LEU 121          HD11      LEU 121   6.887  11.959  -6.071
  892   HD12  LEU 121          HD12      LEU 121   8.279  10.926  -5.692
  893   HD13  LEU 121          HD13      LEU 121   7.996  12.381  -4.750
  894   HD21  LEU 121          HD21      LEU 121   9.089  13.053  -8.822
  895   HD22  LEU 121          HD22      LEU 121   8.870  11.352  -8.352
  896   HD23  LEU 121          HD23      LEU 121   7.485  12.466  -8.358
  897    H    LEU 122           H        LEU 122   7.281  15.994  -8.712
  898    HA   LEU 122           HA       LEU 122   7.794  18.813  -7.968
  899    HB2  LEU 122           HB2      LEU 122   9.864  17.011  -8.464
  900    HB3  LEU 122           HB3      LEU 122   9.646  17.710 -10.048
  901    HG   LEU 122           HG       LEU 122   9.919  19.491  -7.590
  902   HD11  LEU 122          HD11      LEU 122  11.792  17.896  -7.526
  903   HD12  LEU 122          HD12      LEU 122  12.186  18.290  -9.217
  904   HD13  LEU 122          HD13      LEU 122  12.347  19.523  -7.942
  905   HD21  LEU 122          HD21      LEU 122  10.862  19.881 -10.474
  906   HD22  LEU 122          HD22      LEU 122   9.375  20.572  -9.812
  907   HD23  LEU 122          HD23      LEU 122  10.918  21.069  -9.145
  908    H    THR 123           H        THR 123   7.444  20.294  -9.652
  909    HA   THR 123           HA       THR 123   6.361  19.341 -12.240
  910    HB   THR 123           HB       THR 123   4.829  21.271 -10.444
  911    HG1  THR 123           HG1      THR 123   4.813  18.529 -10.681
  912   HG21  THR 123          HG21      THR 123   2.982  20.952 -11.995
  913   HG22  THR 123          HG22      THR 123   4.368  21.588 -12.882
  914   HG23  THR 123          HG23      THR 123   3.951  19.857 -12.986
  915    H    LEU 124           H        LEU 124   6.543  20.806 -13.867
  916    HA   LEU 124           HA       LEU 124   8.122  23.289 -13.439
  917    HB2  LEU 124           HB2      LEU 124   8.496  20.943 -15.294
  918    HB3  LEU 124           HB3      LEU 124   8.711  22.537 -15.989
  919    HG   LEU 124           HG       LEU 124  10.380  23.108 -14.257
  920   HD11  LEU 124          HD11      LEU 124  11.416  21.376 -12.910
  921   HD12  LEU 124          HD12      LEU 124   9.722  21.463 -12.495
  922   HD13  LEU 124          HD13      LEU 124  10.288  20.141 -13.536
  923   HD21  LEU 124          HD21      LEU 124  12.189  21.759 -15.203
  924   HD22  LEU 124          HD22      LEU 124  11.006  20.609 -15.871
  925   HD23  LEU 124          HD23      LEU 124  11.061  22.287 -16.461
  926    H    VAL 125           H        VAL 125   7.576  25.025 -14.678
  927    HA   VAL 125           HA       VAL 125   5.052  24.928 -16.264
  928    HB   VAL 125           HB       VAL 125   5.469  26.897 -13.984
  929   HG11  VAL 125          HG11      VAL 125   3.015  26.207 -15.665
  930   HG12  VAL 125          HG12      VAL 125   3.038  27.324 -14.285
  931   HG13  VAL 125          HG13      VAL 125   3.949  27.718 -15.738
  932   HG21  VAL 125          HG21      VAL 125   5.153  24.721 -12.920
  933   HG22  VAL 125          HG22      VAL 125   3.696  25.682 -12.745
  934   HG23  VAL 125          HG23      VAL 125   3.748  24.380 -13.960
  935    H    CYS 126           H        CYS 126   4.910  26.337 -17.943
  936    HA   CYS 126           HA       CYS 126   7.076  28.383 -18.227
  937    HB2  CYS 126           HB2      CYS 126   6.976  26.348 -19.829
  938    HB3  CYS 126           HB3      CYS 126   5.486  27.056 -20.446
  939    HG   CYS 126           HG       CYS 126   8.541  28.359 -20.298
  940    H    SER 127           H        SER 127   6.590  30.373 -19.095
  941    HA   SER 127           HA       SER 127   3.721  31.187 -19.378
  942    HB2  SER 127           HB2      SER 127   5.945  32.778 -18.047
  943    HB3  SER 127           HB3      SER 127   4.266  33.301 -18.271
  944    HG   SER 127           HG       SER 127   4.647  32.450 -16.178
  945    H    GLY 128           H        GLY 128   6.335  30.697 -21.213
  946    HA2  GLY 128           HA2      GLY 128   5.864  31.416 -23.535
  947    HA3  GLY 128           HA3      GLY 128   5.854  33.080 -22.971
  948    H    SER 129           H        SER 129   8.392  32.091 -21.212
  949    HA   SER 129           HA       SER 129  10.422  32.175 -23.369
  950    HB2  SER 129           HB2      SER 129   9.596  34.533 -22.913
  951    HB3  SER 129           HB3      SER 129  10.289  34.376 -21.287
  952    HG   SER 129           HG       SER 129  11.755  35.313 -22.798
  953    H    TRP 130           H        TRP 130  12.582  32.034 -22.675
  954    HA   TRP 130           HA       TRP 130  13.177  29.996 -20.888
  955    HB2  TRP 130           HB2      TRP 130  14.601  30.536 -22.695
  956    HB3  TRP 130           HB3      TRP 130  14.758  32.209 -22.201
  957    HD1  TRP 130           HD1      TRP 130  16.756  32.880 -20.815
  958    HE1  TRP 130           HE1      TRP 130  18.649  31.693 -19.554
  959    HE3  TRP 130           HE3      TRP 130  15.148  28.045 -21.315
  960    HZ2  TRP 130           HZ2      TRP 130  19.402  28.980 -18.885
  961    HZ3  TRP 130           HZ3      TRP 130  16.454  26.195 -20.291
  962    HH2  TRP 130           HH2      TRP 130  18.570  26.647 -19.102
  963    HA   PRO 131           HA       PRO 131  13.722  28.891 -19.332
  964    HB2  PRO 131           HB2      PRO 131  14.495  28.007 -16.938
  965    HB3  PRO 131           HB3      PRO 131  15.669  28.800 -18.021
  966    HG2  PRO 131           HG2      PRO 131  14.209  29.998 -15.668
  967    HG3  PRO 131           HG3      PRO 131  15.946  30.116 -16.104
  968    HD2  PRO 131           HD2      PRO 131  14.000  32.037 -16.756
  969    HD3  PRO 131           HD3      PRO 131  15.530  31.805 -17.647
  970    H    LEU 132           H        LEU 132  12.467  27.139 -17.979
  971    HA   LEU 132           HA       LEU 132   9.817  28.064 -17.230
  972    HB2  LEU 132           HB2      LEU 132  11.258  25.390 -17.320
  973    HB3  LEU 132           HB3      LEU 132   9.828  25.563 -16.319
  974    HG   LEU 132           HG       LEU 132   8.639  26.541 -18.358
  975   HD11  LEU 132          HD11      LEU 132   9.404  25.797 -20.551
  976   HD12  LEU 132          HD12      LEU 132  10.596  26.880 -19.833
  977   HD13  LEU 132          HD13      LEU 132  10.877  25.122 -19.827
  978   HD21  LEU 132          HD21      LEU 132   8.172  24.329 -17.404
  979   HD22  LEU 132          HD22      LEU 132   8.014  24.326 -19.152
  980   HD23  LEU 132          HD23      LEU 132   9.463  23.617 -18.396
  981    H    ASP 133           H        ASP 133   8.856  27.429 -15.207
  982    HA   ASP 133           HA       ASP 133  10.469  28.184 -12.799
  983    HB2  ASP 133           HB2      ASP 133   8.392  29.482 -13.175
  984    HB3  ASP 133           HB3      ASP 133   7.466  27.989 -13.324
  985    H    GLN 134           H        GLN 134  10.287  26.686 -10.971
  986    HA   GLN 134           HA       GLN 134   8.961  24.124 -11.480
  987    HB2  GLN 134           HB2      GLN 134  10.778  22.716 -10.904
  988    HB3  GLN 134           HB3      GLN 134  11.267  23.740 -12.256
  989    HG2  GLN 134           HG2      GLN 134  12.580  25.143 -10.732
  990    HG3  GLN 134           HG3      GLN 134  12.077  24.136  -9.359
  991   HE21  GLN 134          HE22      GLN 134  12.805  21.808  -9.352
  992   HE22  GLN 134          HE21      GLN 134  14.290  21.441 -10.207
  993    H    THR 135           H        THR 135   8.432  22.901  -9.686
  994    HA   THR 135           HA       THR 135   8.607  24.134  -6.986
  995    HB   THR 135           HB       THR 135   6.819  25.288  -8.221
  996    HG1  THR 135           HG1      THR 135   6.514  24.987  -6.032
  997   HG21  THR 135          HG21      THR 135   5.452  22.577  -8.434
  998   HG22  THR 135          HG22      THR 135   4.723  24.149  -8.811
  999   HG23  THR 135          HG23      THR 135   6.056  23.561  -9.792
 1000    H    LEU 136           H        LEU 136   7.855  22.756  -5.290
 1001    HA   LEU 136           HA       LEU 136   7.942  19.872  -5.811
 1002    HB2  LEU 136           HB2      LEU 136   7.341  21.550  -3.337
 1003    HB3  LEU 136           HB3      LEU 136   7.181  19.807  -3.364
 1004    HG   LEU 136           HG       LEU 136   9.234  20.416  -2.310
 1005   HD11  LEU 136          HD11      LEU 136   9.901  19.202  -5.019
 1006   HD12  LEU 136          HD12      LEU 136  10.807  19.029  -3.507
 1007   HD13  LEU 136          HD13      LEU 136   9.187  18.325  -3.649
 1008   HD21  LEU 136          HD21      LEU 136  10.239  21.641  -4.901
 1009   HD22  LEU 136          HD22      LEU 136   9.680  22.570  -3.486
 1010   HD23  LEU 136          HD23      LEU 136  11.091  21.509  -3.354
 1011    H    ALA 137           H        ALA 137   6.272  18.573  -6.137
 1012    HA   ALA 137           HA       ALA 137   4.237  18.146  -7.203
 1013    HB1  ALA 137           HB1      ALA 137   2.667  17.570  -5.392
 1014    HB2  ALA 137           HB2      ALA 137   4.337  17.140  -4.973
 1015    HB3  ALA 137           HB3      ALA 137   3.588  18.589  -4.265
 1016    H    ARG 138           H        ARG 138   4.197  20.147  -8.482
 1017    HA   ARG 138           HA       ARG 138   3.338  22.043  -9.353
 1018    HB2  ARG 138           HB2      ARG 138   1.069  21.810 -10.037
 1019    HB3  ARG 138           HB3      ARG 138   1.914  20.286 -10.102
 1020    HG2  ARG 138           HG2      ARG 138  -0.354  19.956  -9.393
 1021    HG3  ARG 138           HG3      ARG 138   0.755  19.462  -8.119
 1022    HD2  ARG 138           HD2      ARG 138   0.341  21.604  -6.937
 1023    HD3  ARG 138           HD3      ARG 138  -0.691  22.136  -8.258
 1024    HE   ARG 138           HE       ARG 138  -2.413  20.739  -7.495
 1025   HH11  ARG 138          HH21      ARG 138   0.472  19.975  -5.621
 1026   HH12  ARG 138          HH22      ARG 138  -0.456  19.082  -4.442
 1027   HH21  ARG 138          HH11      ARG 138  -3.486  19.561  -5.962
 1028   HH22  ARG 138          HH12      ARG 138  -2.615  18.844  -4.643
 1029    H    ASP 139           H        ASP 139   3.635  22.495  -6.291
 1030    HA   ASP 139           HA       ASP 139   1.460  23.990  -5.454
 1031    HB2  ASP 139           HB2      ASP 139   3.265  23.129  -4.028
 1032    HB3  ASP 139           HB3      ASP 139   4.351  24.376  -4.636
 1033    H    THR 140           H        THR 140   4.102  25.347  -7.441
 1034    HA   THR 140           HA       THR 140   3.039  28.081  -7.248
 1035    HB   THR 140           HB       THR 140   4.569  28.633  -9.094
 1036    HG1  THR 140           HG1      THR 140   5.879  27.133  -9.953
 1037   HG21  THR 140          HG21      THR 140   5.475  28.757  -6.859
 1038   HG22  THR 140          HG22      THR 140   5.865  27.028  -6.867
 1039   HG23  THR 140          HG23      THR 140   6.707  28.133  -7.973
 1040    H    ARG 141           H        ARG 141   2.078  25.353  -9.139
 1041    HA   ARG 141           HA       ARG 141   1.513  26.687 -11.608
 1042    HB2  ARG 141           HB2      ARG 141   1.967  24.232 -11.257
 1043    HB3  ARG 141           HB3      ARG 141   0.321  24.068 -10.629
 1044    HG2  ARG 141           HG2      ARG 141  -0.588  24.889 -12.783
 1045    HG3  ARG 141           HG3      ARG 141   1.058  25.111 -13.401
 1046    HD2  ARG 141           HD2      ARG 141   1.486  22.690 -13.174
 1047    HD3  ARG 141           HD3      ARG 141  -0.136  22.439 -12.523
 1048    HE   ARG 141           HE       ARG 141   0.620  22.901 -15.329
 1049   HH11  ARG 141          HH21      ARG 141  -2.137  22.885 -13.145
 1050   HH12  ARG 141          HH22      ARG 141  -3.263  22.898 -14.469
 1051   HH21  ARG 141          HH11      ARG 141  -0.826  22.980 -16.890
 1052   HH22  ARG 141          HH12      ARG 141  -2.542  22.960 -16.554
 1053    HA   PRO 142           HA       PRO 142  -3.117  26.853 -10.471
 1054    HB2  PRO 142           HB2      PRO 142  -3.966  26.927  -7.861
 1055    HB3  PRO 142           HB3      PRO 142  -3.757  25.425  -8.809
 1056    HG2  PRO 142           HG2      PRO 142  -1.820  26.671  -6.843
 1057    HG3  PRO 142           HG3      PRO 142  -2.335  24.958  -6.961
 1058    HD2  PRO 142           HD2      PRO 142  -0.019  25.844  -8.032
 1059    HD3  PRO 142           HD3      PRO 142  -0.988  24.586  -8.851
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1   7.975   4.808   6.908
    2    H2   MET   1           H2       MET   1   7.994   5.681   5.527
    3    H3   MET   1           H3       MET   1   6.645   5.644   6.449
    4    HA   MET   1           HA       MET   1   7.802   3.353   5.002
    5    HB2  MET   1           HB2      MET   1   6.699   2.720   7.153
    6    HB3  MET   1           HB3      MET   1   5.197   3.464   6.592
    7    HG2  MET   1           HG2      MET   1   5.108   1.857   4.709
    8    HG3  MET   1           HG3      MET   1   6.646   1.155   5.229
    9    HE1  MET   1           HE1      MET   1   5.567  -1.250   5.128
   10    HE2  MET   1           HE2      MET   1   4.057  -1.694   5.954
   11    HE3  MET   1           HE3      MET   1   4.023  -0.533   4.609
   12    H    ALA   2           H        ALA   2   7.130   3.049   2.939
   13    HA   ALA   2           HA       ALA   2   4.681   4.306   1.899
   14    HB1  ALA   2           HB1      ALA   2   7.455   4.920   0.766
   15    HB2  ALA   2           HB2      ALA   2   5.906   5.424   0.057
   16    HB3  ALA   2           HB3      ALA   2   6.408   6.070   1.626
   17    H    TYR   3           H        TYR   3   4.294   3.614  -0.404
   18    HA   TYR   3           HA       TYR   3   4.534   0.775  -0.665
   19    HB2  TYR   3           HB2      TYR   3   2.662   2.283  -1.448
   20    HB3  TYR   3           HB3      TYR   3   3.679   2.793  -2.778
   21    HD1  TYR   3           HD2      TYR   3   1.912  -0.096  -1.223
   22    HD2  TYR   3           HD1      TYR   3   3.937   1.365  -4.741
   23    HE1  TYR   3           HE2      TYR   3   1.075  -2.050  -2.517
   24    HE2  TYR   3           HE1      TYR   3   3.091  -0.582  -6.038
   25    HH   TYR   3           HH       TYR   3   1.030  -3.109  -4.548
   26    H    GLY   4           H        GLY   4   6.802   3.196  -1.544
   27    HA2  GLY   4           HA2      GLY   4   8.633   1.340  -2.796
   28    HA3  GLY   4           HA3      GLY   4   7.932   2.466  -3.961
   29    H    ARG   5           H        ARG   5  10.382   2.869  -4.026
   30    HA   ARG   5           HA       ARG   5  11.630   4.222  -1.802
   31    HB2  ARG   5           HB2      ARG   5  12.664   2.555  -3.421
   32    HB3  ARG   5           HB3      ARG   5  12.781   3.875  -4.594
   33    HG2  ARG   5           HG2      ARG   5  14.240   5.127  -3.064
   34    HG3  ARG   5           HG3      ARG   5  13.922   3.985  -1.760
   35    HD2  ARG   5           HD2      ARG   5  16.111   3.570  -2.654
   36    HD3  ARG   5           HD3      ARG   5  15.060   2.190  -2.990
   37    HE   ARG   5           HE       ARG   5  14.842   3.614  -5.326
   38   HH11  ARG   5          HH11      ARG   5  17.714   2.515  -3.603
   39   HH12  ARG   5          HH12      ARG   5  18.622   2.408  -5.082
   40   HH21  ARG   5          HH21      ARG   5  15.963   3.428  -7.031
   41   HH22  ARG   5          HH22      ARG   5  17.656   2.912  -7.037
   42    H    GLU   6           H        GLU   6   9.745   5.794  -1.974
   43    HA   GLU   6           HA       GLU   6   9.447   7.955  -3.661
   44    HB2  GLU   6           HB2      GLU   6   9.288   7.814  -0.630
   45    HB3  GLU   6           HB3      GLU   6   8.747   9.215  -1.543
   46    HG2  GLU   6           HG2      GLU   6   7.629   6.418  -2.002
   47    HG3  GLU   6           HG3      GLU   6   6.968   7.548  -0.829
   48    H    ASP   7           H        ASP   7  11.924   7.841  -1.032
   49    HA   ASP   7           HA       ASP   7  12.691  10.569  -1.303
   50    HB2  ASP   7           HB2      ASP   7  13.127   9.147   0.674
   51    HB3  ASP   7           HB3      ASP   7  14.284   8.197  -0.260
   52    H    VAL   8           H        VAL   8  14.041   7.668  -2.863
   53    HA   VAL   8           HA       VAL   8  16.154   9.158  -4.251
   54    HB   VAL   8           HB       VAL   8  15.084   6.375  -4.850
   55   HG11  VAL   8          HG11      VAL   8  17.232   6.077  -6.074
   56   HG12  VAL   8          HG12      VAL   8  16.249   7.328  -6.823
   57   HG13  VAL   8          HG13      VAL   8  17.623   7.788  -5.805
   58   HG21  VAL   8          HG21      VAL   8  17.187   5.638  -3.721
   59   HG22  VAL   8          HG22      VAL   8  17.560   7.324  -3.322
   60   HG23  VAL   8          HG23      VAL   8  16.148   6.529  -2.602
   61    H    ALA   9           H        ALA   9  12.831   8.032  -5.099
   62    HA   ALA   9           HA       ALA   9  12.868   9.032  -7.774
   63    HB1  ALA   9           HB1      ALA   9  11.153   7.501  -6.841
   64    HB2  ALA   9           HB2      ALA   9  10.518   8.827  -5.844
   65    HB3  ALA   9           HB3      ALA   9  10.443   8.929  -7.618
   66    H    ASN  10           H        ASN  10  11.957  10.725  -4.711
   67    HA   ASN  10           HA       ASN  10  11.333  13.219  -5.963
   68    HB2  ASN  10           HB2      ASN  10  10.779  12.334  -3.603
   69    HB3  ASN  10           HB3      ASN  10  12.396  12.840  -3.129
   70   HD21  ASN  10          HD22      ASN  10   9.233  13.781  -3.051
   71   HD22  ASN  10          HD21      ASN  10   9.457  15.517  -3.101
   72    H    THR  11           H        THR  11  14.419  12.010  -4.618
   73    HA   THR  11           HA       THR  11  16.011  14.314  -5.207
   74    HB   THR  11           HB       THR  11  16.882  11.391  -5.198
   75    HG1  THR  11           HG1      THR  11  15.931  11.847  -3.267
   76   HG21  THR  11          HG21      THR  11  18.640  12.868  -6.088
   77   HG22  THR  11          HG22      THR  11  18.431  13.976  -4.712
   78   HG23  THR  11          HG23      THR  11  19.060  12.332  -4.456
   79    H    ARG  12           H        ARG  12  15.473  11.358  -7.171
   80    HA   ARG  12           HA       ARG  12  16.917  12.082  -9.523
   81    HB2  ARG  12           HB2      ARG  12  14.477  10.336  -8.977
   82    HB3  ARG  12           HB3      ARG  12  15.150  10.473 -10.578
   83    HG2  ARG  12           HG2      ARG  12  17.045   9.705  -8.353
   84    HG3  ARG  12           HG3      ARG  12  15.824   8.541  -8.860
   85    HD2  ARG  12           HD2      ARG  12  17.793   8.058 -10.080
   86    HD3  ARG  12           HD3      ARG  12  16.595   8.696 -11.199
   87    HE   ARG  12           HE       ARG  12  19.128   9.974 -10.313
   88   HH11  ARG  12          HH11      ARG  12  16.245  10.325 -12.320
   89   HH12  ARG  12          HH12      ARG  12  16.911  11.709 -13.133
   90   HH21  ARG  12          HH21      ARG  12  19.981  11.566 -11.646
   91   HH22  ARG  12          HH22      ARG  12  18.989  12.235 -12.911
   92    H    ALA  13           H        ALA  13  13.477  12.799  -8.663
   93    HA   ALA  13           HA       ALA  13  12.749  13.970 -11.120
   94    HB1  ALA  13           HB1      ALA  13  10.944  14.997  -9.873
   95    HB2  ALA  13           HB2      ALA  13  11.213  13.367  -9.232
   96    HB3  ALA  13           HB3      ALA  13  11.801  14.777  -8.334
   97    H    ARG  14           H        ARG  14  14.091  15.585  -8.198
   98    HA   ARG  14           HA       ARG  14  14.305  18.235  -9.306
   99    HB2  ARG  14           HB2      ARG  14  15.954  16.881  -7.130
  100    HB3  ARG  14           HB3      ARG  14  15.899  18.619  -7.431
  101    HG2  ARG  14           HG2      ARG  14  13.552  18.733  -6.776
  102    HG3  ARG  14           HG3      ARG  14  13.449  16.971  -6.658
  103    HD2  ARG  14           HD2      ARG  14  15.348  17.109  -4.938
  104    HD3  ARG  14           HD3      ARG  14  15.057  18.858  -4.911
  105    HE   ARG  14           HE       ARG  14  12.919  16.821  -4.318
  106   HH11  ARG  14          HH11      ARG  14  14.665  19.648  -3.153
  107   HH12  ARG  14          HH12      ARG  14  13.759  19.666  -1.669
  108   HH21  ARG  14          HH21      ARG  14  11.911  16.879  -2.491
  109   HH22  ARG  14          HH22      ARG  14  12.227  18.105  -1.274
  110    H    GLU  15           H        GLU  15  16.626  15.563  -9.177
  111    HA   GLU  15           HA       GLU  15  18.828  16.883 -10.420
  112    HB2  GLU  15           HB2      GLU  15  18.793  14.743  -9.061
  113    HB3  GLU  15           HB3      GLU  15  18.063  13.938 -10.447
  114    HG2  GLU  15           HG2      GLU  15  20.317  13.403 -10.490
  115    HG3  GLU  15           HG3      GLU  15  20.095  14.582 -11.789
  116    H    THR  16           H        THR  16  16.348  14.732 -11.971
  117    HA   THR  16           HA       THR  16  17.276  15.263 -14.627
  118    HB   THR  16           HB       THR  16  14.500  14.392 -13.749
  119    HG1  THR  16           HG1      THR  16  15.267  12.394 -13.991
  120   HG21  THR  16          HG21      THR  16  14.474  15.054 -16.121
  121   HG22  THR  16          HG22      THR  16  15.980  14.157 -16.422
  122   HG23  THR  16          HG23      THR  16  14.482  13.290 -16.014
  123    H    ALA  17           H        ALA  17  15.010  17.081 -12.558
  124    HA   ALA  17           HA       ALA  17  14.165  18.879 -14.622
  125    HB1  ALA  17           HB1      ALA  17  13.592  20.368 -12.694
  126    HB2  ALA  17           HB2      ALA  17  12.933  18.718 -12.559
  127    HB3  ALA  17           HB3      ALA  17  14.350  19.202 -11.605
  128    H    ALA  18           H        ALA  18  16.942  19.130 -12.327
  129    HA   ALA  18           HA       ALA  18  17.950  21.600 -13.376
  130    HB1  ALA  18           HB1      ALA  18  20.054  20.909 -12.295
  131    HB2  ALA  18           HB2      ALA  18  18.666  20.612 -11.231
  132    HB3  ALA  18           HB3      ALA  18  19.431  19.258 -12.092
  133    H    ARG  19           H        ARG  19  18.617  18.194 -14.304
  134    HA   ARG  19           HA       ARG  19  20.425  18.822 -16.436
  135    HB2  ARG  19           HB2      ARG  19  20.113  16.581 -15.286
  136    HB3  ARG  19           HB3      ARG  19  18.623  16.374 -16.198
  137    HG2  ARG  19           HG2      ARG  19  20.494  15.158 -17.227
  138    HG3  ARG  19           HG3      ARG  19  19.851  16.388 -18.311
  139    HD2  ARG  19           HD2      ARG  19  22.310  16.261 -18.387
  140    HD3  ARG  19           HD3      ARG  19  21.722  17.854 -17.911
  141    HE   ARG  19           HE       ARG  19  22.409  15.995 -15.710
  142   HH11  ARG  19          HH11      ARG  19  23.662  18.591 -17.703
  143   HH12  ARG  19          HH12      ARG  19  24.853  19.037 -16.518
  144   HH21  ARG  19          HH21      ARG  19  23.955  16.626 -14.254
  145   HH22  ARG  19          HH22      ARG  19  25.023  17.939 -14.636
  146    H    PHE  20           H        PHE  20  16.877  18.392 -16.504
  147    HA   PHE  20           HA       PHE  20  16.480  18.824 -19.286
  148    HB2  PHE  20           HB2      PHE  20  14.696  18.017 -17.790
  149    HB3  PHE  20           HB3      PHE  20  14.722  19.528 -16.906
  150    HD1  PHE  20           HD2      PHE  20  14.263  18.250 -20.441
  151    HD2  PHE  20           HD1      PHE  20  13.270  21.270 -17.521
  152    HE1  PHE  20           HE2      PHE  20  12.555  19.184 -21.970
  153    HE2  PHE  20           HE1      PHE  20  11.625  22.251 -19.101
  154    HZ   PHE  20           HZ       PHE  20  11.269  21.205 -21.334
  155    H    THR  21           H        THR  21  16.695  21.206 -16.593
  156    HA   THR  21           HA       THR  21  16.255  23.524 -18.192
  157    HB   THR  21           HB       THR  21  18.019  23.337 -15.719
  158    HG1  THR  21           HG1      THR  21  15.965  22.533 -15.295
  159   HG21  THR  21          HG21      THR  21  16.497  25.661 -16.994
  160   HG22  THR  21          HG22      THR  21  17.211  25.696 -15.372
  161   HG23  THR  21          HG23      THR  21  18.258  25.516 -16.782
  162    H    ALA  22           H        ALA  22  19.375  21.828 -17.462
  163    HA   ALA  22           HA       ALA  22  20.950  23.515 -19.160
  164    HB1  ALA  22           HB1      ALA  22  22.609  21.701 -19.007
  165    HB2  ALA  22           HB2      ALA  22  21.888  22.030 -17.420
  166    HB3  ALA  22           HB3      ALA  22  21.378  20.604 -18.350
  167    H    ALA  23           H        ALA  23  19.224  20.467 -19.907
  168    HA   ALA  23           HA       ALA  23  20.042  20.261 -22.626
  169    HB1  ALA  23           HB1      ALA  23  18.190  18.697 -22.848
  170    HB2  ALA  23           HB2      ALA  23  19.027  18.429 -21.308
  171    HB3  ALA  23           HB3      ALA  23  17.464  19.282 -21.341
  172    H    LEU  24           H        LEU  24  17.367  22.091 -21.167
  173    HA   LEU  24           HA       LEU  24  16.222  23.002 -23.645
  174    HB2  LEU  24           HB2      LEU  24  15.084  22.786 -21.426
  175    HB3  LEU  24           HB3      LEU  24  16.063  24.108 -20.819
  176    HG   LEU  24           HG       LEU  24  14.999  25.577 -22.649
  177   HD11  LEU  24          HD11      LEU  24  12.845  24.756 -23.564
  178   HD12  LEU  24          HD12      LEU  24  14.181  23.726 -24.104
  179   HD13  LEU  24          HD13      LEU  24  13.108  23.172 -22.806
  180   HD21  LEU  24          HD21      LEU  24  12.893  25.841 -21.384
  181   HD22  LEU  24          HD22      LEU  24  13.178  24.277 -20.583
  182   HD23  LEU  24          HD23      LEU  24  14.271  25.644 -20.286
  183    H    GLU  25           H        GLU  25  18.779  24.323 -21.498
  184    HA   GLU  25           HA       GLU  25  19.198  26.769 -22.964
  185    HB2  GLU  25           HB2      GLU  25  20.183  26.152 -20.685
  186    HB3  GLU  25           HB3      GLU  25  21.349  25.151 -21.544
  187    HG2  GLU  25           HG2      GLU  25  22.102  27.157 -22.826
  188    HG3  GLU  25           HG3      GLU  25  20.933  28.142 -21.946
  189    H    LEU  26           H        LEU  26  20.642  23.514 -23.290
  190    HA   LEU  26           HA       LEU  26  22.189  23.850 -25.636
  191    HB2  LEU  26           HB2      LEU  26  22.513  21.826 -24.588
  192    HB3  LEU  26           HB3      LEU  26  20.843  21.652 -24.155
  193    HG   LEU  26           HG       LEU  26  20.344  21.034 -26.600
  194   HD11  LEU  26          HD11      LEU  26  22.233  20.141 -27.878
  195   HD12  LEU  26          HD12      LEU  26  22.480  21.867 -27.569
  196   HD13  LEU  26          HD13      LEU  26  23.369  20.661 -26.614
  197   HD21  LEU  26          HD21      LEU  26  20.319  19.410 -24.811
  198   HD22  LEU  26          HD22      LEU  26  21.081  18.716 -26.245
  199   HD23  LEU  26          HD23      LEU  26  22.092  19.249 -24.879
  200    H    ALA  27           H        ALA  27  18.703  23.099 -25.373
  201    HA   ALA  27           HA       ALA  27  18.184  23.052 -28.162
  202    HB1  ALA  27           HB1      ALA  27  16.306  23.802 -25.887
  203    HB2  ALA  27           HB2      ALA  27  15.840  23.303 -27.520
  204    HB3  ALA  27           HB3      ALA  27  16.664  22.154 -26.443
  205    H    ILE  28           H        ILE  28  18.089  25.874 -25.913
  206    HA   ILE  28           HA       ILE  28  17.266  27.811 -27.885
  207    HB   ILE  28           HB       ILE  28  18.883  28.121 -25.321
  208   HG12  ILE  28          HG12      ILE  28  15.978  28.858 -25.851
  209   HG13  ILE  28          HG13      ILE  28  16.442  27.277 -25.235
  210   HG21  ILE  28          HG21      ILE  28  18.270  30.548 -25.456
  211   HG22  ILE  28          HG22      ILE  28  19.347  30.063 -26.756
  212   HG23  ILE  28          HG23      ILE  28  17.613  30.271 -27.084
  213   HD11  ILE  28          HD11      ILE  28  16.796  29.914 -23.816
  214   HD12  ILE  28          HD12      ILE  28  15.761  28.529 -23.395
  215   HD13  ILE  28          HD13      ILE  28  17.523  28.378 -23.272
  216    H    ASP  29           H        ASP  29  20.541  26.805 -26.798
  217    HA   ASP  29           HA       ASP  29  22.014  28.457 -28.574
  218    HB2  ASP  29           HB2      ASP  29  22.932  27.272 -26.604
  219    HB3  ASP  29           HB3      ASP  29  22.727  25.730 -27.433
  220    H    ARG  30           H        ARG  30  20.601  25.239 -29.121
  221    HA   ARG  30           HA       ARG  30  21.679  25.051 -31.825
  222    HB2  ARG  30           HB2      ARG  30  21.163  23.058 -30.409
  223    HB3  ARG  30           HB3      ARG  30  19.458  23.484 -30.419
  224    HG2  ARG  30           HG2      ARG  30  19.779  21.696 -31.970
  225    HG3  ARG  30           HG3      ARG  30  19.429  23.142 -32.910
  226    HD2  ARG  30           HD2      ARG  30  21.996  23.378 -33.162
  227    HD3  ARG  30           HD3      ARG  30  22.091  21.721 -32.569
  228    HE   ARG  30           HE       ARG  30  20.697  22.699 -35.047
  229   HH11  ARG  30          HH11      ARG  30  22.081  19.863 -33.417
  230   HH12  ARG  30          HH12      ARG  30  21.777  18.900 -34.873
  231   HH21  ARG  30          HH21      ARG  30  20.466  21.297 -36.765
  232   HH22  ARG  30          HH22      ARG  30  20.961  19.612 -36.533
  233    H    ALA  31           H        ALA  31  18.527  26.186 -30.521
  234    HA   ALA  31           HA       ALA  31  17.249  26.451 -33.058
  235    HB1  ALA  31           HB1      ALA  31  15.694  27.937 -31.854
  236    HB2  ALA  31           HB2      ALA  31  16.067  26.511 -30.873
  237    HB3  ALA  31           HB3      ALA  31  16.835  28.067 -30.496
  238    H    THR  32           H        THR  32  19.473  28.700 -31.402
  239    HA   THR  32           HA       THR  32  19.001  30.806 -33.379
  240    HB   THR  32           HB       THR  32  19.705  31.311 -31.080
  241    HG1  THR  32           HG1      THR  32  21.074  32.940 -31.717
  242   HG21  THR  32          HG21      THR  32  21.402  29.646 -30.630
  243   HG22  THR  32          HG22      THR  32  22.432  30.253 -31.951
  244   HG23  THR  32          HG23      THR  32  22.120  31.250 -30.512
  245    H    LEU  33           H        LEU  33  21.180  28.033 -33.244
  246    HA   LEU  33           HA       LEU  33  22.798  29.092 -35.405
  247    HB2  LEU  33           HB2      LEU  33  24.352  27.510 -34.916
  248    HB3  LEU  33           HB3      LEU  33  23.581  27.791 -33.363
  249    HG   LEU  33           HG       LEU  33  22.242  25.681 -33.759
  250   HD11  LEU  33          HD11      LEU  33  23.462  23.936 -35.142
  251   HD12  LEU  33          HD12      LEU  33  22.615  25.123 -36.105
  252   HD13  LEU  33          HD13      LEU  33  24.375  25.255 -35.897
  253   HD21  LEU  33          HD21      LEU  33  24.134  24.285 -32.946
  254   HD22  LEU  33          HD22      LEU  33  25.273  25.529 -33.498
  255   HD23  LEU  33          HD23      LEU  33  24.131  25.878 -32.185
  256    H    SER  34           H        SER  34  20.061  26.959 -35.142
  257    HA   SER  34           HA       SER  34  20.570  25.532 -37.631
  258    HB2  SER  34           HB2      SER  34  18.151  25.504 -35.797
  259    HB3  SER  34           HB3      SER  34  18.508  24.342 -37.098
  260    HG   SER  34           HG       SER  34  19.872  24.811 -34.674
  261    H    GLY  35           H        GLY  35  18.666  28.390 -36.901
  262    HA2  GLY  35           HA2      GLY  35  17.553  29.799 -38.391
  263    HA3  GLY  35           HA3      GLY  35  17.861  28.670 -39.709
  264    H    GLN  36           H        GLN  36  16.437  27.034 -37.141
  265    HA   GLN  36           HA       GLN  36  13.638  27.748 -37.575
  266    HB2  GLN  36           HB2      GLN  36  14.025  25.914 -39.231
  267    HB3  GLN  36           HB3      GLN  36  14.661  24.888 -37.955
  268    HG2  GLN  36           HG2      GLN  36  12.446  24.928 -36.814
  269    HG3  GLN  36           HG3      GLN  36  11.804  25.929 -38.129
  270   HE21  GLN  36          HE22      GLN  36  11.342  22.984 -37.033
  271   HE22  GLN  36          HE21      GLN  36  11.299  22.083 -38.543
  272    HA   PRO  37           HA       PRO  37  13.627  27.061 -33.085
  273    HB2  PRO  37           HB2      PRO  37  11.043  25.629 -33.820
  274    HB3  PRO  37           HB3      PRO  37  11.360  26.643 -32.384
  275    HG2  PRO  37           HG2      PRO  37  10.138  27.776 -34.474
  276    HG3  PRO  37           HG3      PRO  37  11.552  28.628 -33.757
  277    HD2  PRO  37           HD2      PRO  37  11.452  26.940 -36.233
  278    HD3  PRO  37           HD3      PRO  37  12.269  28.508 -35.971
  279    H    VAL  38           H        VAL  38  13.572  25.344 -31.496
  280    HA   VAL  38           HA       VAL  38  14.211  22.584 -32.497
  281    HB   VAL  38           HB       VAL  38  15.658  24.205 -30.384
  282   HG11  VAL  38          HG11      VAL  38  17.161  22.231 -30.111
  283   HG12  VAL  38          HG12      VAL  38  15.547  21.929 -29.482
  284   HG13  VAL  38          HG13      VAL  38  16.029  21.253 -31.055
  285   HG21  VAL  38          HG21      VAL  38  16.311  24.532 -32.801
  286   HG22  VAL  38          HG22      VAL  38  17.585  23.817 -31.817
  287   HG23  VAL  38          HG23      VAL  38  16.631  22.801 -32.923
  288    H    GLY  39           H        GLY  39  13.730  20.864 -30.803
  289    HA2  GLY  39           HA2      GLY  39  11.911  21.756 -28.666
  290    HA3  GLY  39           HA3      GLY  39  11.145  20.905 -29.997
  291    H    ILE  40           H        ILE  40  10.721  19.936 -27.679
  292    HA   ILE  40           HA       ILE  40  12.332  17.437 -27.508
  293    HB   ILE  40           HB       ILE  40  11.435  19.011 -25.069
  294   HG12  ILE  40          HG12      ILE  40  14.244  18.589 -26.177
  295   HG13  ILE  40          HG13      ILE  40  13.355  20.106 -26.222
  296   HG21  ILE  40          HG21      ILE  40  13.057  16.436 -25.333
  297   HG22  ILE  40          HG22      ILE  40  12.650  17.264 -23.815
  298   HG23  ILE  40          HG23      ILE  40  11.381  16.540 -24.781
  299   HD11  ILE  40          HD11      ILE  40  14.958  20.211 -24.454
  300   HD12  ILE  40          HD12      ILE  40  13.316  20.230 -23.786
  301   HD13  ILE  40          HD13      ILE  40  14.314  18.751 -23.692
  302    H    HIS  41           H        HIS  41  11.173  15.746 -27.679
  303    HA   HIS  41           HA       HIS  41   8.215  15.707 -27.565
  304    HB2  HIS  41           HB2      HIS  41   9.053  14.571 -29.471
  305    HB3  HIS  41           HB3      HIS  41  10.421  13.905 -28.598
  306    HD1  HIS  41           HD1      HIS  41  10.030  11.588 -27.341
  307    HD2  HIS  41           HD2      HIS  41   6.576  13.446 -28.850
  308    HE1  HIS  41           HE1      HIS  41   8.120   9.936 -26.976
  309    H    PHE  42           H        PHE  42   7.110  14.494 -26.161
  310    HA   PHE  42           HA       PHE  42   8.452  12.886 -24.059
  311    HB2  PHE  42           HB2      PHE  42   6.526  15.198 -23.613
  312    HB3  PHE  42           HB3      PHE  42   6.823  13.954 -22.417
  313    HD1  PHE  42           HD2      PHE  42   9.003  13.685 -21.335
  314    HD2  PHE  42           HD1      PHE  42   8.224  17.022 -23.967
  315    HE1  PHE  42           HE2      PHE  42  10.813  14.975 -20.234
  316    HE2  PHE  42           HE1      PHE  42  10.081  18.279 -22.893
  317    HZ   PHE  42           HZ       PHE  42  11.335  17.278 -20.997
  318    H    SER  43           H        SER  43   7.280  11.125 -23.398
  319    HA   SER  43           HA       SER  43   4.399  10.975 -23.887
  320    HB2  SER  43           HB2      SER  43   4.439   8.900 -25.036
  321    HB3  SER  43           HB3      SER  43   5.571   9.954 -25.894
  322    HG   SER  43           HG       SER  43   6.486   7.912 -25.543
  323    H    ASP  44           H        ASP  44   3.525   8.823 -22.906
  324    HA   ASP  44           HA       ASP  44   4.266   8.489 -20.182
  325    HB2  ASP  44           HB2      ASP  44   2.058   7.991 -21.237
  326    HB3  ASP  44           HB3      ASP  44   2.781   6.611 -22.060
  327    H    SER  45           H        SER  45   5.971   7.380 -22.926
  328    HA   SER  45           HA       SER  45   7.328   5.187 -21.393
  329    HB2  SER  45           HB2      SER  45   6.587   5.228 -24.337
  330    HB3  SER  45           HB3      SER  45   7.486   3.946 -23.505
  331    HG   SER  45           HG       SER  45   5.252   3.465 -23.693
  332    H    ALA  46           H        ALA  46   7.868   8.076 -23.314
  333    HA   ALA  46           HA       ALA  46  10.778   7.691 -23.015
  334    HB1  ALA  46           HB1      ALA  46   9.447   8.104 -25.739
  335    HB2  ALA  46           HB2      ALA  46  11.195   8.069 -25.447
  336    HB3  ALA  46           HB3      ALA  46  10.234   6.610 -25.192
  337    H    TRP  47           H        TRP  47  11.997   9.479 -23.823
  338    HA   TRP  47           HA       TRP  47  10.808  12.167 -24.074
  339    HB2  TRP  47           HB2      TRP  47  11.496  12.529 -21.912
  340    HB3  TRP  47           HB3      TRP  47  12.683  11.230 -21.933
  341    HD1  TRP  47           HD1      TRP  47  12.366  14.941 -22.501
  342    HE1  TRP  47           HE1      TRP  47  14.698  15.977 -22.706
  343    HE3  TRP  47           HE3      TRP  47  15.114  10.666 -22.986
  344    HZ2  TRP  47           HZ2      TRP  47  17.411  15.072 -23.175
  345    HZ3  TRP  47           HZ3      TRP  47  17.577  10.775 -23.358
  346    HH2  TRP  47           HH2      TRP  47  18.724  12.970 -23.466
  347    H    ARG  48           H        ARG  48  12.028  13.363 -25.559
  348    HA   ARG  48           HA       ARG  48  14.471  12.269 -26.808
  349    HB2  ARG  48           HB2      ARG  48  12.715  10.797 -27.732
  350    HB3  ARG  48           HB3      ARG  48  11.711  12.179 -28.115
  351    HG2  ARG  48           HG2      ARG  48  13.282  12.870 -29.900
  352    HG3  ARG  48           HG3      ARG  48  14.335  11.514 -29.495
  353    HD2  ARG  48           HD2      ARG  48  13.001  10.775 -31.338
  354    HD3  ARG  48           HD3      ARG  48  12.368   9.962 -29.916
  355    HE   ARG  48           HE       ARG  48  11.108  12.488 -30.947
  356   HH11  ARG  48          HH21      ARG  48  10.671   9.042 -30.374
  357   HH12  ARG  48          HH22      ARG  48   8.954   9.135 -30.722
  358   HH21  ARG  48          HH11      ARG  48   8.926  12.483 -31.355
  359   HH22  ARG  48          HH12      ARG  48   8.030  10.977 -31.249
  360    H    ILE  49           H        ILE  49  15.665  13.850 -27.642
  361    HA   ILE  49           HA       ILE  49  14.394  16.536 -27.990
  362    HB   ILE  49           HB       ILE  49  17.339  15.805 -27.915
  363   HG12  ILE  49          HG12      ILE  49  15.281  16.566 -25.834
  364   HG13  ILE  49          HG13      ILE  49  16.506  15.321 -25.777
  365   HG21  ILE  49          HG21      ILE  49  15.925  18.519 -27.875
  366   HG22  ILE  49          HG22      ILE  49  17.673  18.252 -27.703
  367   HG23  ILE  49          HG23      ILE  49  16.885  17.868 -29.220
  368   HD11  ILE  49          HD11      ILE  49  16.907  18.335 -25.444
  369   HD12  ILE  49          HD12      ILE  49  16.995  17.104 -24.192
  370   HD13  ILE  49          HD13      ILE  49  18.239  17.140 -25.467
  371    H    MET  50           H        MET  50  14.323  17.631 -29.909
  372    HA   MET  50           HA       MET  50  15.027  16.095 -32.356
  373    HB2  MET  50           HB2      MET  50  12.289  17.245 -31.697
  374    HB3  MET  50           HB3      MET  50  12.760  16.526 -33.246
  375    HG2  MET  50           HG2      MET  50  13.278  14.389 -32.046
  376    HG3  MET  50           HG3      MET  50  12.695  15.118 -30.555
  377    HE1  MET  50           HE1      MET  50  11.176  15.005 -34.309
  378    HE2  MET  50           HE2      MET  50  11.814  13.398 -33.890
  379    HE3  MET  50           HE3      MET  50  10.063  13.655 -34.059
  380    H    VAL  51           H        VAL  51  15.309  17.186 -34.184
  381    HA   VAL  51           HA       VAL  51  15.625  20.152 -34.102
  382    HB   VAL  51           HB       VAL  51  17.930  19.643 -35.209
  383   HG11  VAL  51          HG11      VAL  51  19.022  19.604 -33.050
  384   HG12  VAL  51          HG12      VAL  51  17.593  20.647 -32.979
  385   HG13  VAL  51          HG13      VAL  51  17.537  19.027 -32.260
  386   HG21  VAL  51          HG21      VAL  51  17.618  17.196 -35.524
  387   HG22  VAL  51          HG22      VAL  51  19.062  17.628 -34.594
  388   HG23  VAL  51          HG23      VAL  51  17.637  16.992 -33.758
  389    HA   PRO  52           HA       PRO  52  14.070  20.134 -38.138
  390    HB2  PRO  52           HB2      PRO  52  15.051  22.399 -39.271
  391    HB3  PRO  52           HB3      PRO  52  14.152  22.422 -37.723
  392    HG2  PRO  52           HG2      PRO  52  17.169  22.313 -38.035
  393    HG3  PRO  52           HG3      PRO  52  16.212  23.557 -37.162
  394    HD2  PRO  52           HD2      PRO  52  17.198  21.483 -35.833
  395    HD3  PRO  52           HD3      PRO  52  15.529  22.025 -35.504
  396    H    GLY  53           H        GLY  53  16.956  18.779 -37.950
  397    HA2  GLY  53           HA2      GLY  53  18.707  19.185 -39.897
  398    HA3  GLY  53           HA3      GLY  53  18.289  17.565 -39.364
  399    H    LYS  54           H        LYS  54  15.693  17.345 -40.670
  400    HA   LYS  54           HA       LYS  54  16.692  16.399 -43.199
  401    HB2  LYS  54           HB2      LYS  54  14.956  15.182 -41.993
  402    HB3  LYS  54           HB3      LYS  54  13.868  16.567 -42.081
  403    HG2  LYS  54           HG2      LYS  54  13.191  14.882 -43.681
  404    HG3  LYS  54           HG3      LYS  54  13.706  16.335 -44.521
  405    HD2  LYS  54           HD2      LYS  54  15.986  15.168 -44.878
  406    HD3  LYS  54           HD3      LYS  54  15.197  13.695 -44.275
  407    HE2  LYS  54           HE2      LYS  54  13.438  13.997 -46.055
  408    HE3  LYS  54           HE3      LYS  54  14.309  15.426 -46.632
  409    HZ1  LYS  54           HZ1      LYS  54  15.411  12.660 -46.599
  410    HZ2  LYS  54           HZ2      LYS  54  14.891  13.446 -47.925
  411    HZ3  LYS  54           HZ3      LYS  54  16.212  13.977 -47.136
  412    H    THR  55           H        THR  55  14.618  19.169 -42.393
  413    HA   THR  55           HA       THR  55  15.460  20.601 -44.721
  414    HB   THR  55           HB       THR  55  14.062  19.327 -46.071
  415    HG1  THR  55           HG1      THR  55  12.801  20.864 -46.865
  416   HG21  THR  55          HG21      THR  55  11.666  19.819 -44.263
  417   HG22  THR  55          HG22      THR  55  11.736  18.868 -45.766
  418   HG23  THR  55          HG23      THR  55  12.573  18.297 -44.328
  419    HA   PRO  56           HA       PRO  56  13.604  23.786 -42.049
  420    HB2  PRO  56           HB2      PRO  56  14.729  25.981 -43.172
  421    HB3  PRO  56           HB3      PRO  56  15.687  24.833 -42.188
  422    HG2  PRO  56           HG2      PRO  56  15.479  24.973 -45.212
  423    HG3  PRO  56           HG3      PRO  56  16.956  24.831 -44.209
  424    HD2  PRO  56           HD2      PRO  56  15.686  22.668 -45.378
  425    HD3  PRO  56           HD3      PRO  56  16.600  22.543 -43.847
  426    H    SER  57           H        SER  57  13.448  23.448 -45.561
  427    HA   SER  57           HA       SER  57  11.552  25.558 -46.102
  428    HB2  SER  57           HB2      SER  57  12.320  23.126 -47.765
  429    HB3  SER  57           HB3      SER  57  11.484  24.580 -48.345
  430    HG   SER  57           HG       SER  57  13.735  24.661 -48.758
  431    H    ALA  58           H        ALA  58  11.214  22.165 -45.250
  432    HA   ALA  58           HA       ALA  58   8.235  22.483 -45.205
  433    HB1  ALA  58           HB1      ALA  58   8.037  20.176 -45.986
  434    HB2  ALA  58           HB2      ALA  58   8.974  21.138 -47.147
  435    HB3  ALA  58           HB3      ALA  58   9.805  20.023 -46.040
  436    H    TRP  59           H        TRP  59  10.425  22.703 -43.221
  437    HA   TRP  59           HA       TRP  59  10.953  22.424 -41.131
  438    HB2  TRP  59           HB2      TRP  59   9.396  23.323 -39.915
  439    HB3  TRP  59           HB3      TRP  59   8.378  23.250 -41.324
  440    HD1  TRP  59           HD1      TRP  59   7.212  20.383 -41.245
  441    HE1  TRP  59           HE1      TRP  59   5.689  19.580 -39.359
  442    HE3  TRP  59           HE3      TRP  59   8.552  23.760 -37.625
  443    HZ2  TRP  59           HZ2      TRP  59   5.073  20.329 -36.646
  444    HZ3  TRP  59           HZ3      TRP  59   7.422  23.726 -35.414
  445    HH2  TRP  59           HH2      TRP  59   5.687  22.022 -34.910
  446    H    ARG  60           H        ARG  60   9.844  19.530 -42.346
  447    HA   ARG  60           HA       ARG  60   9.282  17.756 -40.495
  448    HB2  ARG  60           HB2      ARG  60   9.551  17.277 -42.868
  449    HB3  ARG  60           HB3      ARG  60  11.302  17.312 -42.709
  450    HG2  ARG  60           HG2      ARG  60  10.406  15.048 -42.906
  451    HG3  ARG  60           HG3      ARG  60  11.321  15.265 -41.427
  452    HD2  ARG  60           HD2      ARG  60   8.365  15.714 -41.184
  453    HD3  ARG  60           HD3      ARG  60   8.853  14.076 -41.629
  454    HE   ARG  60           HE       ARG  60  10.533  14.695 -39.512
  455   HH11  ARG  60          HH11      ARG  60   7.031  14.411 -39.767
  456   HH12  ARG  60          HH12      ARG  60   6.898  13.824 -38.127
  457   HH21  ARG  60          HH21      ARG  60  10.298  13.983 -37.555
  458   HH22  ARG  60          HH22      ARG  60   8.708  13.671 -36.860
  459    H    TRP  61           H        TRP  61   9.860  17.517 -38.526
  460    HA   TRP  61           HA       TRP  61  12.402  17.935 -37.369
  461    HB2  TRP  61           HB2      TRP  61   9.993  16.333 -36.396
  462    HB3  TRP  61           HB3      TRP  61  11.379  16.800 -35.410
  463    HD1  TRP  61           HD1      TRP  61   8.127  18.154 -36.660
  464    HE1  TRP  61           HE1      TRP  61   7.828  20.590 -35.856
  465    HE3  TRP  61           HE3      TRP  61  12.809  18.947 -34.826
  466    HZ2  TRP  61           HZ2      TRP  61   9.392  22.546 -34.378
  467    HZ3  TRP  61           HZ3      TRP  61  13.392  21.076 -33.711
  468    HH2  TRP  61           HH2      TRP  61  11.694  22.870 -33.463
  469    H    VAL  62           H        VAL  62  13.878  16.599 -36.435
  470    HA   VAL  62           HA       VAL  62  14.028  13.717 -37.215
  471    HB   VAL  62           HB       VAL  62  16.375  15.664 -37.051
  472   HG11  VAL  62          HG11      VAL  62  17.565  13.973 -38.368
  473   HG12  VAL  62          HG12      VAL  62  16.968  13.265 -36.876
  474   HG13  VAL  62          HG13      VAL  62  16.115  12.948 -38.407
  475   HG21  VAL  62          HG21      VAL  62  16.432  15.633 -39.543
  476   HG22  VAL  62          HG22      VAL  62  14.796  14.930 -39.535
  477   HG23  VAL  62          HG23      VAL  62  15.086  16.557 -38.863
  478    HA   PRO  63           HA       PRO  63  15.072  13.540 -32.740
  479    HB2  PRO  63           HB2      PRO  63  16.300  11.093 -32.607
  480    HB3  PRO  63           HB3      PRO  63  14.529  11.291 -32.735
  481    HG2  PRO  63           HG2      PRO  63  16.484  10.738 -34.981
  482    HG3  PRO  63           HG3      PRO  63  14.943   9.893 -34.620
  483    HD2  PRO  63           HD2      PRO  63  15.076  11.856 -36.484
  484    HD3  PRO  63           HD3      PRO  63  13.655  11.717 -35.411
  485    H    LEU  64           H        LEU  64  16.999  13.971 -31.558
  486    HA   LEU  64           HA       LEU  64  19.041  15.176 -33.048
  487    HB2  LEU  64           HB2      LEU  64  18.230  15.835 -30.833
  488    HB3  LEU  64           HB3      LEU  64  19.004  14.435 -30.098
  489    HG   LEU  64           HG       LEU  64  21.212  15.366 -30.497
  490   HD11  LEU  64          HD11      LEU  64  21.522  17.585 -31.570
  491   HD12  LEU  64          HD12      LEU  64  20.937  16.373 -32.712
  492   HD13  LEU  64          HD13      LEU  64  19.807  17.578 -32.045
  493   HD21  LEU  64          HD21      LEU  64  19.933  16.215 -28.559
  494   HD22  LEU  64          HD22      LEU  64  21.099  17.393 -29.184
  495   HD23  LEU  64          HD23      LEU  64  19.372  17.583 -29.550
  496    H    GLN  65           H        GLN  65  18.871  12.141 -33.477
  497    HA   GLN  65           HA       GLN  65  21.306  10.922 -32.489
  498    HB2  GLN  65           HB2      GLN  65  19.386  10.114 -34.707
  499    HB3  GLN  65           HB3      GLN  65  20.786   9.154 -34.204
  500    HG2  GLN  65           HG2      GLN  65  19.876   9.146 -31.850
  501    HG3  GLN  65           HG3      GLN  65  18.405   9.905 -32.473
  502   HE21  GLN  65          HE22      GLN  65  20.319   6.908 -32.389
  503   HE22  GLN  65          HE21      GLN  65  19.049   5.912 -33.092
  504    H    GLU  66           H        GLU  66  20.790  13.179 -35.008
  505    HA   GLU  66           HA       GLU  66  23.034  12.608 -36.700
  506    HB2  GLU  66           HB2      GLU  66  22.865  15.010 -37.300
  507    HB3  GLU  66           HB3      GLU  66  21.342  14.129 -37.420
  508    HG2  GLU  66           HG2      GLU  66  20.539  15.110 -35.321
  509    HG3  GLU  66           HG3      GLU  66  22.108  15.870 -35.040
  510    H    ASP  67           H        ASP  67  22.966  13.645 -33.410
  511    HA   ASP  67           HA       ASP  67  25.935  13.659 -33.420
  512    HB2  ASP  67           HB2      ASP  67  25.267  16.045 -33.476
  513    HB3  ASP  67           HB3      ASP  67  24.251  15.800 -32.056
  514    H    ALA  68           H        ALA  68  22.964  13.659 -31.402
  515    HA   ALA  68           HA       ALA  68  24.217  12.157 -29.215
  516    HB1  ALA  68           HB1      ALA  68  21.341  13.044 -29.719
  517    HB2  ALA  68           HB2      ALA  68  21.990  12.417 -28.200
  518    HB3  ALA  68           HB3      ALA  68  22.566  13.969 -28.819
  519    H    ALA  69           H        ALA  69  24.622  10.697 -31.429
  520    HA   ALA  69           HA       ALA  69  22.799   9.180 -32.704
  521    HB1  ALA  69           HB1      ALA  69  24.628   7.624 -33.193
  522    HB2  ALA  69           HB2      ALA  69  25.184   9.307 -33.227
  523    HB3  ALA  69           HB3      ALA  69  25.561   8.274 -31.827
  524    H    ASP  70           H        ASP  70  23.935   8.278 -29.483
  525    HA   ASP  70           HA       ASP  70  21.880   6.104 -29.397
  526    HB2  ASP  70           HB2      ASP  70  24.248   5.304 -29.713
  527    HB3  ASP  70           HB3      ASP  70  24.657   6.035 -28.162
  528    H    GLU  71           H        GLU  71  22.102   9.035 -28.373
  529    HA   GLU  71           HA       GLU  71  21.037   8.514 -25.649
  530    HB2  GLU  71           HB2      GLU  71  22.512  10.072 -24.569
  531    HB3  GLU  71           HB3      GLU  71  23.453   8.825 -25.376
  532    HG2  GLU  71           HG2      GLU  71  23.852  10.437 -27.286
  533    HG3  GLU  71           HG3      GLU  71  23.021  11.678 -26.344
  534    H    SER  72           H        SER  72  20.427   9.967 -28.517
  535    HA   SER  72           HA       SER  72  19.346  12.491 -27.949
  536    HB2  SER  72           HB2      SER  72  17.964  12.186 -29.901
  537    HB3  SER  72           HB3      SER  72  19.530  11.431 -30.222
  538    HG   SER  72           HG       SER  72  18.587   9.408 -29.817
  539    H    GLN  73           H        GLN  73  18.172   9.468 -26.800
  540    HA   GLN  73           HA       GLN  73  15.734  10.593 -25.657
  541    HB2  GLN  73           HB2      GLN  73  14.255   9.038 -26.889
  542    HB3  GLN  73           HB3      GLN  73  15.135  10.096 -27.980
  543    HG2  GLN  73           HG2      GLN  73  16.791   8.132 -28.308
  544    HG3  GLN  73           HG3      GLN  73  15.601   7.137 -27.459
  545   HE21  GLN  73          HE22      GLN  73  16.073   9.312 -30.262
  546   HE22  GLN  73          HE21      GLN  73  14.768   8.592 -31.219
  547    H    ASN  74           H        ASN  74  14.471   8.965 -24.543
  548    HA   ASN  74           HA       ASN  74  14.041   7.458 -22.953
  549    HB2  ASN  74           HB2      ASN  74  14.167   6.027 -24.943
  550    HB3  ASN  74           HB3      ASN  74  15.872   5.710 -24.628
  551   HD21  ASN  74          HD22      ASN  74  16.255   3.804 -23.552
  552   HD22  ASN  74          HD21      ASN  74  15.098   3.030 -22.488
  553    H    ASP  75           H        ASP  75  17.598   7.531 -23.303
  554    HA   ASP  75           HA       ASP  75  18.140   6.513 -20.640
  555    HB2  ASP  75           HB2      ASP  75  19.670   6.220 -22.536
  556    HB3  ASP  75           HB3      ASP  75  19.874   7.965 -22.676
  557    H    TRP  76           H        TRP  76  16.497   8.031 -19.678
  558    HA   TRP  76           HA       TRP  76  17.657  10.719 -19.047
  559    HB2  TRP  76           HB2      TRP  76  15.727  10.433 -20.706
  560    HB3  TRP  76           HB3      TRP  76  14.732   9.999 -19.337
  561    HD1  TRP  76           HD1      TRP  76  13.149  11.966 -19.184
  562    HE1  TRP  76           HE1      TRP  76  13.305  14.511 -19.041
  563    HE3  TRP  76           HE3      TRP  76  18.206  12.538 -19.944
  564    HZ2  TRP  76           HZ2      TRP  76  15.316  16.529 -19.292
  565    HZ3  TRP  76           HZ3      TRP  76  19.192  14.793 -19.978
  566    HH2  TRP  76           HH2      TRP  76  17.772  16.807 -19.685
  567    H    ASP  77           H        ASP  77  16.007   7.951 -17.528
  568    HA   ASP  77           HA       ASP  77  16.589   9.096 -14.906
  569    HB2  ASP  77           HB2      ASP  77  14.192   9.905 -15.973
  570    HB3  ASP  77           HB3      ASP  77  13.686   8.421 -15.176
  571    H    GLU  78           H        GLU  78  15.489   7.684 -13.150
  572    HA   GLU  78           HA       GLU  78  15.918   4.765 -13.750
  573    HB2  GLU  78           HB2      GLU  78  16.640   6.213 -11.181
  574    HB3  GLU  78           HB3      GLU  78  17.029   4.560 -11.609
  575    HG2  GLU  78           HG2      GLU  78  18.208   7.099 -12.797
  576    HG3  GLU  78           HG3      GLU  78  18.981   5.994 -11.676
  577    H    GLU  79           H        GLU  79  13.996   7.171 -12.039
  578    HA   GLU  79           HA       GLU  79  12.259   5.040 -10.820
  579    HB2  GLU  79           HB2      GLU  79  13.447   7.520  -9.513
  580    HB3  GLU  79           HB3      GLU  79  12.241   6.503  -8.745
  581    HG2  GLU  79           HG2      GLU  79  14.979   5.447  -9.532
  582    HG3  GLU  79           HG3      GLU  79  14.624   6.240  -8.014
  583    H    LEU  80           H        LEU  80  11.965   7.206 -13.120
  584    HA   LEU  80           HA       LEU  80   9.562   8.607 -11.991
  585    HB2  LEU  80           HB2      LEU  80  11.913   9.529 -13.625
  586    HB3  LEU  80           HB3      LEU  80  10.393  10.314 -13.883
  587    HG   LEU  80           HG       LEU  80  11.804  11.570 -12.375
  588   HD11  LEU  80          HD11      LEU  80   9.287  11.627 -12.268
  589   HD12  LEU  80          HD12      LEU  80   9.367  10.502 -10.898
  590   HD13  LEU  80          HD13      LEU  80  10.108  12.102 -10.765
  591   HD21  LEU  80          HD21      LEU  80  11.388   9.487 -10.215
  592   HD22  LEU  80          HD22      LEU  80  12.885   9.629 -11.168
  593   HD23  LEU  80          HD23      LEU  80  12.333  10.978 -10.168
  594    H    SER  81           H        SER  81   7.929   9.196 -13.197
  595    HA   SER  81           HA       SER  81   7.613   8.374 -16.045
  596    HB2  SER  81           HB2      SER  81   5.540   8.222 -13.807
  597    HB3  SER  81           HB3      SER  81   5.206   7.996 -15.535
  598    HG   SER  81           HG       SER  81   5.507   5.997 -14.498
  599    H    ILE  82           H        ILE  82   6.832  10.046 -17.303
  600    HA   ILE  82           HA       ILE  82   6.497  12.688 -15.950
  601    HB   ILE  82           HB       ILE  82   8.083  11.734 -18.305
  602   HG12  ILE  82          HG12      ILE  82   9.640  13.498 -17.544
  603   HG13  ILE  82          HG13      ILE  82   8.486  14.004 -16.311
  604   HG21  ILE  82          HG21      ILE  82   6.792  14.480 -18.241
  605   HG22  ILE  82          HG22      ILE  82   8.196  14.059 -19.224
  606   HG23  ILE  82          HG23      ILE  82   6.663  13.235 -19.513
  607   HD11  ILE  82          HD11      ILE  82   8.833  11.972 -15.058
  608   HD12  ILE  82          HD12      ILE  82   9.750  11.234 -16.400
  609   HD13  ILE  82          HD13      ILE  82  10.418  12.609 -15.496
  610    H    HIS  83           H        HIS  83   4.948  14.035 -16.492
  611    HA   HIS  83           HA       HIS  83   2.805  13.212 -18.407
  612    HB2  HIS  83           HB2      HIS  83   2.457  14.011 -15.489
  613    HB3  HIS  83           HB3      HIS  83   1.166  13.626 -16.626
  614    HD1  HIS  83           HD1      HIS  83   0.978  10.947 -17.314
  615    HD2  HIS  83           HD2      HIS  83   3.770  11.987 -14.342
  616    HE1  HIS  83           HE1      HIS  83   1.697   8.765 -16.212
  617    H    LEU  84           H        LEU  84   3.505  14.929 -19.835
  618    HA   LEU  84           HA       LEU  84   3.560  17.696 -18.957
  619    HB2  LEU  84           HB2      LEU  84   3.732  16.255 -21.605
  620    HB3  LEU  84           HB3      LEU  84   3.190  17.920 -21.614
  621    HG   LEU  84           HG       LEU  84   5.235  18.605 -20.345
  622   HD11  LEU  84          HD11      LEU  84   6.086  15.750 -20.951
  623   HD12  LEU  84          HD12      LEU  84   7.184  17.050 -20.446
  624   HD13  LEU  84          HD13      LEU  84   5.905  16.496 -19.351
  625   HD21  LEU  84          HD21      LEU  84   6.711  18.480 -22.312
  626   HD22  LEU  84          HD22      LEU  84   5.637  17.262 -23.042
  627   HD23  LEU  84          HD23      LEU  84   5.057  18.915 -22.761
  628    H    GLN  85           H        GLN  85   2.190  19.318 -19.577
  629    HA   GLN  85           HA       GLN  85  -0.448  18.717 -20.699
  630    HB2  GLN  85           HB2      GLN  85  -0.693  20.658 -18.482
  631    HB3  GLN  85           HB3      GLN  85  -1.802  19.453 -19.074
  632    HG2  GLN  85           HG2      GLN  85  -1.433  18.735 -16.924
  633    HG3  GLN  85           HG3      GLN  85  -0.303  17.713 -17.781
  634   HE21  GLN  85          HE22      GLN  85   1.737  17.638 -16.619
  635   HE22  GLN  85          HE21      GLN  85   2.285  19.009 -15.663
  636    HA   PRO  86           HA       PRO  86  -2.263  20.052 -21.425
  637    HB2  PRO  86           HB2      PRO  86  -3.073  21.173 -23.758
  638    HB3  PRO  86           HB3      PRO  86  -3.086  22.078 -22.215
  639    HG2  PRO  86           HG2      PRO  86  -0.948  22.130 -24.375
  640    HG3  PRO  86           HG3      PRO  86  -1.766  23.524 -23.597
  641    HD2  PRO  86           HD2      PRO  86   0.665  22.600 -22.747
  642    HD3  PRO  86           HD3      PRO  86  -0.544  23.249 -21.604
  643    H    PHE  87           H        PHE  87   0.579  19.990 -23.430
  644    HA   PHE  87           HA       PHE  87  -0.182  18.300 -25.549
  645    HB2  PHE  87           HB2      PHE  87   2.510  18.534 -24.149
  646    HB3  PHE  87           HB3      PHE  87   2.224  17.819 -25.728
  647    HD1  PHE  87           HD1      PHE  87   1.197  19.299 -27.584
  648    HD2  PHE  87           HD2      PHE  87   2.951  20.884 -23.973
  649    HE1  PHE  87           HE1      PHE  87   1.449  21.515 -28.676
  650    HE2  PHE  87           HE2      PHE  87   3.192  23.101 -25.074
  651    HZ   PHE  87           HZ       PHE  87   2.440  23.418 -27.417
  652    H    LYS  88           H        LYS  88  -0.909  16.288 -25.568
  653    HA   LYS  88           HA       LYS  88  -1.102  14.637 -23.320
  654    HB2  LYS  88           HB2      LYS  88  -2.175  13.069 -24.649
  655    HB3  LYS  88           HB3      LYS  88  -2.546  14.604 -25.401
  656    HG2  LYS  88           HG2      LYS  88  -0.515  12.544 -26.368
  657    HG3  LYS  88           HG3      LYS  88  -2.127  12.806 -27.013
  658    HD2  LYS  88           HD2      LYS  88  -1.459  15.091 -27.773
  659    HD3  LYS  88           HD3      LYS  88   0.166  14.813 -27.133
  660    HE2  LYS  88           HE2      LYS  88   0.273  14.419 -29.471
  661    HE3  LYS  88           HE3      LYS  88   0.449  12.867 -28.650
  662    HZ1  LYS  88           HZ1      LYS  88  -1.912  12.420 -29.174
  663    HZ2  LYS  88           HZ2      LYS  88  -2.063  13.870 -29.910
  664    HZ3  LYS  88           HZ3      LYS  88  -1.092  12.732 -30.545
  665    HA   PRO  89           HA       PRO  89   2.781  12.468 -23.179
  666    HB2  PRO  89           HB2      PRO  89   2.271  10.512 -21.373
  667    HB3  PRO  89           HB3      PRO  89   2.177  12.239 -20.946
  668    HG2  PRO  89           HG2      PRO  89  -0.118  10.418 -21.765
  669    HG3  PRO  89           HG3      PRO  89  -0.003  11.457 -20.306
  670    HD2  PRO  89           HD2      PRO  89  -1.253  12.282 -22.596
  671    HD3  PRO  89           HD3      PRO  89  -0.340  13.415 -21.555
  672    H    ASP  90           H        ASP  90   2.210  11.989 -25.595
  673    HA   ASP  90           HA       ASP  90   2.445   9.090 -26.079
  674    HB2  ASP  90           HB2      ASP  90  -0.037   9.636 -26.123
  675    HB3  ASP  90           HB3      ASP  90   0.306  10.720 -27.483
  676    H    ASP  91           H        ASP  91   3.090   8.615 -28.339
  677    HA   ASP  91           HA       ASP  91   5.077  10.559 -29.141
  678    HB2  ASP  91           HB2      ASP  91   5.456   8.083 -29.065
  679    HB3  ASP  91           HB3      ASP  91   4.554   7.965 -30.579
  680    H    SER  92           H        SER  92   4.046  12.304 -29.762
  681    HA   SER  92           HA       SER  92   2.321  12.716 -31.956
  682    HB2  SER  92           HB2      SER  92   3.409  15.079 -31.788
  683    HB3  SER  92           HB3      SER  92   2.541  14.424 -30.404
  684    HG   SER  92           HG       SER  92   5.321  14.819 -30.683
  685    H    ASN  93           H        ASN  93   5.385  11.374 -32.332
  686    HA   ASN  93           HA       ASN  93   7.010  11.323 -33.806
  687    HB2  ASN  93           HB2      ASN  93   6.538  10.898 -36.008
  688    HB3  ASN  93           HB3      ASN  93   5.062  10.460 -35.174
  689   HD21  ASN  93          HD22      ASN  93   3.167  11.332 -36.024
  690   HD22  ASN  93          HD21      ASN  93   3.151  12.621 -37.212
  691    H    GLN  94           H        GLN  94   6.098  14.121 -32.837
  692    HA   GLN  94           HA       GLN  94   8.337  15.619 -34.038
  693    HB2  GLN  94           HB2      GLN  94   6.987  17.605 -34.321
  694    HB3  GLN  94           HB3      GLN  94   6.215  16.321 -35.222
  695    HG2  GLN  94           HG2      GLN  94   4.404  16.184 -33.687
  696    HG3  GLN  94           HG3      GLN  94   5.280  16.981 -32.387
  697   HE21  GLN  94          HE22      GLN  94   5.399  19.240 -32.282
  698   HE22  GLN  94          HE21      GLN  94   4.427  20.247 -33.356
  699    HA   PRO  95           HA       PRO  95   8.627  16.703 -29.672
  700    HB2  PRO  95           HB2      PRO  95   9.547  19.240 -29.604
  701    HB3  PRO  95           HB3      PRO  95  10.562  17.834 -30.070
  702    HG2  PRO  95           HG2      PRO  95   9.144  19.819 -31.882
  703    HG3  PRO  95           HG3      PRO  95  10.833  19.232 -32.002
  704    HD2  PRO  95           HD2      PRO  95   8.785  18.183 -33.464
  705    HD3  PRO  95           HD3      PRO  95  10.141  17.171 -32.907
  706    H    GLN  96           H        GLN  96   7.578  17.826 -28.036
  707    HA   GLN  96           HA       GLN  96   5.039  19.235 -28.801
  708    HB2  GLN  96           HB2      GLN  96   5.966  17.696 -26.355
  709    HB3  GLN  96           HB3      GLN  96   4.483  18.654 -26.371
  710    HG2  GLN  96           HG2      GLN  96   3.402  17.243 -27.924
  711    HG3  GLN  96           HG3      GLN  96   4.915  16.613 -28.561
  712   HE21  GLN  96          HE22      GLN  96   4.393  14.422 -28.295
  713   HE22  GLN  96          HE21      GLN  96   4.391  13.710 -26.672
  714    H    VAL  97           H        VAL  97   7.857  19.422 -26.572
  715    HA   VAL  97           HA       VAL  97   7.277  22.242 -25.883
  716    HB   VAL  97           HB       VAL  97   9.834  20.648 -25.422
  717   HG11  VAL  97          HG11      VAL  97  10.199  22.400 -23.654
  718   HG12  VAL  97          HG12      VAL  97  10.213  23.066 -25.285
  719   HG13  VAL  97          HG13      VAL  97   8.774  23.270 -24.267
  720   HG21  VAL  97          HG21      VAL  97   8.997  20.437 -23.074
  721   HG22  VAL  97          HG22      VAL  97   7.437  21.107 -23.598
  722   HG23  VAL  97          HG23      VAL  97   8.003  19.546 -24.230
  723    H    VAL  98           H        VAL  98   8.145  23.997 -26.960
  724    HA   VAL  98           HA       VAL  98  10.080  23.553 -29.177
  725    HB   VAL  98           HB       VAL  98   7.447  25.054 -29.420
  726   HG11  VAL  98          HG11      VAL  98   9.180  26.242 -30.700
  727   HG12  VAL  98          HG12      VAL  98   9.733  24.709 -31.422
  728   HG13  VAL  98          HG13      VAL  98   8.130  25.370 -31.810
  729   HG21  VAL  98          HG21      VAL  98   8.481  22.535 -30.805
  730   HG22  VAL  98          HG22      VAL  98   7.125  22.630 -29.660
  731   HG23  VAL  98          HG23      VAL  98   6.990  23.401 -31.237
  732    H    ILE  99           H        ILE  99  11.493  25.090 -29.464
  733    HA   ILE  99           HA       ILE  99  11.638  27.428 -27.600
  734    HB   ILE  99           HB       ILE  99  13.843  25.533 -28.574
  735   HG12  ILE  99          HG12      ILE  99  14.100  25.163 -25.998
  736   HG13  ILE  99          HG13      ILE  99  12.413  25.639 -25.905
  737   HG21  ILE  99          HG21      ILE  99  13.943  27.880 -26.632
  738   HG22  ILE  99          HG22      ILE  99  15.272  26.762 -27.030
  739   HG23  ILE  99          HG23      ILE  99  14.647  27.838 -28.258
  740   HD11  ILE  99          HD11      ILE  99  11.784  23.695 -27.289
  741   HD12  ILE  99          HD12      ILE  99  13.496  23.337 -27.596
  742   HD13  ILE  99          HD13      ILE  99  12.816  23.161 -25.971
  743    H    LEU 100           H        LEU 100  11.770  29.337 -28.731
  744    HA   LEU 100           HA       LEU 100  12.514  29.290 -31.594
  745    HB2  LEU 100           HB2      LEU 100  11.823  31.696 -29.881
  746    HB3  LEU 100           HB3      LEU 100  11.892  31.606 -31.636
  747    HG   LEU 100           HG       LEU 100   9.778  30.519 -29.767
  748   HD11  LEU 100          HD11      LEU 100   8.302  31.881 -31.137
  749   HD12  LEU 100          HD12      LEU 100   9.695  32.885 -30.694
  750   HD13  LEU 100          HD13      LEU 100   9.598  32.196 -32.313
  751   HD21  LEU 100          HD21      LEU 100   8.627  29.508 -31.702
  752   HD22  LEU 100          HD22      LEU 100  10.015  29.893 -32.739
  753   HD23  LEU 100          HD23      LEU 100  10.172  28.700 -31.425
  754    H    ALA 101           H        ALA 101  14.081  30.725 -32.430
  755    HA   ALA 101           HA       ALA 101  16.688  30.517 -31.368
  756    HB1  ALA 101           HB1      ALA 101  15.526  32.480 -33.397
  757    HB2  ALA 101           HB2      ALA 101  17.250  32.159 -33.168
  758    HB3  ALA 101           HB3      ALA 101  16.181  30.863 -33.746
  759    H    ASP 102           H        ASP 102  14.298  32.983 -30.699
  760    HA   ASP 102           HA       ASP 102  16.080  35.005 -29.618
  761    HB2  ASP 102           HB2      ASP 102  13.940  35.530 -30.668
  762    HB3  ASP 102           HB3      ASP 102  13.080  34.512 -29.519
  763    H    GLY 103           H        GLY 103  14.880  32.025 -28.318
  764    HA2  GLY 103           HA2      GLY 103  15.306  31.141 -26.212
  765    HA3  GLY 103           HA3      GLY 103  15.686  32.737 -25.559
  766    H    GLN 104           H        GLN 104  12.730  32.730 -27.308
  767    HA   GLN 104           HA       GLN 104  11.118  32.602 -24.836
  768    HB2  GLN 104           HB2      GLN 104   9.287  33.485 -26.124
  769    HB3  GLN 104           HB3      GLN 104  10.707  34.520 -26.220
  770    HG2  GLN 104           HG2      GLN 104  11.200  33.466 -28.486
  771    HG3  GLN 104           HG3      GLN 104   9.632  32.646 -28.356
  772   HE21  GLN 104          HE22      GLN 104  11.188  35.899 -28.270
  773   HE22  GLN 104          HE21      GLN 104   9.791  36.729 -28.965
  774    H    ILE 105           H        ILE 105   9.469  31.102 -24.633
  775    HA   ILE 105           HA       ILE 105   9.935  28.537 -26.121
  776    HB   ILE 105           HB       ILE 105   9.396  28.677 -23.146
  777   HG12  ILE 105          HG12      ILE 105  11.409  30.007 -23.317
  778   HG13  ILE 105          HG13      ILE 105  11.715  28.472 -22.543
  779   HG21  ILE 105          HG21      ILE 105  10.637  26.474 -23.194
  780   HG22  ILE 105          HG22      ILE 105   9.116  26.485 -24.095
  781   HG23  ILE 105          HG23      ILE 105  10.662  26.600 -24.962
  782   HD11  ILE 105          HD11      ILE 105  13.540  29.138 -24.022
  783   HD12  ILE 105          HD12      ILE 105  12.806  27.625 -24.575
  784   HD13  ILE 105          HD13      ILE 105  12.461  29.167 -25.411
  785    H    THR 106           H        THR 106   8.111  27.144 -26.276
  786    HA   THR 106           HA       THR 106   5.495  28.285 -26.212
  787    HB   THR 106           HB       THR 106   6.119  26.268 -27.482
  788    HG1  THR 106           HG1      THR 106   4.115  25.375 -27.203
  789   HG21  THR 106          HG21      THR 106   5.742  24.689 -24.917
  790   HG22  THR 106          HG22      THR 106   6.089  24.084 -26.547
  791   HG23  THR 106          HG23      THR 106   7.323  25.015 -25.659
  792    HA   PRO 107           HA       PRO 107   4.803  27.959 -21.746
  793    HB2  PRO 107           HB2      PRO 107   2.197  28.767 -21.580
  794    HB3  PRO 107           HB3      PRO 107   3.587  29.867 -21.809
  795    HG2  PRO 107           HG2      PRO 107   1.657  28.844 -23.877
  796    HG3  PRO 107           HG3      PRO 107   2.388  30.477 -23.707
  797    HD2  PRO 107           HD2      PRO 107   3.287  28.516 -25.468
  798    HD3  PRO 107           HD3      PRO 107   4.307  29.836 -24.820
  799    H    PHE 108           H        PHE 108   4.712  26.011 -20.892
  800    HA   PHE 108           HA       PHE 108   2.360  24.268 -21.048
  801    HB2  PHE 108           HB2      PHE 108   3.454  22.372 -21.860
  802    HB3  PHE 108           HB3      PHE 108   4.006  23.631 -22.940
  803    HD1  PHE 108           HD1      PHE 108   6.328  24.727 -22.380
  804    HD2  PHE 108           HD2      PHE 108   5.020  20.964 -20.765
  805    HE1  PHE 108           HE1      PHE 108   8.673  24.168 -21.819
  806    HE2  PHE 108           HE2      PHE 108   7.376  20.388 -20.235
  807    HZ   PHE 108           HZ       PHE 108   9.195  22.002 -20.711
  808    H    SER 109           H        SER 109   2.878  22.239 -19.606
  809    HA   SER 109           HA       SER 109   4.767  22.847 -17.424
  810    HB2  SER 109           HB2      SER 109   1.819  22.285 -17.047
  811    HB3  SER 109           HB3      SER 109   3.011  22.014 -15.754
  812    HG   SER 109           HG       SER 109   2.691  24.471 -17.143
  813    H    LEU 110           H        LEU 110   5.383  21.022 -16.218
  814    HA   LEU 110           HA       LEU 110   5.125  18.347 -17.548
  815    HB2  LEU 110           HB2      LEU 110   7.019  19.055 -18.565
  816    HB3  LEU 110           HB3      LEU 110   7.425  20.228 -17.327
  817    HG   LEU 110           HG       LEU 110   8.448  18.487 -15.935
  818   HD11  LEU 110          HD11      LEU 110   7.990  16.583 -18.255
  819   HD12  LEU 110          HD12      LEU 110   8.870  16.263 -16.758
  820   HD13  LEU 110          HD13      LEU 110   7.119  16.490 -16.703
  821   HD21  LEU 110          HD21      LEU 110   9.771  19.732 -17.596
  822   HD22  LEU 110          HD22      LEU 110  10.382  18.087 -17.372
  823   HD23  LEU 110          HD23      LEU 110   9.425  18.487 -18.813
  824    H    LEU 111           H        LEU 111   4.151  17.148 -15.955
  825    HA   LEU 111           HA       LEU 111   5.051  17.501 -13.144
  826    HB2  LEU 111           HB2      LEU 111   2.701  17.729 -13.589
  827    HB3  LEU 111           HB3      LEU 111   2.609  16.146 -14.350
  828    HG   LEU 111           HG       LEU 111   3.651  16.327 -11.524
  829   HD11  LEU 111          HD11      LEU 111   1.359  16.234 -10.623
  830   HD12  LEU 111          HD12      LEU 111   1.681  17.760 -11.463
  831   HD13  LEU 111          HD13      LEU 111   0.703  16.503 -12.257
  832   HD21  LEU 111          HD21      LEU 111   3.500  14.091 -12.709
  833   HD22  LEU 111          HD22      LEU 111   2.481  14.175 -11.272
  834   HD23  LEU 111          HD23      LEU 111   1.758  14.343 -12.884
  835    H    MET 112           H        MET 112   5.825  15.843 -11.935
  836    HA   MET 112           HA       MET 112   6.920  13.452 -13.379
  837    HB2  MET 112           HB2      MET 112   8.177  15.345 -11.348
  838    HB3  MET 112           HB3      MET 112   8.869  13.793 -11.783
  839    HG2  MET 112           HG2      MET 112   8.985  14.516 -14.158
  840    HG3  MET 112           HG3      MET 112   8.406  16.118 -13.679
  841    HE1  MET 112           HE1      MET 112  11.136  15.475 -15.326
  842    HE2  MET 112           HE2      MET 112  10.578  17.123 -14.944
  843    HE3  MET 112           HE3      MET 112  12.243  16.634 -14.558
  844    H    ALA 113           H        ALA 113   6.365  11.572 -12.527
  845    HA   ALA 113           HA       ALA 113   5.474  11.387  -9.687
  846    HB1  ALA 113           HB1      ALA 113   3.740   9.833 -10.457
  847    HB2  ALA 113           HB2      ALA 113   3.557  11.426 -11.218
  848    HB3  ALA 113           HB3      ALA 113   4.257  10.075 -12.141
  849    H    ASN 114           H        ASN 114   6.128   9.623  -8.525
  850    HA   ASN 114           HA       ASN 114   8.497   8.248  -9.316
  851    HB2  ASN 114           HB2      ASN 114   7.999   8.744  -7.016
  852    HB3  ASN 114           HB3      ASN 114   6.517   7.812  -7.061
  853   HD21  ASN 114          HD22      ASN 114   7.697   6.898  -5.069
  854   HD22  ASN 114          HD21      ASN 114   8.841   5.583  -5.383
  855    H    ALA 115           H        ALA 115   8.707   6.579 -10.640
  856    HA   ALA 115           HA       ALA 115   6.586   5.144 -11.891
  857    HB1  ALA 115           HB1      ALA 115   9.542   4.445 -11.616
  858    HB2  ALA 115           HB2      ALA 115   8.413   3.760 -12.804
  859    HB3  ALA 115           HB3      ALA 115   8.820   5.482 -12.870
  860    H    GLY 116           H        GLY 116   8.146   4.536  -8.807
  861    HA2  GLY 116           HA2      GLY 116   7.397   1.712  -8.622
  862    HA3  GLY 116           HA3      GLY 116   8.129   2.725  -7.379
  863    H    THR 117           H        THR 117   5.781   4.754  -7.710
  864    HA   THR 117           HA       THR 117   3.746   3.250  -6.123
  865    HB   THR 117           HB       THR 117   3.681   5.232  -4.707
  866    HG1  THR 117           HG1      THR 117   5.511   6.730  -5.028
  867   HG21  THR 117          HG21      THR 117   5.729   4.966  -3.503
  868   HG22  THR 117          HG22      THR 117   5.358   3.383  -4.219
  869   HG23  THR 117          HG23      THR 117   6.594   4.413  -4.953
  870    H    GLY 118           H        GLY 118   4.285   5.744  -8.550
  871    HA2  GLY 118           HA2      GLY 118   2.711   6.673 -10.007
  872    HA3  GLY 118           HA3      GLY 118   1.385   6.075  -9.000
  873    H    GLU 119           H        GLU 119   3.553   7.515  -6.876
  874    HA   GLU 119           HA       GLU 119   1.746   9.757  -6.447
  875    HB2  GLU 119           HB2      GLU 119   4.327   8.884  -5.103
  876    HB3  GLU 119           HB3      GLU 119   3.320  10.216  -4.534
  877    HG2  GLU 119           HG2      GLU 119   2.407   7.310  -4.745
  878    HG3  GLU 119           HG3      GLU 119   2.971   8.091  -3.279
  879    HA   PRO 120           HA       PRO 120   4.269  12.779  -8.674
  880    HB2  PRO 120           HB2      PRO 120   3.223  15.113  -7.744
  881    HB3  PRO 120           HB3      PRO 120   2.347  14.037  -8.871
  882    HG2  PRO 120           HG2      PRO 120   2.055  14.195  -5.858
  883    HG3  PRO 120           HG3      PRO 120   0.761  14.184  -7.099
  884    HD2  PRO 120           HD2      PRO 120   1.539  11.927  -5.760
  885    HD3  PRO 120           HD3      PRO 120   1.013  11.871  -7.471
  886    H    LEU 121           H        LEU 121   6.149  13.900  -8.285
  887    HA   LEU 121           HA       LEU 121   6.979  14.388  -5.423
  888    HB2  LEU 121           HB2      LEU 121   9.036  14.218  -7.621
  889    HB3  LEU 121           HB3      LEU 121   9.201  14.007  -5.911
  890    HG   LEU 121           HG       LEU 121   9.696  11.945  -6.975
  891   HD11  LEU 121          HD11      LEU 121   6.900  11.482  -5.934
  892   HD12  LEU 121          HD12      LEU 121   8.343  10.453  -5.799
  893   HD13  LEU 121          HD13      LEU 121   8.244  11.937  -4.866
  894   HD21  LEU 121          HD21      LEU 121   8.581  10.900  -8.617
  895   HD22  LEU 121          HD22      LEU 121   7.061  11.775  -8.316
  896   HD23  LEU 121          HD23      LEU 121   8.443  12.617  -9.063
  897    H    LEU 122           H        LEU 122   7.073  15.558  -8.758
  898    HA   LEU 122           HA       LEU 122   7.668  18.337  -7.891
  899    HB2  LEU 122           HB2      LEU 122   9.766  16.790  -8.263
  900    HB3  LEU 122           HB3      LEU 122   9.292  16.770  -9.938
  901    HG   LEU 122           HG       LEU 122   9.459  19.393  -9.814
  902   HD11  LEU 122          HD11      LEU 122   9.562  19.460  -7.281
  903   HD12  LEU 122          HD12      LEU 122  11.128  18.651  -7.366
  904   HD13  LEU 122          HD13      LEU 122  10.915  20.272  -8.073
  905   HD21  LEU 122          HD21      LEU 122  11.071  17.918 -10.971
  906   HD22  LEU 122          HD22      LEU 122  11.859  19.299 -10.212
  907   HD23  LEU 122          HD23      LEU 122  11.943  17.696  -9.441
  908    H    THR 123           H        THR 123   7.347  19.888  -9.568
  909    HA   THR 123           HA       THR 123   6.323  19.009 -12.193
  910    HB   THR 123           HB       THR 123   4.795  20.961 -10.436
  911    HG1  THR 123           HG1      THR 123   4.709  18.250 -10.655
  912   HG21  THR 123          HG21      THR 123   2.986  20.695 -12.097
  913   HG22  THR 123          HG22      THR 123   4.424  21.437 -12.816
  914   HG23  THR 123          HG23      THR 123   4.063  19.717 -13.113
  915    H    LEU 124           H        LEU 124   6.875  20.383 -13.781
  916    HA   LEU 124           HA       LEU 124   8.349  22.889 -13.127
  917    HB2  LEU 124           HB2      LEU 124   8.740  20.709 -15.169
  918    HB3  LEU 124           HB3      LEU 124   9.086  22.361 -15.658
  919    HG   LEU 124           HG       LEU 124  10.665  22.650 -13.825
  920   HD11  LEU 124          HD11      LEU 124  11.454  20.801 -12.466
  921   HD12  LEU 124          HD12      LEU 124   9.746  20.983 -12.192
  922   HD13  LEU 124          HD13      LEU 124  10.311  19.671 -13.246
  923   HD21  LEU 124          HD21      LEU 124  11.238  20.170 -15.488
  924   HD22  LEU 124          HD22      LEU 124  11.424  21.856 -16.025
  925   HD23  LEU 124          HD23      LEU 124  12.438  21.234 -14.715
  926    H    VAL 125           H        VAL 125   7.871  24.738 -14.242
  927    HA   VAL 125           HA       VAL 125   5.330  24.812 -15.807
  928    HB   VAL 125           HB       VAL 125   6.001  26.574 -13.418
  929   HG11  VAL 125          HG11      VAL 125   4.532  27.708 -15.041
  930   HG12  VAL 125          HG12      VAL 125   3.429  26.310 -15.032
  931   HG13  VAL 125          HG13      VAL 125   3.646  27.302 -13.575
  932   HG21  VAL 125          HG21      VAL 125   4.029  24.251 -13.580
  933   HG22  VAL 125          HG22      VAL 125   5.473  24.347 -12.548
  934   HG23  VAL 125          HG23      VAL 125   4.124  25.426 -12.241
  935    H    CYS 126           H        CYS 126   5.234  26.225 -17.443
  936    HA   CYS 126           HA       CYS 126   7.494  28.159 -17.818
  937    HB2  CYS 126           HB2      CYS 126   7.242  26.153 -19.407
  938    HB3  CYS 126           HB3      CYS 126   5.711  26.864 -19.898
  939    HG   CYS 126           HG       CYS 126   7.361  27.421 -21.784
  940    H    SER 127           H        SER 127   7.047  30.166 -18.736
  941    HA   SER 127           HA       SER 127   4.210  31.136 -18.769
  942    HB2  SER 127           HB2      SER 127   6.614  32.596 -17.612
  943    HB3  SER 127           HB3      SER 127   4.949  33.202 -17.687
  944    HG   SER 127           HG       SER 127   5.461  32.305 -15.643
  945    H    GLY 128           H        GLY 128   6.514  30.477 -20.866
  946    HA2  GLY 128           HA2      GLY 128   6.158  31.240 -23.133
  947    HA3  GLY 128           HA3      GLY 128   6.012  32.893 -22.565
  948    H    SER 129           H        SER 129   8.573  31.764 -20.824
  949    HA   SER 129           HA       SER 129  10.668  32.423 -22.836
  950    HB2  SER 129           HB2      SER 129  10.100  34.060 -20.335
  951    HB3  SER 129           HB3      SER 129  11.551  34.212 -21.341
  952    HG   SER 129           HG       SER 129   9.935  35.749 -21.882
  953    H    TRP 130           H        TRP 130  12.759  31.865 -22.314
  954    HA   TRP 130           HA       TRP 130  13.355  29.801 -20.550
  955    HB2  TRP 130           HB2      TRP 130  14.771  30.295 -22.370
  956    HB3  TRP 130           HB3      TRP 130  14.936  31.981 -21.918
  957    HD1  TRP 130           HD1      TRP 130  16.925  32.693 -20.543
  958    HE1  TRP 130           HE1      TRP 130  18.851  31.541 -19.302
  959    HE3  TRP 130           HE3      TRP 130  15.393  27.828 -21.019
  960    HZ2  TRP 130           HZ2      TRP 130  19.637  28.847 -18.606
  961    HZ3  TRP 130           HZ3      TRP 130  16.733  26.004 -19.990
  962    HH2  TRP 130           HH2      TRP 130  18.838  26.503 -18.797
  963    HA   PRO 131           HA       PRO 131  14.010  28.692 -19.021
  964    HB2  PRO 131           HB2      PRO 131  14.834  27.821 -16.637
  965    HB3  PRO 131           HB3      PRO 131  15.978  28.650 -17.725
  966    HG2  PRO 131           HG2      PRO 131  14.494  29.808 -15.363
  967    HG3  PRO 131           HG3      PRO 131  16.229  29.963 -15.793
  968    HD2  PRO 131           HD2      PRO 131  14.259  31.846 -16.446
  969    HD3  PRO 131           HD3      PRO 131  15.784  31.631 -17.349
  970    H    LEU 132           H        LEU 132  12.803  26.906 -17.701
  971    HA   LEU 132           HA       LEU 132  10.164  27.784 -16.806
  972    HB2  LEU 132           HB2      LEU 132  11.596  25.112 -17.072
  973    HB3  LEU 132           HB3      LEU 132  10.189  25.254 -16.035
  974    HG   LEU 132           HG       LEU 132   8.970  26.327 -18.015
  975   HD11  LEU 132          HD11      LEU 132  10.890  26.683 -19.523
  976   HD12  LEU 132          HD12      LEU 132  11.166  24.923 -19.568
  977   HD13  LEU 132          HD13      LEU 132   9.681  25.624 -20.245
  978   HD21  LEU 132          HD21      LEU 132   8.315  24.132 -18.893
  979   HD22  LEU 132          HD22      LEU 132   9.738  23.390 -18.127
  980   HD23  LEU 132          HD23      LEU 132   8.446  24.110 -17.140
  981    H    ASP 133           H        ASP 133   9.330  26.999 -14.751
  982    HA   ASP 133           HA       ASP 133  11.230  27.429 -12.460
  983    HB2  ASP 133           HB2      ASP 133   9.541  29.258 -12.762
  984    HB3  ASP 133           HB3      ASP 133   8.255  28.059 -12.597
  985    H    GLN 134           H        GLN 134  10.453  26.192 -10.463
  986    HA   GLN 134           HA       GLN 134   8.906  23.769 -11.105
  987    HB2  GLN 134           HB2      GLN 134  10.552  22.179 -10.422
  988    HB3  GLN 134           HB3      GLN 134  11.205  23.182 -11.722
  989    HG2  GLN 134           HG2      GLN 134  12.460  24.497  -9.993
  990    HG3  GLN 134           HG3      GLN 134  11.902  23.331  -8.778
  991   HE21  GLN 134          HE22      GLN 134  12.760  21.085  -8.898
  992   HE22  GLN 134          HE21      GLN 134  14.206  20.802  -9.857
  993    H    THR 135           H        THR 135   8.227  22.494  -9.400
  994    HA   THR 135           HA       THR 135   8.287  23.590  -6.639
  995    HB   THR 135           HB       THR 135   6.536  24.800  -7.862
  996    HG1  THR 135           HG1      THR 135   6.157  24.360  -5.711
  997   HG21  THR 135          HG21      THR 135   5.840  23.145  -9.559
  998   HG22  THR 135          HG22      THR 135   5.170  22.108  -8.273
  999   HG23  THR 135          HG23      THR 135   4.471  23.704  -8.604
 1000    H    LEU 136           H        LEU 136   7.481  22.088  -5.060
 1001    HA   LEU 136           HA       LEU 136   7.637  19.250  -5.778
 1002    HB2  LEU 136           HB2      LEU 136   7.048  20.782  -3.227
 1003    HB3  LEU 136           HB3      LEU 136   6.693  19.065  -3.363
 1004    HG   LEU 136           HG       LEU 136   9.052  18.551  -3.872
 1005   HD11  LEU 136          HD11      LEU 136   9.882  20.624  -4.854
 1006   HD12  LEU 136          HD12      LEU 136   9.550  21.511  -3.346
 1007   HD13  LEU 136          HD13      LEU 136  10.805  20.253  -3.401
 1008   HD21  LEU 136          HD21      LEU 136   9.888  18.979  -1.594
 1009   HD22  LEU 136          HD22      LEU 136   8.625  20.201  -1.346
 1010   HD23  LEU 136          HD23      LEU 136   8.188  18.492  -1.561
 1011    H    ALA 137           H        ALA 137   5.997  17.945  -6.235
 1012    HA   ALA 137           HA       ALA 137   4.014  17.569  -7.426
 1013    HB1  ALA 137           HB1      ALA 137   2.408  16.806  -5.719
 1014    HB2  ALA 137           HB2      ALA 137   4.076  16.388  -5.282
 1015    HB3  ALA 137           HB3      ALA 137   3.264  17.754  -4.485
 1016    H    ARG 138           H        ARG 138   3.919  19.649  -8.565
 1017    HA   ARG 138           HA       ARG 138   3.025  21.562  -9.313
 1018    HB2  ARG 138           HB2      ARG 138   0.843  21.344 -10.091
 1019    HB3  ARG 138           HB3      ARG 138   1.573  19.764 -10.127
 1020    HG2  ARG 138           HG2      ARG 138  -0.115  20.461  -7.717
 1021    HG3  ARG 138           HG3      ARG 138  -0.928  20.264  -9.264
 1022    HD2  ARG 138           HD2      ARG 138  -0.009  18.023  -9.550
 1023    HD3  ARG 138           HD3      ARG 138   0.860  18.127  -8.027
 1024    HE   ARG 138           HE       ARG 138  -1.969  17.596  -8.436
 1025   HH11  ARG 138          HH12      ARG 138   0.245  18.835  -5.980
 1026   HH12  ARG 138          HH11      ARG 138  -0.849  18.391  -4.697
 1027   HH21  ARG 138          HH21      ARG 138  -3.272  17.096  -6.734
 1028   HH22  ARG 138          HH22      ARG 138  -2.767  17.452  -5.112
 1029    H    ASP 139           H        ASP 139   3.284  21.811  -6.233
 1030    HA   ASP 139           HA       ASP 139   1.056  23.150  -5.273
 1031    HB2  ASP 139           HB2      ASP 139   2.905  22.260  -3.922
 1032    HB3  ASP 139           HB3      ASP 139   3.937  23.588  -4.447
 1033    H    THR 140           H        THR 140   3.691  24.741  -7.095
 1034    HA   THR 140           HA       THR 140   2.412  27.397  -6.801
 1035    HB   THR 140           HB       THR 140   4.157  28.220  -8.292
 1036    HG1  THR 140           HG1      THR 140   5.643  26.854  -9.151
 1037   HG21  THR 140          HG21      THR 140   5.312  26.389  -6.164
 1038   HG22  THR 140          HG22      THR 140   6.156  27.723  -6.976
 1039   HG23  THR 140          HG23      THR 140   4.758  28.059  -5.935
 1040    H    ARG 141           H        ARG 141   1.807  24.768  -8.902
 1041    HA   ARG 141           HA       ARG 141   1.808  26.004 -11.445
 1042    HB2  ARG 141           HB2      ARG 141   1.756  23.520 -10.896
 1043    HB3  ARG 141           HB3      ARG 141   0.029  23.708 -10.564
 1044    HG2  ARG 141           HG2      ARG 141   0.038  24.774 -13.037
 1045    HG3  ARG 141           HG3      ARG 141   1.528  23.842 -13.183
 1046    HD2  ARG 141           HD2      ARG 141   0.220  21.807 -12.466
 1047    HD3  ARG 141           HD3      ARG 141  -1.248  22.795 -12.445
 1048    HE   ARG 141           HE       ARG 141   0.074  21.651 -14.750
 1049   HH11  ARG 141          HH11      ARG 141  -2.010  24.463 -13.971
 1050   HH12  ARG 141          HH12      ARG 141  -2.444  24.584 -15.649
 1051   HH21  ARG 141          HH21      ARG 141  -0.558  21.929 -16.696
 1052   HH22  ARG 141          HH22      ARG 141  -1.666  23.212 -17.169
 1053    HA   PRO 142           HA       PRO 142  -2.004  28.502 -11.484
 1054    HB2  PRO 142           HB2      PRO 142  -1.812  27.707 -14.399
 1055    HB3  PRO 142           HB3      PRO 142  -2.241  29.298 -13.694
 1056    HG2  PRO 142           HG2      PRO 142   0.258  28.869 -14.637
 1057    HG3  PRO 142           HG3      PRO 142   0.033  29.712 -13.068
 1058    HD2  PRO 142           HD2      PRO 142   0.776  26.829 -13.567
 1059    HD3  PRO 142           HD3      PRO 142   1.423  27.974 -12.355
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1   9.286  -3.466   4.166
    2    H2   MET   1           H2       MET   1   8.570  -4.283   2.946
    3    H3   MET   1           H3       MET   1  10.175  -4.458   3.220
    4    HA   MET   1           HA       MET   1  10.592  -2.162   2.642
    5    HB2  MET   1           HB2      MET   1  10.706  -3.952   0.884
    6    HB3  MET   1           HB3      MET   1   9.032  -3.595   0.443
    7    HG2  MET   1           HG2      MET   1   9.692  -1.284  -0.160
    8    HG3  MET   1           HG3      MET   1  11.353  -1.622   0.341
    9    HE1  MET   1           HE1      MET   1  12.189  -0.644  -1.970
   10    HE2  MET   1           HE2      MET   1  11.600  -1.204  -3.551
   11    HE3  MET   1           HE3      MET   1  10.503  -0.340  -2.451
   12    H    ALA   2           H        ALA   2   9.847  -0.093   2.357
   13    HA   ALA   2           HA       ALA   2   7.199   0.642   3.127
   14    HB1  ALA   2           HB1      ALA   2   9.219   2.043   3.425
   15    HB2  ALA   2           HB2      ALA   2   9.355   2.229   1.660
   16    HB3  ALA   2           HB3      ALA   2   7.963   2.908   2.528
   17    H    TYR   3           H        TYR   3   5.768   2.086   1.816
   18    HA   TYR   3           HA       TYR   3   4.704   0.834  -0.494
   19    HB2  TYR   3           HB2      TYR   3   3.378   2.964  -0.687
   20    HB3  TYR   3           HB3      TYR   3   3.292   2.146   0.861
   21    HD1  TYR   3           HD1      TYR   3   4.972   5.010  -0.902
   22    HD2  TYR   3           HD2      TYR   3   3.832   3.282   2.888
   23    HE1  TYR   3           HE1      TYR   3   5.660   7.090   0.253
   24    HE2  TYR   3           HE2      TYR   3   4.537   5.367   4.044
   25    HH   TYR   3           HH       TYR   3   5.409   7.475   3.809
   26    H    GLY   4           H        GLY   4   7.224   3.306  -0.283
   27    HA2  GLY   4           HA2      GLY   4   8.165   2.817  -2.919
   28    HA3  GLY   4           HA3      GLY   4   7.214   4.307  -2.926
   29    H    ARG   5           H        ARG   5   9.943   4.196  -3.529
   30    HA   ARG   5           HA       ARG   5  11.530   5.039  -1.192
   31    HB2  ARG   5           HB2      ARG   5  12.219   4.720  -4.135
   32    HB3  ARG   5           HB3      ARG   5  13.374   5.181  -2.892
   33    HG2  ARG   5           HG2      ARG   5  11.855   2.542  -3.004
   34    HG3  ARG   5           HG3      ARG   5  13.543   2.797  -3.438
   35    HD2  ARG   5           HD2      ARG   5  12.335   3.112  -0.657
   36    HD3  ARG   5           HD3      ARG   5  13.347   1.789  -1.203
   37    HE   ARG   5           HE       ARG   5  14.191   4.562  -0.542
   38   HH11  ARG   5          HH11      ARG   5  15.277   1.489  -1.881
   39   HH12  ARG   5          HH12      ARG   5  16.951   1.895  -1.646
   40   HH21  ARG   5          HH21      ARG   5  16.310   4.973  -0.244
   41   HH22  ARG   5          HH22      ARG   5  17.524   3.811  -0.746
   42    H    GLU   6           H        GLU   6   9.849   6.801  -0.920
   43    HA   GLU   6           HA       GLU   6   9.866   9.260  -2.315
   44    HB2  GLU   6           HB2      GLU   6   9.877   8.768   0.691
   45    HB3  GLU   6           HB3      GLU   6   9.447  10.295  -0.072
   46    HG2  GLU   6           HG2      GLU   6   7.946   7.677  -0.510
   47    HG3  GLU   6           HG3      GLU   6   7.511   8.890   0.684
   48    H    ASP   7           H        ASP   7  12.258   8.024  -0.003
   49    HA   ASP   7           HA       ASP   7  13.941  10.298   0.222
   50    HB2  ASP   7           HB2      ASP   7  15.434   8.798   1.319
   51    HB3  ASP   7           HB3      ASP   7  13.800   8.332   1.773
   52    H    VAL   8           H        VAL   8  13.542   8.250  -2.473
   53    HA   VAL   8           HA       VAL   8  16.132   9.158  -3.708
   54    HB   VAL   8           HB       VAL   8  14.382   6.777  -4.447
   55   HG11  VAL   8          HG11      VAL   8  15.424   7.714  -6.464
   56   HG12  VAL   8          HG12      VAL   8  17.008   7.750  -5.654
   57   HG13  VAL   8          HG13      VAL   8  16.214   6.203  -6.024
   58   HG21  VAL   8          HG21      VAL   8  15.690   6.328  -2.413
   59   HG22  VAL   8          HG22      VAL   8  16.336   5.413  -3.776
   60   HG23  VAL   8          HG23      VAL   8  17.172   6.882  -3.222
   61    H    ALA   9           H        ALA   9  12.601   8.675  -4.287
   62    HA   ALA   9           HA       ALA   9  12.554   9.857  -6.838
   63    HB1  ALA   9           HB1      ALA   9  10.350   9.733  -4.740
   64    HB2  ALA   9           HB2      ALA   9  10.130  10.005  -6.484
   65    HB3  ALA   9           HB3      ALA   9  10.766   8.455  -5.908
   66    H    ASN  10           H        ASN  10  12.167  11.504  -3.648
   67    HA   ASN  10           HA       ASN  10  11.668  14.136  -4.647
   68    HB2  ASN  10           HB2      ASN  10  12.941  13.055  -2.119
   69    HB3  ASN  10           HB3      ASN  10  13.012  14.776  -2.468
   70   HD21  ASN  10          HD22      ASN  10  11.008  16.003  -2.706
   71   HD22  ASN  10          HD21      ASN  10   9.570  15.390  -1.915
   72    H    THR  11           H        THR  11  14.886  12.664  -4.001
   73    HA   THR  11           HA       THR  11  16.400  14.865  -5.046
   74    HB   THR  11           HB       THR  11  17.156  11.913  -4.952
   75    HG1  THR  11           HG1      THR  11  17.965  12.427  -2.926
   76   HG21  THR  11          HG21      THR  11  18.780  13.264  -6.235
   77   HG22  THR  11          HG22      THR  11  18.868  14.442  -4.905
   78   HG23  THR  11          HG23      THR  11  19.463  12.779  -4.680
   79    H    ARG  12           H        ARG  12  15.355  11.786  -6.574
   80    HA   ARG  12           HA       ARG  12  16.673  12.403  -9.029
   81    HB2  ARG  12           HB2      ARG  12  16.252  10.126  -8.093
   82    HB3  ARG  12           HB3      ARG  12  14.552  10.283  -8.488
   83    HG2  ARG  12           HG2      ARG  12  15.842   8.942 -10.120
   84    HG3  ARG  12           HG3      ARG  12  15.075  10.334 -10.888
   85    HD2  ARG  12           HD2      ARG  12  17.069  11.452 -11.243
   86    HD3  ARG  12           HD3      ARG  12  17.905  10.665  -9.899
   87    HE   ARG  12           HE       ARG  12  17.736   9.705 -12.658
   88   HH11  ARG  12          HH11      ARG  12  18.485   8.647  -9.354
   89   HH12  ARG  12          HH12      ARG  12  19.073   7.109  -9.993
   90   HH21  ARG  12          HH21      ARG  12  18.562   7.764 -13.233
   91   HH22  ARG  12          HH22      ARG  12  19.117   6.647 -11.959
   92    H    ALA  13           H        ALA  13  13.351  13.110  -8.024
   93    HA   ALA  13           HA       ALA  13  12.324  13.845 -10.581
   94    HB1  ALA  13           HB1      ALA  13  11.761  15.069  -7.845
   95    HB2  ALA  13           HB2      ALA  13  10.772  15.236  -9.318
   96    HB3  ALA  13           HB3      ALA  13  10.950  13.658  -8.547
   97    H    ARG  14           H        ARG  14  14.002  15.850  -8.088
   98    HA   ARG  14           HA       ARG  14  14.150  18.214  -9.746
   99    HB2  ARG  14           HB2      ARG  14  15.769  17.476  -7.269
  100    HB3  ARG  14           HB3      ARG  14  15.703  19.072  -8.033
  101    HG2  ARG  14           HG2      ARG  14  13.162  19.013  -7.685
  102    HG3  ARG  14           HG3      ARG  14  13.415  17.573  -6.693
  103    HD2  ARG  14           HD2      ARG  14  13.332  19.326  -5.143
  104    HD3  ARG  14           HD3      ARG  14  15.061  18.984  -5.321
  105    HE   ARG  14           HE       ARG  14  13.925  21.112  -7.067
  106   HH11  ARG  14          HH11      ARG  14  15.651  20.577  -4.058
  107   HH12  ARG  14          HH12      ARG  14  16.174  22.235  -3.994
  108   HH21  ARG  14          HH21      ARG  14  14.580  23.106  -6.929
  109   HH22  ARG  14          HH22      ARG  14  15.585  23.658  -5.600
  110    H    GLU  15           H        GLU  15  16.494  15.601  -9.184
  111    HA   GLU  15           HA       GLU  15  18.585  16.573 -10.890
  112    HB2  GLU  15           HB2      GLU  15  18.742  14.632  -9.325
  113    HB3  GLU  15           HB3      GLU  15  17.649  13.743 -10.382
  114    HG2  GLU  15           HG2      GLU  15  19.824  12.985 -10.860
  115    HG3  GLU  15           HG3      GLU  15  19.259  13.936 -12.232
  116    H    THR  16           H        THR  16  15.757  14.517 -11.775
  117    HA   THR  16           HA       THR  16  16.310  14.413 -14.567
  118    HB   THR  16           HB       THR  16  13.603  14.339 -13.172
  119    HG1  THR  16           HG1      THR  16  14.860  12.743 -12.385
  120   HG21  THR  16          HG21      THR  16  13.357  14.591 -15.635
  121   HG22  THR  16          HG22      THR  16  14.459  13.213 -15.868
  122   HG23  THR  16          HG23      THR  16  12.885  12.976 -15.086
  123    H    ALA  17           H        ALA  17  14.442  16.792 -12.684
  124    HA   ALA  17           HA       ALA  17  13.732  18.445 -14.900
  125    HB1  ALA  17           HB1      ALA  17  13.214  20.114 -13.153
  126    HB2  ALA  17           HB2      ALA  17  12.584  18.502 -12.728
  127    HB3  ALA  17           HB3      ALA  17  14.059  19.121 -11.949
  128    H    ALA  18           H        ALA  18  16.599  18.642 -12.721
  129    HA   ALA  18           HA       ALA  18  17.692  21.012 -13.880
  130    HB1  ALA  18           HB1      ALA  18  19.785  20.253 -12.813
  131    HB2  ALA  18           HB2      ALA  18  18.404  20.063 -11.716
  132    HB3  ALA  18           HB3      ALA  18  19.084  18.644 -12.543
  133    H    ARG  19           H        ARG  19  18.173  17.553 -14.710
  134    HA   ARG  19           HA       ARG  19  19.984  17.972 -16.924
  135    HB2  ARG  19           HB2      ARG  19  18.029  15.722 -16.296
  136    HB3  ARG  19           HB3      ARG  19  19.188  15.684 -17.636
  137    HG2  ARG  19           HG2      ARG  19  21.075  15.863 -16.087
  138    HG3  ARG  19           HG3      ARG  19  19.976  16.010 -14.710
  139    HD2  ARG  19           HD2      ARG  19  19.021  13.747 -15.325
  140    HD3  ARG  19           HD3      ARG  19  20.311  13.606 -16.540
  141    HE   ARG  19           HE       ARG  19  21.161  14.229 -13.763
  142   HH11  ARG  19          HH11      ARG  19  20.802  11.601 -16.063
  143   HH12  ARG  19          HH12      ARG  19  21.790  10.545 -15.090
  144   HH21  ARG  19          HH21      ARG  19  22.307  12.963 -12.661
  145   HH22  ARG  19          HH22      ARG  19  22.678  11.309 -13.159
  146    H    PHE  20           H        PHE  20  16.396  17.660 -16.883
  147    HA   PHE  20           HA       PHE  20  16.013  18.178 -19.656
  148    HB2  PHE  20           HB2      PHE  20  14.148  17.383 -18.415
  149    HB3  PHE  20           HB3      PHE  20  14.305  18.650 -17.207
  150    HD1  PHE  20           HD2      PHE  20  13.831  18.373 -20.961
  151    HD2  PHE  20           HD1      PHE  20  12.894  20.488 -17.314
  152    HE1  PHE  20           HE2      PHE  20  12.312  19.885 -22.212
  153    HE2  PHE  20           HE1      PHE  20  11.436  22.028 -18.582
  154    HZ   PHE  20           HZ       PHE  20  11.138  21.733 -21.040
  155    H    THR  21           H        THR  21  16.237  20.548 -16.944
  156    HA   THR  21           HA       THR  21  15.787  22.858 -18.545
  157    HB   THR  21           HB       THR  21  17.484  22.683 -16.024
  158    HG1  THR  21           HG1      THR  21  15.438  21.873 -15.666
  159   HG21  THR  21          HG21      THR  21  15.997  25.011 -17.337
  160   HG22  THR  21          HG22      THR  21  16.646  25.039 -15.689
  161   HG23  THR  21          HG23      THR  21  17.750  24.875 -17.057
  162    H    ALA  22           H        ALA  22  18.928  21.240 -17.736
  163    HA   ALA  22           HA       ALA  22  20.514  22.976 -19.369
  164    HB1  ALA  22           HB1      ALA  22  20.950  20.057 -18.582
  165    HB2  ALA  22           HB2      ALA  22  22.191  21.168 -19.201
  166    HB3  ALA  22           HB3      ALA  22  21.431  21.479 -17.628
  167    H    ALA  23           H        ALA  23  18.794  19.950 -20.197
  168    HA   ALA  23           HA       ALA  23  19.695  19.780 -22.897
  169    HB1  ALA  23           HB1      ALA  23  17.897  18.175 -23.166
  170    HB2  ALA  23           HB2      ALA  23  18.681  17.934 -21.602
  171    HB3  ALA  23           HB3      ALA  23  17.100  18.750 -21.692
  172    H    LEU  24           H        LEU  24  16.934  21.549 -21.483
  173    HA   LEU  24           HA       LEU  24  15.925  22.558 -23.991
  174    HB2  LEU  24           HB2      LEU  24  14.557  22.330 -21.986
  175    HB3  LEU  24           HB3      LEU  24  15.593  23.439 -21.107
  176    HG   LEU  24           HG       LEU  24  14.901  25.286 -22.663
  177   HD11  LEU  24          HD11      LEU  24  12.920  24.958 -24.091
  178   HD12  LEU  24          HD12      LEU  24  14.262  23.946 -24.637
  179   HD13  LEU  24          HD13      LEU  24  12.920  23.223 -23.720
  180   HD21  LEU  24          HD21      LEU  24  12.632  25.531 -21.745
  181   HD22  LEU  24          HD22      LEU  24  12.607  23.805 -21.321
  182   HD23  LEU  24          HD23      LEU  24  13.736  24.905 -20.506
  183    H    GLU  25           H        GLU  25  18.396  23.779 -21.701
  184    HA   GLU  25           HA       GLU  25  18.881  26.265 -23.078
  185    HB2  GLU  25           HB2      GLU  25  19.775  25.536 -20.775
  186    HB3  GLU  25           HB3      GLU  25  21.001  24.621 -21.648
  187    HG2  GLU  25           HG2      GLU  25  21.717  26.725 -22.796
  188    HG3  GLU  25           HG3      GLU  25  20.497  27.616 -21.884
  189    H    LEU  26           H        LEU  26  20.301  23.013 -23.456
  190    HA   LEU  26           HA       LEU  26  21.969  23.408 -25.711
  191    HB2  LEU  26           HB2      LEU  26  22.249  21.360 -24.708
  192    HB3  LEU  26           HB3      LEU  26  20.562  21.182 -24.340
  193    HG   LEU  26           HG       LEU  26  20.139  20.611 -26.794
  194   HD11  LEU  26          HD11      LEU  26  23.166  20.261 -26.763
  195   HD12  LEU  26          HD12      LEU  26  22.053  19.757 -28.055
  196   HD13  LEU  26          HD13      LEU  26  22.286  21.482 -27.708
  197   HD21  LEU  26          HD21      LEU  26  20.896  18.292 -26.476
  198   HD22  LEU  26          HD22      LEU  26  21.880  18.807 -25.085
  199   HD23  LEU  26          HD23      LEU  26  20.105  18.947 -25.038
  200    H    ALA  27           H        ALA  27  18.476  22.656 -25.624
  201    HA   ALA  27           HA       ALA  27  18.065  22.724 -28.439
  202    HB1  ALA  27           HB1      ALA  27  16.125  23.399 -26.183
  203    HB2  ALA  27           HB2      ALA  27  15.692  22.949 -27.838
  204    HB3  ALA  27           HB3      ALA  27  16.490  21.770 -26.779
  205    H    ILE  28           H        ILE  28  17.720  25.435 -26.049
  206    HA   ILE  28           HA       ILE  28  17.019  27.440 -27.962
  207    HB   ILE  28           HB       ILE  28  18.423  27.616 -25.276
  208   HG12  ILE  28          HG12      ILE  28  15.567  28.407 -25.996
  209   HG13  ILE  28          HG13      ILE  28  15.963  26.757 -25.537
  210   HG21  ILE  28          HG21      ILE  28  18.994  29.662 -26.507
  211   HG22  ILE  28          HG22      ILE  28  17.297  29.884 -26.987
  212   HG23  ILE  28          HG23      ILE  28  17.788  30.043 -25.288
  213   HD11  ILE  28          HD11      ILE  28  16.900  27.585 -23.382
  214   HD12  ILE  28          HD12      ILE  28  16.277  29.203 -23.793
  215   HD13  ILE  28          HD13      ILE  28  15.160  27.829 -23.610
  216    H    ASP  29           H        ASP  29  20.275  26.368 -26.879
  217    HA   ASP  29           HA       ASP  29  21.747  28.144 -28.581
  218    HB2  ASP  29           HB2      ASP  29  22.694  26.924 -26.654
  219    HB3  ASP  29           HB3      ASP  29  22.473  25.396 -27.502
  220    H    ARG  30           H        ARG  30  20.525  24.842 -29.170
  221    HA   ARG  30           HA       ARG  30  21.587  24.537 -31.811
  222    HB2  ARG  30           HB2      ARG  30  20.609  22.750 -30.235
  223    HB3  ARG  30           HB3      ARG  30  19.016  23.312 -30.704
  224    HG2  ARG  30           HG2      ARG  30  19.576  21.334 -31.952
  225    HG3  ARG  30           HG3      ARG  30  19.484  22.694 -33.066
  226    HD2  ARG  30           HD2      ARG  30  21.353  21.220 -33.597
  227    HD3  ARG  30           HD3      ARG  30  21.941  22.827 -33.152
  228    HE   ARG  30           HE       ARG  30  22.071  21.515 -30.762
  229   HH11  ARG  30          HH11      ARG  30  23.389  20.634 -33.895
  230   HH12  ARG  30          HH12      ARG  30  24.672  19.683 -33.164
  231   HH21  ARG  30          HH21      ARG  30  23.739  20.271 -29.944
  232   HH22  ARG  30          HH22      ARG  30  24.795  19.416 -31.044
  233    H    ALA  31           H        ALA  31  18.579  26.053 -30.731
  234    HA   ALA  31           HA       ALA  31  17.234  26.132 -33.203
  235    HB1  ALA  31           HB1      ALA  31  16.282  26.585 -30.932
  236    HB2  ALA  31           HB2      ALA  31  17.070  28.160 -30.936
  237    HB3  ALA  31           HB3      ALA  31  15.810  27.788 -32.143
  238    H    THR  32           H        THR  32  19.573  28.541 -31.934
  239    HA   THR  32           HA       THR  32  19.163  30.301 -34.238
  240    HB   THR  32           HB       THR  32  19.791  31.119 -31.981
  241    HG1  THR  32           HG1      THR  32  21.116  32.700 -32.821
  242   HG21  THR  32          HG21      THR  32  22.150  31.220 -31.336
  243   HG22  THR  32          HG22      THR  32  21.584  29.551 -31.362
  244   HG23  THR  32          HG23      THR  32  22.601  30.163 -32.689
  245    H    LEU  33           H        LEU  33  21.203  27.523 -33.626
  246    HA   LEU  33           HA       LEU  33  23.127  28.190 -35.717
  247    HB2  LEU  33           HB2      LEU  33  22.776  25.777 -33.898
  248    HB3  LEU  33           HB3      LEU  33  24.123  25.995 -35.016
  249    HG   LEU  33           HG       LEU  33  23.496  27.808 -32.645
  250   HD11  LEU  33          HD11      LEU  33  25.693  25.736 -33.064
  251   HD12  LEU  33          HD12      LEU  33  25.508  26.802 -31.652
  252   HD13  LEU  33          HD13      LEU  33  24.287  25.569 -31.986
  253   HD21  LEU  33          HD21      LEU  33  25.862  27.797 -34.568
  254   HD22  LEU  33          HD22      LEU  33  24.651  29.088 -34.385
  255   HD23  LEU  33          HD23      LEU  33  25.765  28.739 -33.064
  256    H    SER  34           H        SER  34  20.447  25.942 -35.245
  257    HA   SER  34           HA       SER  34  21.006  24.403 -37.644
  258    HB2  SER  34           HB2      SER  34  19.045  23.107 -36.985
  259    HB3  SER  34           HB3      SER  34  20.146  23.373 -35.618
  260    HG   SER  34           HG       SER  34  18.796  24.804 -34.750
  261    H    GLY  35           H        GLY  35  19.100  27.255 -37.130
  262    HA2  GLY  35           HA2      GLY  35  18.379  28.630 -38.868
  263    HA3  GLY  35           HA3      GLY  35  18.484  27.290 -40.003
  264    H    GLN  36           H        GLN  36  16.660  26.189 -37.430
  265    HA   GLN  36           HA       GLN  36  14.045  27.331 -38.234
  266    HB2  GLN  36           HB2      GLN  36  14.441  25.197 -39.576
  267    HB3  GLN  36           HB3      GLN  36  14.641  24.352 -38.046
  268    HG2  GLN  36           HG2      GLN  36  12.218  25.093 -37.503
  269    HG3  GLN  36           HG3      GLN  36  12.098  25.492 -39.215
  270   HE21  GLN  36          HE22      GLN  36  12.361  22.918 -36.780
  271   HE22  GLN  36          HE21      GLN  36  12.012  21.601 -37.918
  272    HA   PRO  37           HA       PRO  37  13.427  27.012 -33.720
  273    HB2  PRO  37           HB2      PRO  37  10.705  26.077 -34.704
  274    HB3  PRO  37           HB3      PRO  37  11.076  27.117 -33.297
  275    HG2  PRO  37           HG2      PRO  37  10.290  28.266 -35.604
  276    HG3  PRO  37           HG3      PRO  37  11.712  28.944 -34.741
  277    HD2  PRO  37           HD2      PRO  37  11.667  27.157 -37.159
  278    HD3  PRO  37           HD3      PRO  37  12.721  28.553 -36.802
  279    H    VAL  38           H        VAL  38  13.430  25.320 -32.218
  280    HA   VAL  38           HA       VAL  38  13.597  22.548 -33.367
  281    HB   VAL  38           HB       VAL  38  15.126  21.949 -31.573
  282   HG11  VAL  38          HG11      VAL  38  17.099  23.044 -32.550
  283   HG12  VAL  38          HG12      VAL  38  15.927  22.701 -33.844
  284   HG13  VAL  38          HG13      VAL  38  16.082  24.338 -33.216
  285   HG21  VAL  38          HG21      VAL  38  16.355  23.625 -30.346
  286   HG22  VAL  38          HG22      VAL  38  15.131  24.842 -30.813
  287   HG23  VAL  38          HG23      VAL  38  14.695  23.430 -29.836
  288    H    GLY  39           H        GLY  39  13.311  20.795 -31.496
  289    HA2  GLY  39           HA2      GLY  39  11.328  21.705 -29.513
  290    HA3  GLY  39           HA3      GLY  39  10.724  20.616 -30.739
  291    H    ILE  40           H        ILE  40  10.469  20.037 -28.179
  292    HA   ILE  40           HA       ILE  40  12.320  17.742 -27.742
  293    HB   ILE  40           HB       ILE  40  11.166  19.400 -25.484
  294   HG12  ILE  40          HG12      ILE  40  14.047  19.230 -26.497
  295   HG13  ILE  40          HG13      ILE  40  12.984  20.606 -26.711
  296   HG21  ILE  40          HG21      ILE  40  11.459  16.936 -25.035
  297   HG22  ILE  40          HG22      ILE  40  13.164  17.082 -25.485
  298   HG23  ILE  40          HG23      ILE  40  12.530  17.926 -24.058
  299   HD11  ILE  40          HD11      ILE  40  14.437  21.112 -24.902
  300   HD12  ILE  40          HD12      ILE  40  12.810  20.854 -24.236
  301   HD13  ILE  40          HD13      ILE  40  14.065  19.598 -24.065
  302    H    HIS  41           H        HIS  41  11.340  16.002 -27.952
  303    HA   HIS  41           HA       HIS  41   8.440  15.666 -27.964
  304    HB2  HIS  41           HB2      HIS  41   9.698  14.682 -29.794
  305    HB3  HIS  41           HB3      HIS  41  10.848  13.971 -28.684
  306    HD1  HIS  41           HD1      HIS  41  10.168  11.615 -27.611
  307    HD2  HIS  41           HD2      HIS  41   7.151  13.581 -29.785
  308    HE1  HIS  41           HE1      HIS  41   8.229   9.977 -27.795
  309    H    PHE  42           H        PHE  42   7.377  14.252 -26.585
  310    HA   PHE  42           HA       PHE  42   8.774  13.055 -24.237
  311    HB2  PHE  42           HB2      PHE  42   6.596  15.168 -24.206
  312    HB3  PHE  42           HB3      PHE  42   6.778  14.031 -22.886
  313    HD1  PHE  42           HD2      PHE  42   8.622  14.107 -21.329
  314    HD2  PHE  42           HD1      PHE  42   8.304  16.972 -24.538
  315    HE1  PHE  42           HE2      PHE  42  10.245  15.585 -20.170
  316    HE2  PHE  42           HE1      PHE  42   9.935  18.449 -23.371
  317    HZ   PHE  42           HZ       PHE  42  10.890  17.756 -21.183
  318    H    SER  43           H        SER  43   7.873  11.211 -23.523
  319    HA   SER  43           HA       SER  43   5.094  10.497 -24.258
  320    HB2  SER  43           HB2      SER  43   5.641   8.310 -24.860
  321    HB3  SER  43           HB3      SER  43   6.836   9.305 -25.703
  322    HG   SER  43           HG       SER  43   7.842   7.556 -24.676
  323    H    ASP  44           H        ASP  44   4.406   8.517 -22.873
  324    HA   ASP  44           HA       ASP  44   4.599   8.984 -20.093
  325    HB2  ASP  44           HB2      ASP  44   3.520   6.813 -19.870
  326    HB3  ASP  44           HB3      ASP  44   2.794   7.743 -21.173
  327    H    SER  45           H        SER  45   7.052   7.586 -22.085
  328    HA   SER  45           HA       SER  45   8.413   6.345 -19.715
  329    HB2  SER  45           HB2      SER  45   7.948   5.119 -22.457
  330    HB3  SER  45           HB3      SER  45   9.090   4.483 -21.265
  331    HG   SER  45           HG       SER  45   6.266   4.694 -21.051
  332    H    ALA  46           H        ALA  46   8.869   8.456 -22.429
  333    HA   ALA  46           HA       ALA  46  11.715   8.707 -21.755
  334    HB1  ALA  46           HB1      ALA  46  12.488   8.269 -24.063
  335    HB2  ALA  46           HB2      ALA  46  11.704   6.830 -23.403
  336    HB3  ALA  46           HB3      ALA  46  10.831   7.861 -24.558
  337    H    TRP  47           H        TRP  47  12.762  10.388 -23.192
  338    HA   TRP  47           HA       TRP  47  10.959  12.272 -24.564
  339    HB2  TRP  47           HB2      TRP  47  12.188  14.209 -23.446
  340    HB3  TRP  47           HB3      TRP  47  10.956  13.368 -22.529
  341    HD1  TRP  47           HD1      TRP  47  14.660  14.108 -22.489
  342    HE1  TRP  47           HE1      TRP  47  15.636  13.441 -20.211
  343    HE3  TRP  47           HE3      TRP  47  10.621  11.605 -20.565
  344    HZ2  TRP  47           HZ2      TRP  47  14.821  11.897 -17.913
  345    HZ3  TRP  47           HZ3      TRP  47  10.758  10.536 -18.329
  346    HH2  TRP  47           HH2      TRP  47  12.846  10.676 -16.994
  347    H    ARG  48           H        ARG  48  12.125  13.725 -25.998
  348    HA   ARG  48           HA       ARG  48  14.800  12.839 -26.942
  349    HB2  ARG  48           HB2      ARG  48  13.277  11.126 -27.813
  350    HB3  ARG  48           HB3      ARG  48  12.125  12.319 -28.331
  351    HG2  ARG  48           HG2      ARG  48  13.736  13.073 -30.122
  352    HG3  ARG  48           HG3      ARG  48  14.816  11.769 -29.606
  353    HD2  ARG  48           HD2      ARG  48  13.640  10.872 -31.429
  354    HD3  ARG  48           HD3      ARG  48  12.891  10.149 -30.012
  355    HE   ARG  48           HE       ARG  48  11.722  12.540 -31.426
  356   HH11  ARG  48          HH11      ARG  48  11.140   9.279 -30.251
  357   HH12  ARG  48          HH12      ARG  48   9.453   9.323 -30.696
  358   HH21  ARG  48          HH21      ARG  48   9.639  12.486 -32.072
  359   HH22  ARG  48          HH22      ARG  48   8.646  11.095 -31.766
  360    H    ILE  49           H        ILE  49  15.724  14.238 -28.530
  361    HA   ILE  49           HA       ILE  49  14.290  16.883 -28.757
  362    HB   ILE  49           HB       ILE  49  17.285  16.393 -28.761
  363   HG12  ILE  49          HG12      ILE  49  15.274  17.353 -26.704
  364   HG13  ILE  49          HG13      ILE  49  16.515  16.125 -26.539
  365   HG21  ILE  49          HG21      ILE  49  17.457  18.868 -28.844
  366   HG22  ILE  49          HG22      ILE  49  16.655  18.268 -30.270
  367   HG23  ILE  49          HG23      ILE  49  15.692  18.997 -28.963
  368   HD11  ILE  49          HD11      ILE  49  16.922  19.155 -26.620
  369   HD12  ILE  49          HD12      ILE  49  17.116  18.073 -25.241
  370   HD13  ILE  49          HD13      ILE  49  18.252  17.963 -26.605
  371    H    MET  50           H        MET  50  14.085  17.871 -30.690
  372    HA   MET  50           HA       MET  50  14.940  16.375 -33.112
  373    HB2  MET  50           HB2      MET  50  12.102  17.261 -32.470
  374    HB3  MET  50           HB3      MET  50  12.648  16.693 -34.058
  375    HG2  MET  50           HG2      MET  50  13.337  14.535 -33.060
  376    HG3  MET  50           HG3      MET  50  12.795  15.088 -31.480
  377    HE1  MET  50           HE1      MET  50  10.056  14.062 -35.041
  378    HE2  MET  50           HE2      MET  50  11.666  14.802 -35.119
  379    HE3  MET  50           HE3      MET  50  11.511  13.087 -34.708
  380    H    VAL  51           H        VAL  51  15.070  17.491 -34.964
  381    HA   VAL  51           HA       VAL  51  15.282  20.475 -34.889
  382    HB   VAL  51           HB       VAL  51  17.606  20.049 -35.952
  383   HG11  VAL  51          HG11      VAL  51  18.701  19.988 -33.850
  384   HG12  VAL  51          HG12      VAL  51  17.184  20.851 -33.616
  385   HG13  VAL  51          HG13      VAL  51  17.321  19.182 -33.059
  386   HG21  VAL  51          HG21      VAL  51  18.774  18.021 -35.486
  387   HG22  VAL  51          HG22      VAL  51  17.365  17.304 -34.695
  388   HG23  VAL  51          HG23      VAL  51  17.334  17.630 -36.439
  389    HA   PRO  52           HA       PRO  52  14.013  20.496 -39.155
  390    HB2  PRO  52           HB2      PRO  52  16.106  21.791 -40.522
  391    HB3  PRO  52           HB3      PRO  52  14.764  22.574 -39.657
  392    HG2  PRO  52           HG2      PRO  52  17.543  21.940 -38.627
  393    HG3  PRO  52           HG3      PRO  52  16.639  23.471 -38.453
  394    HD2  PRO  52           HD2      PRO  52  16.678  21.797 -36.412
  395    HD3  PRO  52           HD3      PRO  52  15.105  22.461 -36.888
  396    H    GLY  53           H        GLY  53  17.344  19.429 -38.703
  397    HA2  GLY  53           HA2      GLY  53  18.569  17.676 -39.482
  398    HA3  GLY  53           HA3      GLY  53  17.070  16.959 -40.046
  399    H    LYS  54           H        LYS  54  16.346  18.762 -42.078
  400    HA   LYS  54           HA       LYS  54  18.574  18.638 -44.080
  401    HB2  LYS  54           HB2      LYS  54  17.285  16.489 -43.980
  402    HB3  LYS  54           HB3      LYS  54  15.824  17.375 -44.430
  403    HG2  LYS  54           HG2      LYS  54  16.851  17.977 -46.607
  404    HG3  LYS  54           HG3      LYS  54  18.378  17.242 -46.101
  405    HD2  LYS  54           HD2      LYS  54  17.246  15.745 -47.605
  406    HD3  LYS  54           HD3      LYS  54  17.259  15.020 -45.992
  407    HE2  LYS  54           HE2      LYS  54  14.911  15.757 -45.640
  408    HE3  LYS  54           HE3      LYS  54  14.912  16.543 -47.224
  409    HZ1  LYS  54           HZ1      LYS  54  15.247  13.620 -46.778
  410    HZ2  LYS  54           HZ2      LYS  54  13.893  14.337 -47.329
  411    HZ3  LYS  54           HZ3      LYS  54  15.242  14.348 -48.238
  412    H    THR  55           H        THR  55  15.410  20.044 -43.303
  413    HA   THR  55           HA       THR  55  15.776  21.989 -45.558
  414    HB   THR  55           HB       THR  55  13.433  21.833 -46.105
  415    HG1  THR  55           HG1      THR  55  12.652  21.267 -44.103
  416   HG21  THR  55          HG21      THR  55  13.304  19.648 -47.078
  417   HG22  THR  55          HG22      THR  55  15.000  20.167 -47.181
  418   HG23  THR  55          HG23      THR  55  14.488  18.987 -45.941
  419    HA   PRO  56           HA       PRO  56  14.779  24.150 -41.503
  420    HB2  PRO  56           HB2      PRO  56  16.893  25.933 -41.438
  421    HB3  PRO  56           HB3      PRO  56  16.928  24.289 -40.737
  422    HG2  PRO  56           HG2      PRO  56  17.942  25.188 -43.446
  423    HG3  PRO  56           HG3      PRO  56  18.782  24.172 -42.229
  424    HD2  PRO  56           HD2      PRO  56  17.490  23.069 -44.340
  425    HD3  PRO  56           HD3      PRO  56  17.430  22.301 -42.725
  426    H    SER  57           H        SER  57  15.521  25.299 -44.750
  427    HA   SER  57           HA       SER  57  14.371  27.896 -44.632
  428    HB2  SER  57           HB2      SER  57  14.378  25.946 -46.966
  429    HB3  SER  57           HB3      SER  57  14.223  27.711 -47.051
  430    HG   SER  57           HG       SER  57  16.363  27.017 -47.468
  431    H    ALA  58           H        ALA  58  12.761  24.939 -44.139
  432    HA   ALA  58           HA       ALA  58  10.083  26.134 -44.650
  433    HB1  ALA  58           HB1      ALA  58  10.728  24.753 -46.595
  434    HB2  ALA  58           HB2      ALA  58  11.024  23.366 -45.528
  435    HB3  ALA  58           HB3      ALA  58   9.378  24.032 -45.711
  436    H    TRP  59           H        TRP  59   9.493  23.042 -43.890
  437    HA   TRP  59           HA       TRP  59   9.858  23.209 -40.944
  438    HB2  TRP  59           HB2      TRP  59   7.694  24.177 -41.242
  439    HB3  TRP  59           HB3      TRP  59   7.229  22.966 -42.424
  440    HD1  TRP  59           HD1      TRP  59   6.509  20.574 -41.569
  441    HE1  TRP  59           HE1      TRP  59   5.476  19.784 -39.361
  442    HE3  TRP  59           HE3      TRP  59   7.935  24.476 -38.558
  443    HZ2  TRP  59           HZ2      TRP  59   5.182  20.771 -36.667
  444    HZ3  TRP  59           HZ3      TRP  59   7.290  24.497 -36.158
  445    HH2  TRP  59           HH2      TRP  59   5.910  22.662 -35.206
  446    H    ARG  60           H        ARG  60  10.889  21.423 -40.418
  447    HA   ARG  60           HA       ARG  60   9.845  18.782 -41.188
  448    HB2  ARG  60           HB2      ARG  60  11.434  19.336 -42.994
  449    HB3  ARG  60           HB3      ARG  60  12.693  19.705 -41.823
  450    HG2  ARG  60           HG2      ARG  60  13.118  17.584 -42.892
  451    HG3  ARG  60           HG3      ARG  60  12.787  17.306 -41.189
  452    HD2  ARG  60           HD2      ARG  60  10.377  16.744 -41.860
  453    HD3  ARG  60           HD3      ARG  60  10.900  16.866 -43.546
  454    HE   ARG  60           HE       ARG  60  12.694  15.095 -42.304
  455   HH11  ARG  60          HH11      ARG  60   9.250  15.071 -42.967
  456   HH12  ARG  60          HH12      ARG  60   9.178  13.335 -42.959
  457   HH21  ARG  60          HH21      ARG  60  12.512  12.881 -42.314
  458   HH22  ARG  60          HH22      ARG  60  10.972  12.141 -42.612
  459    H    TRP  61           H        TRP  61  10.736  17.060 -39.880
  460    HA   TRP  61           HA       TRP  61  12.191  17.869 -37.431
  461    HB2  TRP  61           HB2      TRP  61   9.583  16.295 -37.553
  462    HB3  TRP  61           HB3      TRP  61  10.628  16.368 -36.140
  463    HD1  TRP  61           HD1      TRP  61   7.623  17.868 -37.213
  464    HE1  TRP  61           HE1      TRP  61   7.235  20.217 -36.203
  465    HE3  TRP  61           HE3      TRP  61  12.322  18.764 -35.430
  466    HZ2  TRP  61           HZ2      TRP  61   8.756  22.163 -34.697
  467    HZ3  TRP  61           HZ3      TRP  61  12.832  20.835 -34.215
  468    HH2  TRP  61           HH2      TRP  61  11.071  22.551 -33.836
  469    H    VAL  62           H        VAL  62  13.806  16.656 -36.996
  470    HA   VAL  62           HA       VAL  62  13.863  13.738 -37.598
  471    HB   VAL  62           HB       VAL  62  16.173  15.674 -38.085
  472   HG11  VAL  62          HG11      VAL  62  17.220  13.746 -39.216
  473   HG12  VAL  62          HG12      VAL  62  16.899  13.383 -37.525
  474   HG13  VAL  62          HG13      VAL  62  15.831  12.725 -38.788
  475   HG21  VAL  62          HG21      VAL  62  15.846  15.114 -40.527
  476   HG22  VAL  62          HG22      VAL  62  14.284  14.391 -40.099
  477   HG23  VAL  62          HG23      VAL  62  14.582  16.131 -39.838
  478    HA   PRO  63           HA       PRO  63  15.298  13.731 -33.251
  479    HB2  PRO  63           HB2      PRO  63  16.825  11.316 -34.224
  480    HB3  PRO  63           HB3      PRO  63  15.893  11.530 -32.709
  481    HG2  PRO  63           HG2      PRO  63  14.812  10.166 -34.782
  482    HG3  PRO  63           HG3      PRO  63  13.812  11.356 -33.885
  483    HD2  PRO  63           HD2      PRO  63  15.230  11.715 -36.533
  484    HD3  PRO  63           HD3      PRO  63  13.570  12.193 -36.063
  485    H    LEU  64           H        LEU  64  16.958  14.819 -32.337
  486    HA   LEU  64           HA       LEU  64  19.082  15.867 -33.941
  487    HB2  LEU  64           HB2      LEU  64  18.107  17.164 -32.159
  488    HB3  LEU  64           HB3      LEU  64  18.509  15.940 -30.957
  489    HG   LEU  64           HG       LEU  64  20.882  16.421 -31.128
  490   HD11  LEU  64          HD11      LEU  64  21.129  16.968 -33.510
  491   HD12  LEU  64          HD12      LEU  64  20.163  18.436 -33.293
  492   HD13  LEU  64          HD13      LEU  64  21.749  18.277 -32.512
  493   HD21  LEU  64          HD21      LEU  64  19.538  17.831 -29.639
  494   HD22  LEU  64          HD22      LEU  64  20.892  18.743 -30.318
  495   HD23  LEU  64          HD23      LEU  64  19.252  18.988 -30.962
  496    H    GLN  65           H        GLN  65  20.748  14.619 -34.646
  497    HA   GLN  65           HA       GLN  65  22.160  12.818 -32.705
  498    HB2  GLN  65           HB2      GLN  65  21.078  12.051 -35.443
  499    HB3  GLN  65           HB3      GLN  65  22.293  11.110 -34.565
  500    HG2  GLN  65           HG2      GLN  65  20.734  10.921 -32.633
  501    HG3  GLN  65           HG3      GLN  65  19.469  11.694 -33.597
  502   HE21  GLN  65          HE22      GLN  65  19.309   9.086 -32.424
  503   HE22  GLN  65          HE21      GLN  65  19.175   7.936 -33.759
  504    H    GLU  66           H        GLU  66  22.470  15.112 -35.240
  505    HA   GLU  66           HA       GLU  66  24.725  14.374 -36.620
  506    HB2  GLU  66           HB2      GLU  66  24.037  17.214 -35.754
  507    HB3  GLU  66           HB3      GLU  66  25.068  16.737 -37.100
  508    HG2  GLU  66           HG2      GLU  66  23.173  17.107 -38.277
  509    HG3  GLU  66           HG3      GLU  66  22.909  15.410 -37.916
  510    H    ASP  67           H        ASP  67  24.746  15.712 -33.382
  511    HA   ASP  67           HA       ASP  67  27.482  14.710 -33.021
  512    HB2  ASP  67           HB2      ASP  67  28.196  16.790 -31.798
  513    HB3  ASP  67           HB3      ASP  67  27.954  17.013 -33.519
  514    H    ALA  68           H        ALA  68  24.880  13.827 -32.360
  515    HA   ALA  68           HA       ALA  68  25.118  13.307 -29.459
  516    HB1  ALA  68           HB1      ALA  68  22.700  13.857 -29.137
  517    HB2  ALA  68           HB2      ALA  68  23.641  15.282 -29.613
  518    HB3  ALA  68           HB3      ALA  68  22.622  14.451 -30.807
  519    H    ALA  69           H        ALA  69  25.819  11.746 -31.646
  520    HA   ALA  69           HA       ALA  69  24.049  10.284 -33.038
  521    HB1  ALA  69           HB1      ALA  69  26.454  10.388 -33.424
  522    HB2  ALA  69           HB2      ALA  69  26.750   9.364 -31.997
  523    HB3  ALA  69           HB3      ALA  69  25.898   8.706 -33.410
  524    H    ASP  70           H        ASP  70  24.721   9.616 -29.665
  525    HA   ASP  70           HA       ASP  70  22.827   7.311 -29.707
  526    HB2  ASP  70           HB2      ASP  70  25.246   6.602 -29.613
  527    HB3  ASP  70           HB3      ASP  70  25.401   7.480 -28.092
  528    H    GLU  71           H        GLU  71  22.639  10.266 -29.015
  529    HA   GLU  71           HA       GLU  71  21.653  10.070 -26.186
  530    HB2  GLU  71           HB2      GLU  71  23.330  12.283 -27.435
  531    HB3  GLU  71           HB3      GLU  71  22.610  12.328 -25.822
  532    HG2  GLU  71           HG2      GLU  71  23.941  10.316 -25.186
  533    HG3  GLU  71           HG3      GLU  71  24.733  10.357 -26.764
  534    H    SER  72           H        SER  72  20.592  10.525 -29.248
  535    HA   SER  72           HA       SER  72  19.035  12.826 -29.362
  536    HB2  SER  72           HB2      SER  72  17.441  11.129 -30.703
  537    HB3  SER  72           HB3      SER  72  18.954  11.738 -31.341
  538    HG   SER  72           HG       SER  72  18.652   9.230 -30.005
  539    H    GLN  73           H        GLN  73  18.289   9.862 -27.630
  540    HA   GLN  73           HA       GLN  73  15.921  11.145 -26.398
  541    HB2  GLN  73           HB2      GLN  73  14.702   9.054 -26.441
  542    HB3  GLN  73           HB3      GLN  73  15.056   9.607 -28.070
  543    HG2  GLN  73           HG2      GLN  73  16.741   7.469 -26.689
  544    HG3  GLN  73           HG3      GLN  73  15.271   7.102 -27.576
  545   HE21  GLN  73          HE22      GLN  73  15.250   7.262 -29.893
  546   HE22  GLN  73          HE21      GLN  73  16.746   7.491 -30.780
  547    H    ASN  74           H        ASN  74  15.378  10.449 -24.302
  548    HA   ASN  74           HA       ASN  74  17.533   9.168 -22.706
  549    HB2  ASN  74           HB2      ASN  74  16.573  12.057 -22.444
  550    HB3  ASN  74           HB3      ASN  74  17.569  11.228 -21.255
  551   HD21  ASN  74          HD22      ASN  74  17.583  12.857 -24.352
  552   HD22  ASN  74          HD21      ASN  74  19.278  12.598 -24.709
  553    H    ASP  75           H        ASP  75  17.012   8.826 -20.540
  554    HA   ASP  75           HA       ASP  75  14.273   8.913 -19.507
  555    HB2  ASP  75           HB2      ASP  75  14.171   6.993 -21.041
  556    HB3  ASP  75           HB3      ASP  75  15.626   6.305 -20.323
  557    H    TRP  76           H        TRP  76  16.088  10.285 -18.387
  558    HA   TRP  76           HA       TRP  76  18.224   9.201 -16.972
  559    HB2  TRP  76           HB2      TRP  76  16.605  11.694 -16.345
  560    HB3  TRP  76           HB3      TRP  76  18.219  11.357 -15.741
  561    HD1  TRP  76           HD1      TRP  76  19.768  10.492 -18.277
  562    HE1  TRP  76           HE1      TRP  76  20.225  12.094 -20.219
  563    HE3  TRP  76           HE3      TRP  76  16.077  13.940 -17.380
  564    HZ2  TRP  76           HZ2      TRP  76  19.072  14.498 -21.321
  565    HZ3  TRP  76           HZ3      TRP  76  15.735  15.820 -18.938
  566    HH2  TRP  76           HH2      TRP  76  17.217  16.123 -20.909
  567    H    ASP  77           H        ASP  77  14.900   9.102 -15.812
  568    HA   ASP  77           HA       ASP  77  15.741   8.926 -13.016
  569    HB2  ASP  77           HB2      ASP  77  13.580   9.105 -12.418
  570    HB3  ASP  77           HB3      ASP  77  13.574   9.998 -13.927
  571    H    GLU  78           H        GLU  78  15.004   7.151 -11.588
  572    HA   GLU  78           HA       GLU  78  14.546   4.525 -12.864
  573    HB2  GLU  78           HB2      GLU  78  16.192   3.369 -11.568
  574    HB3  GLU  78           HB3      GLU  78  16.978   4.679 -12.438
  575    HG2  GLU  78           HG2      GLU  78  16.804   6.056 -10.278
  576    HG3  GLU  78           HG3      GLU  78  16.310   4.576  -9.466
  577    H    GLU  79           H        GLU  79  12.988   6.616 -11.288
  578    HA   GLU  79           HA       GLU  79  11.635   4.867  -9.383
  579    HB2  GLU  79           HB2      GLU  79  13.830   5.959  -8.298
  580    HB3  GLU  79           HB3      GLU  79  12.815   7.379  -8.165
  581    HG2  GLU  79           HG2      GLU  79  12.756   6.169  -6.096
  582    HG3  GLU  79           HG3      GLU  79  11.170   6.011  -6.823
  583    H    LEU  80           H        LEU  80  11.259   7.062 -11.730
  584    HA   LEU  80           HA       LEU  80   8.941   8.465 -10.485
  585    HB2  LEU  80           HB2      LEU  80  11.155   9.564 -12.257
  586    HB3  LEU  80           HB3      LEU  80   9.616  10.354 -12.137
  587    HG   LEU  80           HG       LEU  80  11.235  11.500 -10.845
  588   HD11  LEU  80          HD11      LEU  80   8.891  11.519 -10.046
  589   HD12  LEU  80          HD12      LEU  80   9.237  10.114  -9.014
  590   HD13  LEU  80          HD13      LEU  80  10.038  11.651  -8.698
  591   HD21  LEU  80          HD21      LEU  80  12.348  10.748  -8.949
  592   HD22  LEU  80          HD22      LEU  80  11.488   9.207  -8.910
  593   HD23  LEU  80          HD23      LEU  80  12.672   9.534 -10.204
  594    H    SER  81           H        SER  81   7.449   9.345 -12.064
  595    HA   SER  81           HA       SER  81   7.437   8.194 -14.812
  596    HB2  SER  81           HB2      SER  81   5.903   6.867 -13.323
  597    HB3  SER  81           HB3      SER  81   4.996   8.360 -12.996
  598    HG   SER  81           HG       SER  81   4.120   7.121 -14.744
  599    H    ILE  82           H        ILE  82   6.636   9.642 -16.358
  600    HA   ILE  82           HA       ILE  82   6.405  12.477 -15.457
  601    HB   ILE  82           HB       ILE  82   7.826  11.107 -17.699
  602   HG12  ILE  82          HG12      ILE  82   9.385  13.033 -17.424
  603   HG13  ILE  82          HG13      ILE  82   8.319  13.720 -16.202
  604   HG21  ILE  82          HG21      ILE  82   6.266  12.366 -19.070
  605   HG22  ILE  82          HG22      ILE  82   6.602  13.858 -18.152
  606   HG23  ILE  82          HG23      ILE  82   7.860  13.099 -19.144
  607   HD11  ILE  82          HD11      ILE  82   8.810  11.852 -14.688
  608   HD12  ILE  82          HD12      ILE  82   9.741  11.028 -15.969
  609   HD13  ILE  82          HD13      ILE  82  10.324  12.554 -15.285
  610    H    HIS  83           H        HIS  83   4.847  13.778 -16.188
  611    HA   HIS  83           HA       HIS  83   2.716  12.796 -18.029
  612    HB2  HIS  83           HB2      HIS  83   2.271  14.175 -15.347
  613    HB3  HIS  83           HB3      HIS  83   1.019  13.703 -16.491
  614    HD1  HIS  83           HD1      HIS  83   0.314  11.093 -16.457
  615    HD2  HIS  83           HD2      HIS  83   3.436  12.209 -13.863
  616    HE1  HIS  83           HE1      HIS  83   0.678   9.121 -14.884
  617    H    LEU  84           H        LEU  84   1.590  14.573 -19.122
  618    HA   LEU  84           HA       LEU  84   2.819  17.261 -18.968
  619    HB2  LEU  84           HB2      LEU  84   4.009  15.388 -20.474
  620    HB3  LEU  84           HB3      LEU  84   2.746  15.798 -21.621
  621    HG   LEU  84           HG       LEU  84   4.611  17.832 -20.351
  622   HD11  LEU  84          HD11      LEU  84   4.951  16.357 -22.988
  623   HD12  LEU  84          HD12      LEU  84   6.003  17.658 -22.377
  624   HD13  LEU  84          HD13      LEU  84   5.930  16.119 -21.518
  625   HD21  LEU  84          HD21      LEU  84   2.768  17.889 -22.780
  626   HD22  LEU  84          HD22      LEU  84   2.892  19.063 -21.444
  627   HD23  LEU  84          HD23      LEU  84   4.148  18.997 -22.658
  628    H    GLN  85           H        GLN  85   1.600  18.889 -19.860
  629    HA   GLN  85           HA       GLN  85  -0.637  18.337 -21.641
  630    HB2  GLN  85           HB2      GLN  85  -2.398  19.273 -20.358
  631    HB3  GLN  85           HB3      GLN  85  -1.595  18.134 -19.314
  632    HG2  GLN  85           HG2      GLN  85  -1.987  19.945 -17.904
  633    HG3  GLN  85           HG3      GLN  85  -0.298  20.148 -18.343
  634   HE21  GLN  85          HE22      GLN  85   0.162  22.316 -18.747
  635   HE22  GLN  85          HE21      GLN  85  -0.971  23.445 -19.496
  636    HA   PRO  86           HA       PRO  86  -2.477  19.982 -22.377
  637    HB2  PRO  86           HB2      PRO  86  -2.940  21.309 -24.685
  638    HB3  PRO  86           HB3      PRO  86  -3.000  22.122 -23.093
  639    HG2  PRO  86           HG2      PRO  86  -0.678  22.059 -25.054
  640    HG3  PRO  86           HG3      PRO  86  -1.416  23.489 -24.262
  641    HD2  PRO  86           HD2      PRO  86   0.813  22.264 -23.264
  642    HD3  PRO  86           HD3      PRO  86  -0.427  22.971 -22.191
  643    H    PHE  87           H        PHE  87   0.514  19.725 -24.156
  644    HA   PHE  87           HA       PHE  87  -0.398  18.287 -26.430
  645    HB2  PHE  87           HB2      PHE  87   2.353  18.320 -25.132
  646    HB3  PHE  87           HB3      PHE  87   1.967  17.810 -26.769
  647    HD1  PHE  87           HD2      PHE  87   0.852  19.533 -28.357
  648    HD2  PHE  87           HD1      PHE  87   3.017  20.581 -24.770
  649    HE1  PHE  87           HE2      PHE  87   1.249  21.817 -29.257
  650    HE2  PHE  87           HE1      PHE  87   3.415  22.858 -25.681
  651    HZ   PHE  87           HZ       PHE  87   2.549  23.467 -27.930
  652    H    LYS  88           H        LYS  88  -0.142  16.187 -27.019
  653    HA   LYS  88           HA       LYS  88  -0.874  14.142 -25.193
  654    HB2  LYS  88           HB2      LYS  88  -0.773  12.642 -27.083
  655    HB3  LYS  88           HB3      LYS  88  -1.534  14.166 -27.519
  656    HG2  LYS  88           HG2      LYS  88   0.790  14.848 -28.487
  657    HG3  LYS  88           HG3      LYS  88   1.207  13.133 -28.322
  658    HD2  LYS  88           HD2      LYS  88  -0.771  12.554 -29.746
  659    HD3  LYS  88           HD3      LYS  88  -1.077  14.296 -29.964
  660    HE2  LYS  88           HE2      LYS  88   1.208  14.566 -30.917
  661    HE3  LYS  88           HE3      LYS  88   1.498  12.834 -30.712
  662    HZ1  LYS  88           HZ1      LYS  88  -0.328  12.413 -32.281
  663    HZ2  LYS  88           HZ2      LYS  88  -0.578  14.013 -32.483
  664    HZ3  LYS  88           HZ3      LYS  88   0.822  13.337 -32.976
  665    HA   PRO  89           HA       PRO  89   3.356  12.950 -23.948
  666    HB2  PRO  89           HB2      PRO  89   2.790  11.492 -21.743
  667    HB3  PRO  89           HB3      PRO  89   2.543  13.260 -21.778
  668    HG2  PRO  89           HG2      PRO  89   0.457  11.099 -22.241
  669    HG3  PRO  89           HG3      PRO  89   0.362  12.509 -21.140
  670    HD2  PRO  89           HD2      PRO  89  -0.690  12.504 -23.685
  671    HD3  PRO  89           HD3      PRO  89  -0.051  13.981 -22.904
  672    H    ASP  90           H        ASP  90   3.054  11.842 -26.174
  673    HA   ASP  90           HA       ASP  90   3.228   8.902 -25.923
  674    HB2  ASP  90           HB2      ASP  90   0.813   9.401 -26.286
  675    HB3  ASP  90           HB3      ASP  90   1.228  10.298 -27.748
  676    H    ASP  91           H        ASP  91   4.060   7.891 -27.880
  677    HA   ASP  91           HA       ASP  91   6.326   9.316 -28.885
  678    HB2  ASP  91           HB2      ASP  91   6.461   6.976 -28.326
  679    HB3  ASP  91           HB3      ASP  91   5.330   6.574 -29.623
  680    H    SER  92           H        SER  92   5.300  11.067 -29.864
  681    HA   SER  92           HA       SER  92   3.695  10.887 -32.270
  682    HB2  SER  92           HB2      SER  92   3.573  12.685 -30.558
  683    HB3  SER  92           HB3      SER  92   5.185  13.228 -31.036
  684    HG   SER  92           HG       SER  92   3.491  14.375 -32.112
  685    H    ASN  93           H        ASN  93   4.222  11.839 -34.286
  686    HA   ASN  93           HA       ASN  93   6.855  11.235 -35.411
  687    HB2  ASN  93           HB2      ASN  93   4.684  10.874 -36.608
  688    HB3  ASN  93           HB3      ASN  93   4.393  12.615 -36.585
  689   HD21  ASN  93          HD22      ASN  93   6.826  10.183 -37.697
  690   HD22  ASN  93          HD21      ASN  93   7.248  11.091 -39.134
  691    H    GLN  94           H        GLN  94   5.663  13.857 -33.630
  692    HA   GLN  94           HA       GLN  94   7.808  15.684 -34.615
  693    HB2  GLN  94           HB2      GLN  94   6.303  17.565 -34.466
  694    HB3  GLN  94           HB3      GLN  94   5.561  16.378 -35.516
  695    HG2  GLN  94           HG2      GLN  94   3.922  15.792 -33.867
  696    HG3  GLN  94           HG3      GLN  94   4.811  16.538 -32.544
  697   HE21  GLN  94          HE22      GLN  94   4.908  18.881 -32.366
  698   HE22  GLN  94          HE21      GLN  94   3.688  19.844 -33.197
  699    HA   PRO  95           HA       PRO  95   8.354  16.317 -30.167
  700    HB2  PRO  95           HB2      PRO  95   9.270  18.869 -29.992
  701    HB3  PRO  95           HB3      PRO  95  10.276  17.539 -30.652
  702    HG2  PRO  95           HG2      PRO  95   8.622  19.576 -32.186
  703    HG3  PRO  95           HG3      PRO  95  10.327  19.094 -32.478
  704    HD2  PRO  95           HD2      PRO  95   8.266  18.039 -33.881
  705    HD3  PRO  95           HD3      PRO  95   9.673  17.043 -33.431
  706    H    GLN  96           H        GLN  96   7.050  16.990 -28.488
  707    HA   GLN  96           HA       GLN  96   4.560  18.416 -28.989
  708    HB2  GLN  96           HB2      GLN  96   5.975  17.386 -26.478
  709    HB3  GLN  96           HB3      GLN  96   4.475  18.288 -26.434
  710    HG2  GLN  96           HG2      GLN  96   3.797  16.056 -26.314
  711    HG3  GLN  96           HG3      GLN  96   3.437  16.544 -27.967
  712   HE21  GLN  96          HE22      GLN  96   3.365  14.004 -27.881
  713   HE22  GLN  96          HE21      GLN  96   4.858  13.210 -28.322
  714    H    VAL  97           H        VAL  97   7.534  19.220 -27.121
  715    HA   VAL  97           HA       VAL  97   6.695  22.028 -26.727
  716    HB   VAL  97           HB       VAL  97   9.338  20.629 -26.110
  717   HG11  VAL  97          HG11      VAL  97   9.667  22.430 -24.454
  718   HG12  VAL  97          HG12      VAL  97   9.567  23.079 -26.089
  719   HG13  VAL  97          HG13      VAL  97   8.168  23.208 -24.999
  720   HG21  VAL  97          HG21      VAL  97   6.924  21.040 -24.301
  721   HG22  VAL  97          HG22      VAL  97   7.565  19.482 -24.867
  722   HG23  VAL  97          HG23      VAL  97   8.521  20.470 -23.771
  723    H    VAL  98           H        VAL  98   7.508  23.788 -27.873
  724    HA   VAL  98           HA       VAL  98   9.718  23.290 -29.821
  725    HB   VAL  98           HB       VAL  98   7.083  24.616 -30.447
  726   HG11  VAL  98          HG11      VAL  98   9.618  24.697 -32.137
  727   HG12  VAL  98          HG12      VAL  98   8.000  25.186 -32.670
  728   HG13  VAL  98          HG13      VAL  98   8.803  26.097 -31.396
  729   HG21  VAL  98          HG21      VAL  98   7.158  22.184 -30.793
  730   HG22  VAL  98          HG22      VAL  98   7.095  23.024 -32.343
  731   HG23  VAL  98          HG23      VAL  98   8.636  22.352 -31.764
  732    H    ILE  99           H        ILE  99  11.121  24.889 -30.164
  733    HA   ILE  99           HA       ILE  99  11.231  27.140 -28.186
  734    HB   ILE  99           HB       ILE  99  13.486  25.369 -29.236
  735   HG12  ILE  99          HG12      ILE  99  13.773  24.750 -26.751
  736   HG13  ILE  99          HG13      ILE  99  12.090  25.205 -26.558
  737   HG21  ILE  99          HG21      ILE  99  14.271  27.619 -28.738
  738   HG22  ILE  99          HG22      ILE  99  13.504  27.581 -27.143
  739   HG23  ILE  99          HG23      ILE  99  14.865  26.505 -27.533
  740   HD11  ILE  99          HD11      ILE  99  13.108  23.063 -28.512
  741   HD12  ILE  99          HD12      ILE  99  12.523  22.767 -26.861
  742   HD13  ILE  99          HD13      ILE  99  11.416  23.395 -28.069
  743    H    LEU 100           H        LEU 100  11.578  29.121 -29.135
  744    HA   LEU 100           HA       LEU 100  12.493  29.247 -31.967
  745    HB2  LEU 100           HB2      LEU 100  11.741  31.542 -30.136
  746    HB3  LEU 100           HB3      LEU 100  11.987  31.577 -31.880
  747    HG   LEU 100           HG       LEU 100   9.641  30.461 -30.325
  748   HD11  LEU 100          HD11      LEU 100   8.383  32.014 -31.708
  749   HD12  LEU 100          HD12      LEU 100   9.766  32.898 -31.037
  750   HD13  LEU 100          HD13      LEU 100   9.807  32.354 -32.715
  751   HD21  LEU 100          HD21      LEU 100  10.074  28.756 -32.029
  752   HD22  LEU 100          HD22      LEU 100   8.683  29.723 -32.520
  753   HD23  LEU 100          HD23      LEU 100  10.267  30.014 -33.275
  754    H    ALA 101           H        ALA 101  14.249  30.561 -32.559
  755    HA   ALA 101           HA       ALA 101  16.661  30.351 -31.049
  756    HB1  ALA 101           HB1      ALA 101  16.562  30.555 -33.505
  757    HB2  ALA 101           HB2      ALA 101  15.946  32.217 -33.352
  758    HB3  ALA 101           HB3      ALA 101  17.586  31.823 -32.804
  759    H    ASP 102           H        ASP 102  14.167  32.755 -30.857
  760    HA   ASP 102           HA       ASP 102  15.629  34.865 -29.520
  761    HB2  ASP 102           HB2      ASP 102  13.555  35.228 -30.769
  762    HB3  ASP 102           HB3      ASP 102  12.686  34.112 -29.719
  763    H    GLY 103           H        GLY 103  14.440  31.772 -28.429
  764    HA2  GLY 103           HA2      GLY 103  14.818  30.817 -26.352
  765    HA3  GLY 103           HA3      GLY 103  15.064  32.398 -25.608
  766    H    GLN 104           H        GLN 104  12.191  32.419 -27.461
  767    HA   GLN 104           HA       GLN 104  10.495  32.019 -25.076
  768    HB2  GLN 104           HB2      GLN 104   8.679  32.915 -26.361
  769    HB3  GLN 104           HB3      GLN 104  10.055  34.013 -26.372
  770    HG2  GLN 104           HG2      GLN 104  10.650  33.112 -28.672
  771    HG3  GLN 104           HG3      GLN 104   9.132  32.196 -28.636
  772   HE21  GLN 104          HE22      GLN 104  10.514  35.502 -28.432
  773   HE22  GLN 104          HE21      GLN 104   9.072  36.296 -29.083
  774    H    ILE 105           H        ILE 105   8.821  30.497 -25.120
  775    HA   ILE 105           HA       ILE 105   9.388  28.062 -26.775
  776    HB   ILE 105           HB       ILE 105   8.803  27.940 -23.825
  777   HG12  ILE 105          HG12      ILE 105  10.781  29.327 -23.798
  778   HG13  ILE 105          HG13      ILE 105  11.066  27.747 -23.118
  779   HG21  ILE 105          HG21      ILE 105  10.093  25.777 -23.994
  780   HG22  ILE 105          HG22      ILE 105   8.611  25.825 -24.946
  781   HG23  ILE 105          HG23      ILE 105  10.179  26.043 -25.746
  782   HD11  ILE 105          HD11      ILE 105  11.978  28.671 -25.865
  783   HD12  ILE 105          HD12      ILE 105  12.969  28.518 -24.418
  784   HD13  ILE 105          HD13      ILE 105  12.280  27.065 -25.152
  785    H    THR 106           H        THR 106   7.583  26.532 -26.867
  786    HA   THR 106           HA       THR 106   4.926  27.543 -26.906
  787    HB   THR 106           HB       THR 106   4.367  25.026 -26.668
  788    HG1  THR 106           HG1      THR 106   6.351  24.559 -25.609
  789   HG21  THR 106          HG21      THR 106   5.251  24.481 -28.908
  790   HG22  THR 106          HG22      THR 106   4.477  26.077 -28.854
  791   HG23  THR 106          HG23      THR 106   6.249  25.960 -28.852
  792    HA   PRO 107           HA       PRO 107   4.314  27.453 -22.404
  793    HB2  PRO 107           HB2      PRO 107   1.657  28.132 -22.261
  794    HB3  PRO 107           HB3      PRO 107   2.987  29.290 -22.540
  795    HG2  PRO 107           HG2      PRO 107   1.140  28.061 -24.568
  796    HG3  PRO 107           HG3      PRO 107   1.737  29.752 -24.451
  797    HD2  PRO 107           HD2      PRO 107   2.802  27.862 -26.157
  798    HD3  PRO 107           HD3      PRO 107   3.754  29.212 -25.469
  799    H    PHE 108           H        PHE 108   4.283  25.561 -21.404
  800    HA   PHE 108           HA       PHE 108   1.968  23.761 -21.474
  801    HB2  PHE 108           HB2      PHE 108   3.109  21.837 -22.153
  802    HB3  PHE 108           HB3      PHE 108   3.645  23.036 -23.295
  803    HD1  PHE 108           HD1      PHE 108   5.966  24.121 -22.897
  804    HD2  PHE 108           HD2      PHE 108   4.660  20.577 -20.848
  805    HE1  PHE 108           HE1      PHE 108   8.322  23.553 -22.409
  806    HE2  PHE 108           HE2      PHE 108   7.028  19.972 -20.408
  807    HZ   PHE 108           HZ       PHE 108   8.856  21.457 -21.167
  808    H    SER 109           H        SER 109   2.404  21.877 -19.877
  809    HA   SER 109           HA       SER 109   4.324  22.574 -17.779
  810    HB2  SER 109           HB2      SER 109   2.829  22.298 -15.917
  811    HB3  SER 109           HB3      SER 109   2.254  23.603 -16.957
  812    HG   SER 109           HG       SER 109   1.246  20.935 -16.809
  813    H    LEU 110           H        LEU 110   4.948  20.878 -16.474
  814    HA   LEU 110           HA       LEU 110   4.502  18.114 -17.507
  815    HB2  LEU 110           HB2      LEU 110   6.300  18.595 -18.795
  816    HB3  LEU 110           HB3      LEU 110   6.825  19.940 -17.798
  817    HG   LEU 110           HG       LEU 110   7.931  18.422 -16.231
  818   HD11  LEU 110          HD11      LEU 110   6.667  16.276 -16.622
  819   HD12  LEU 110          HD12      LEU 110   7.249  16.253 -18.292
  820   HD13  LEU 110          HD13      LEU 110   8.386  16.065 -16.939
  821   HD21  LEU 110          HD21      LEU 110   9.117  19.442 -18.153
  822   HD22  LEU 110          HD22      LEU 110   9.780  17.847 -17.763
  823   HD23  LEU 110          HD23      LEU 110   8.703  18.043 -19.160
  824    H    LEU 111           H        LEU 111   4.392  16.661 -15.898
  825    HA   LEU 111           HA       LEU 111   5.112  17.481 -13.118
  826    HB2  LEU 111           HB2      LEU 111   2.750  17.752 -13.568
  827    HB3  LEU 111           HB3      LEU 111   2.603  16.126 -14.200
  828    HG   LEU 111           HG       LEU 111   3.627  16.476 -11.396
  829   HD11  LEU 111          HD11      LEU 111   1.332  16.548 -10.505
  830   HD12  LEU 111          HD12      LEU 111   1.718  17.994 -11.450
  831   HD13  LEU 111          HD13      LEU 111   0.693  16.723 -12.158
  832   HD21  LEU 111          HD21      LEU 111   1.644  14.484 -12.607
  833   HD22  LEU 111          HD22      LEU 111   3.374  14.168 -12.432
  834   HD23  LEU 111          HD23      LEU 111   2.383  14.394 -10.996
  835    H    MET 112           H        MET 112   5.720  15.838 -11.694
  836    HA   MET 112           HA       MET 112   6.520  13.230 -12.910
  837    HB2  MET 112           HB2      MET 112   8.189  14.899 -10.989
  838    HB3  MET 112           HB3      MET 112   8.614  13.326 -11.673
  839    HG2  MET 112           HG2      MET 112   8.586  14.352 -13.954
  840    HG3  MET 112           HG3      MET 112   8.288  15.927 -13.210
  841    HE1  MET 112           HE1      MET 112  11.940  16.426 -14.368
  842    HE2  MET 112           HE2      MET 112  10.625  15.589 -15.226
  843    HE3  MET 112           HE3      MET 112  10.291  17.087 -14.323
  844    H    ALA 113           H        ALA 113   6.215  11.476 -11.599
  845    HA   ALA 113           HA       ALA 113   5.257  11.861  -8.789
  846    HB1  ALA 113           HB1      ALA 113   3.996  10.204 -11.028
  847    HB2  ALA 113           HB2      ALA 113   3.462  10.202  -9.338
  848    HB3  ALA 113           HB3      ALA 113   3.317  11.680 -10.310
  849    H    ASN 114           H        ASN 114   5.736  10.145  -7.351
  850    HA   ASN 114           HA       ASN 114   8.098   8.553  -7.922
  851    HB2  ASN 114           HB2      ASN 114   7.588   9.385  -5.713
  852    HB3  ASN 114           HB3      ASN 114   6.088   8.471  -5.649
  853   HD21  ASN 114          HD22      ASN 114   8.111   8.279  -3.709
  854   HD22  ASN 114          HD21      ASN 114   8.897   6.714  -3.859
  855    H    ALA 115           H        ALA 115   8.195   6.669  -8.995
  856    HA   ALA 115           HA       ALA 115   5.967   5.463 -10.258
  857    HB1  ALA 115           HB1      ALA 115   7.630   3.783 -10.976
  858    HB2  ALA 115           HB2      ALA 115   8.273   5.427 -11.115
  859    HB3  ALA 115           HB3      ALA 115   8.778   4.388  -9.762
  860    H    GLY 116           H        GLY 116   7.288   4.812  -7.064
  861    HA2  GLY 116           HA2      GLY 116   5.867   2.200  -6.800
  862    HA3  GLY 116           HA3      GLY 116   7.027   2.907  -5.677
  863    H    THR 117           H        THR 117   6.043   5.396  -5.091
  864    HA   THR 117           HA       THR 117   3.872   4.855  -3.294
  865    HB   THR 117           HB       THR 117   4.805   7.584  -4.233
  866    HG1  THR 117           HG1      THR 117   6.312   7.487  -2.685
  867   HG21  THR 117          HG21      THR 117   4.240   8.253  -1.888
  868   HG22  THR 117          HG22      THR 117   2.833   7.789  -2.849
  869   HG23  THR 117          HG23      THR 117   3.485   6.659  -1.655
  870    H    GLY 118           H        GLY 118   3.938   6.155  -6.604
  871    HA2  GLY 118           HA2      GLY 118   2.252   6.444  -8.104
  872    HA3  GLY 118           HA3      GLY 118   1.097   5.761  -6.949
  873    H    GLU 119           H        GLU 119   3.146   8.606  -6.348
  874    HA   GLU 119           HA       GLU 119   0.775  10.422  -6.308
  875    HB2  GLU 119           HB2      GLU 119   2.835   9.905  -4.130
  876    HB3  GLU 119           HB3      GLU 119   1.884  11.379  -4.172
  877    HG2  GLU 119           HG2      GLU 119   0.624   8.610  -4.067
  878    HG3  GLU 119           HG3      GLU 119   1.049   9.551  -2.646
  879    HA   PRO 120           HA       PRO 120   3.494  13.194  -8.417
  880    HB2  PRO 120           HB2      PRO 120   2.544  15.669  -7.737
  881    HB3  PRO 120           HB3      PRO 120   1.688  14.539  -8.820
  882    HG2  PRO 120           HG2      PRO 120   1.225  14.946  -5.852
  883    HG3  PRO 120           HG3      PRO 120   0.008  14.894  -7.168
  884    HD2  PRO 120           HD2      PRO 120   0.552  12.717  -5.640
  885    HD3  PRO 120           HD3      PRO 120   0.218  12.549  -7.389
  886    H    LEU 121           H        LEU 121   5.269  14.431  -8.186
  887    HA   LEU 121           HA       LEU 121   6.459  14.751  -5.470
  888    HB2  LEU 121           HB2      LEU 121   7.076  13.068  -7.779
  889    HB3  LEU 121           HB3      LEU 121   8.361  14.229  -7.618
  890    HG   LEU 121           HG       LEU 121   8.857  12.176  -6.525
  891   HD11  LEU 121          HD11      LEU 121   8.421  14.368  -4.449
  892   HD12  LEU 121          HD12      LEU 121   9.577  13.030  -4.366
  893   HD13  LEU 121          HD13      LEU 121   9.756  14.290  -5.616
  894   HD21  LEU 121          HD21      LEU 121   6.520  11.516  -5.845
  895   HD22  LEU 121          HD22      LEU 121   7.695  11.377  -4.516
  896   HD23  LEU 121          HD23      LEU 121   6.569  12.735  -4.568
  897    H    LEU 122           H        LEU 122   6.558  15.899  -8.826
  898    HA   LEU 122           HA       LEU 122   7.456  18.611  -8.012
  899    HB2  LEU 122           HB2      LEU 122   9.461  16.942  -8.398
  900    HB3  LEU 122           HB3      LEU 122   8.960  16.963 -10.084
  901    HG   LEU 122           HG       LEU 122   9.248  19.557  -9.921
  902   HD11  LEU 122          HD11      LEU 122  10.806  18.612  -7.464
  903   HD12  LEU 122          HD12      LEU 122  10.939  20.220  -8.198
  904   HD13  LEU 122          HD13      LEU 122   9.421  19.713  -7.461
  905   HD21  LEU 122          HD21      LEU 122  11.583  19.331 -10.452
  906   HD22  LEU 122          HD22      LEU 122  11.668  17.748  -9.649
  907   HD23  LEU 122          HD23      LEU 122  10.724  17.962 -11.141
  908    H    THR 123           H        THR 123   7.120  20.149  -9.661
  909    HA   THR 123           HA       THR 123   5.945  19.267 -12.230
  910    HB   THR 123           HB       THR 123   4.545  21.295 -10.456
  911    HG1  THR 123           HG1      THR 123   4.324  18.536 -10.689
  912   HG21  THR 123          HG21      THR 123   2.634  20.904 -11.958
  913   HG22  THR 123          HG22      THR 123   4.007  21.606 -12.831
  914   HG23  THR 123          HG23      THR 123   3.647  19.864 -12.981
  915    H    LEU 124           H        LEU 124   6.225  20.665 -13.846
  916    HA   LEU 124           HA       LEU 124   7.981  23.033 -13.455
  917    HB2  LEU 124           HB2      LEU 124   8.065  20.975 -15.694
  918    HB3  LEU 124           HB3      LEU 124   9.144  22.349 -15.487
  919    HG   LEU 124           HG       LEU 124   9.022  19.872 -13.722
  920   HD11  LEU 124          HD11      LEU 124  10.090  19.590 -15.949
  921   HD12  LEU 124          HD12      LEU 124  11.189  20.935 -15.583
  922   HD13  LEU 124          HD13      LEU 124  11.247  19.435 -14.629
  923   HD21  LEU 124          HD21      LEU 124   9.634  21.794 -12.336
  924   HD22  LEU 124          HD22      LEU 124  11.041  20.786 -12.624
  925   HD23  LEU 124          HD23      LEU 124  10.850  22.311 -13.526
  926    H    VAL 125           H        VAL 125   7.359  24.797 -14.545
  927    HA   VAL 125           HA       VAL 125   4.971  24.688 -16.372
  928    HB   VAL 125           HB       VAL 125   5.428  26.720 -14.150
  929   HG11  VAL 125          HG11      VAL 125   2.994  26.098 -15.889
  930   HG12  VAL 125          HG12      VAL 125   3.046  27.274 -14.559
  931   HG13  VAL 125          HG13      VAL 125   4.019  27.549 -16.001
  932   HG21  VAL 125          HG21      VAL 125   3.560  25.617 -12.951
  933   HG22  VAL 125          HG22      VAL 125   3.588  24.289 -14.140
  934   HG23  VAL 125          HG23      VAL 125   4.973  24.579 -13.060
  935    H    CYS 126           H        CYS 126   5.202  25.787 -18.241
  936    HA   CYS 126           HA       CYS 126   7.685  27.350 -18.632
  937    HB2  CYS 126           HB2      CYS 126   7.094  25.513 -20.120
  938    HB3  CYS 126           HB3      CYS 126   5.537  26.266 -20.479
  939    HG   CYS 126           HG       CYS 126   6.940  26.612 -22.594
  940    H    SER 127           H        SER 127   4.210  27.998 -18.951
  941    HA   SER 127           HA       SER 127   2.993  29.811 -19.511
  942    HB2  SER 127           HB2      SER 127   5.145  31.329 -18.011
  943    HB3  SER 127           HB3      SER 127   3.503  31.900 -18.343
  944    HG   SER 127           HG       SER 127   2.687  30.231 -17.074
  945    H    GLY 128           H        GLY 128   5.986  29.659 -21.086
  946    HA2  GLY 128           HA2      GLY 128   5.457  30.240 -23.515
  947    HA3  GLY 128           HA3      GLY 128   5.247  31.891 -22.948
  948    H    SER 129           H        SER 129   7.843  30.636 -21.153
  949    HA   SER 129           HA       SER 129   9.901  31.297 -23.162
  950    HB2  SER 129           HB2      SER 129   8.882  33.489 -22.344
  951    HB3  SER 129           HB3      SER 129   9.617  33.129 -20.768
  952    HG   SER 129           HG       SER 129  10.975  34.395 -22.146
  953    H    TRP 130           H        TRP 130  12.058  31.103 -22.508
  954    HA   TRP 130           HA       TRP 130  12.745  28.996 -20.779
  955    HB2  TRP 130           HB2      TRP 130  14.130  29.590 -22.603
  956    HB3  TRP 130           HB3      TRP 130  14.217  31.272 -22.117
  957    HD1  TRP 130           HD1      TRP 130  16.199  32.044 -20.765
  958    HE1  TRP 130           HE1      TRP 130  18.166  30.954 -19.530
  959    HE3  TRP 130           HE3      TRP 130  14.819  27.142 -21.233
  960    HZ2  TRP 130           HZ2      TRP 130  19.052  28.279 -18.855
  961    HZ3  TRP 130           HZ3      TRP 130  16.218  25.353 -20.214
  962    HH2  TRP 130           HH2      TRP 130  18.319  25.914 -19.041
  963    HA   PRO 131           HA       PRO 131  13.478  27.921 -19.255
  964    HB2  PRO 131           HB2      PRO 131  14.306  27.089 -16.854
  965    HB3  PRO 131           HB3      PRO 131  15.428  27.961 -17.932
  966    HG2  PRO 131           HG2      PRO 131  13.874  29.061 -15.589
  967    HG3  PRO 131           HG3      PRO 131  15.603  29.294 -16.011
  968    HD2  PRO 131           HD2      PRO 131  13.554  31.085 -16.679
  969    HD3  PRO 131           HD3      PRO 131  15.091  30.936 -17.576
  970    H    LEU 132           H        LEU 132  12.313  26.072 -17.941
  971    HA   LEU 132           HA       LEU 132   9.647  26.906 -17.141
  972    HB2  LEU 132           HB2      LEU 132  11.094  24.232 -17.219
  973    HB3  LEU 132           HB3      LEU 132   9.632  24.446 -16.262
  974    HG   LEU 132           HG       LEU 132   8.513  25.394 -18.324
  975   HD11  LEU 132          HD11      LEU 132   9.345  24.594 -20.510
  976   HD12  LEU 132          HD12      LEU 132  10.430  25.775 -19.781
  977   HD13  LEU 132          HD13      LEU 132  10.839  24.044 -19.725
  978   HD21  LEU 132          HD21      LEU 132   7.963  23.204 -17.418
  979   HD22  LEU 132          HD22      LEU 132   7.842  23.250 -19.165
  980   HD23  LEU 132          HD23      LEU 132   9.242  22.462 -18.403
  981    H    ASP 133           H        ASP 133   8.760  26.884 -15.200
  982    HA   ASP 133           HA       ASP 133  10.519  27.515 -12.885
  983    HB2  ASP 133           HB2      ASP 133   8.842  29.174 -13.608
  984    HB3  ASP 133           HB3      ASP 133   7.553  27.988 -13.391
  985    H    GLN 134           H        GLN 134  10.702  26.177 -11.185
  986    HA   GLN 134           HA       GLN 134   9.305  23.606 -11.219
  987    HB2  GLN 134           HB2      GLN 134  11.760  23.751 -11.265
  988    HB3  GLN 134           HB3      GLN 134  11.759  24.678  -9.759
  989    HG2  GLN 134           HG2      GLN 134  10.824  22.718  -8.549
  990    HG3  GLN 134           HG3      GLN 134  10.793  21.805 -10.062
  991   HE21  GLN 134          HE22      GLN 134  12.725  20.725 -10.663
  992   HE22  GLN 134          HE21      GLN 134  14.242  20.951  -9.807
  993    H    THR 135           H        THR 135   8.109  22.790  -9.619
  994    HA   THR 135           HA       THR 135   8.037  24.003  -6.915
  995    HB   THR 135           HB       THR 135   6.208  25.071  -8.188
  996    HG1  THR 135           HG1      THR 135   5.495  25.063  -6.260
  997   HG21  THR 135          HG21      THR 135   4.182  23.862  -8.773
  998   HG22  THR 135          HG22      THR 135   5.544  23.261  -9.725
  999   HG23  THR 135          HG23      THR 135   4.939  22.312  -8.340
 1000    H    LEU 136           H        LEU 136   7.242  22.550  -5.293
 1001    HA   LEU 136           HA       LEU 136   7.582  19.674  -5.874
 1002    HB2  LEU 136           HB2      LEU 136   6.755  21.205  -3.372
 1003    HB3  LEU 136           HB3      LEU 136   6.911  19.453  -3.453
 1004    HG   LEU 136           HG       LEU 136   9.205  21.409  -3.929
 1005   HD11  LEU 136          HD11      LEU 136   8.555  19.659  -1.521
 1006   HD12  LEU 136          HD12      LEU 136  10.001  20.674  -1.725
 1007   HD13  LEU 136          HD13      LEU 136   8.405  21.429  -1.595
 1008   HD21  LEU 136          HD21      LEU 136   9.174  18.371  -3.624
 1009   HD22  LEU 136          HD22      LEU 136   9.604  19.275  -5.089
 1010   HD23  LEU 136          HD23      LEU 136  10.634  19.386  -3.663
 1011    H    ALA 137           H        ALA 137   5.999  18.290  -6.245
 1012    HA   ALA 137           HA       ALA 137   3.971  17.755  -7.295
 1013    HB1  ALA 137           HB1      ALA 137   4.293  16.702  -5.084
 1014    HB2  ALA 137           HB2      ALA 137   3.408  18.034  -4.314
 1015    HB3  ALA 137           HB3      ALA 137   2.570  16.943  -5.435
 1016    H    ARG 138           H        ARG 138   3.694  19.855  -8.454
 1017    HA   ARG 138           HA       ARG 138   2.683  21.735  -9.106
 1018    HB2  ARG 138           HB2      ARG 138   0.452  21.458  -9.768
 1019    HB3  ARG 138           HB3      ARG 138   1.277  19.934  -9.939
 1020    HG2  ARG 138           HG2      ARG 138  -0.315  20.386  -7.406
 1021    HG3  ARG 138           HG3      ARG 138  -1.193  20.198  -8.919
 1022    HD2  ARG 138           HD2      ARG 138  -0.114  18.057  -9.369
 1023    HD3  ARG 138           HD3      ARG 138   0.814  18.152  -7.881
 1024    HE   ARG 138           HE       ARG 138  -1.991  17.433  -8.203
 1025   HH11  ARG 138          HH11      ARG 138   0.241  18.680  -5.767
 1026   HH12  ARG 138          HH12      ARG 138  -0.728  18.028  -4.473
 1027   HH21  ARG 138          HH21      ARG 138  -3.143  16.682  -6.485
 1028   HH22  ARG 138          HH22      ARG 138  -2.578  16.955  -4.867
 1029    H    ASP 139           H        ASP 139   3.056  21.854  -6.038
 1030    HA   ASP 139           HA       ASP 139   0.882  23.140  -4.875
 1031    HB2  ASP 139           HB2      ASP 139   2.840  22.222  -3.702
 1032    HB3  ASP 139           HB3      ASP 139   3.837  23.545  -4.313
 1033    H    THR 140           H        THR 140   3.531  24.742  -6.634
 1034    HA   THR 140           HA       THR 140   2.373  27.418  -6.272
 1035    HB   THR 140           HB       THR 140   4.621  26.669  -8.163
 1036    HG1  THR 140           HG1      THR 140   5.917  27.297  -6.278
 1037   HG21  THR 140          HG21      THR 140   3.978  29.008  -8.386
 1038   HG22  THR 140          HG22      THR 140   3.982  29.219  -6.618
 1039   HG23  THR 140          HG23      THR 140   5.496  28.926  -7.505
 1040    H    ARG 141           H        ARG 141   1.689  24.896  -8.488
 1041    HA   ARG 141           HA       ARG 141   1.607  26.353 -10.961
 1042    HB2  ARG 141           HB2      ARG 141   1.775  23.821 -10.651
 1043    HB3  ARG 141           HB3      ARG 141   0.051  23.839 -10.250
 1044    HG2  ARG 141           HG2      ARG 141  -0.260  25.037 -12.551
 1045    HG3  ARG 141           HG3      ARG 141   1.394  24.533 -12.886
 1046    HD2  ARG 141           HD2      ARG 141   0.673  22.163 -12.468
 1047    HD3  ARG 141           HD3      ARG 141  -0.982  22.736 -12.221
 1048    HE   ARG 141           HE       ARG 141   0.391  22.357 -14.747
 1049   HH11  ARG 141          HH12      ARG 141  -2.207  24.430 -13.380
 1050   HH12  ARG 141          HH11      ARG 141  -2.898  24.578 -14.962
 1051   HH21  ARG 141          HH21      ARG 141  -0.517  22.795 -16.627
 1052   HH22  ARG 141          HH22      ARG 141  -1.989  23.732 -16.728
 1053    HA   PRO 142           HA       PRO 142  -2.428  28.453 -10.667
 1054    HB2  PRO 142           HB2      PRO 142  -2.341  27.865 -13.634
 1055    HB3  PRO 142           HB3      PRO 142  -2.863  29.362 -12.800
 1056    HG2  PRO 142           HG2      PRO 142  -0.400  29.223 -13.909
 1057    HG3  PRO 142           HG3      PRO 142  -0.600  29.943 -12.277
 1058    HD2  PRO 142           HD2      PRO 142   0.355  27.174 -13.009
 1059    HD3  PRO 142           HD3      PRO 142   0.981  28.299 -11.767
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1   8.251  -5.878  -3.003
    2    H2   MET   1           H2       MET   1   9.362  -4.771  -2.551
    3    H3   MET   1           H3       MET   1   8.705  -5.781  -1.439
    4    HA   MET   1           HA       MET   1   6.524  -4.788  -1.732
    5    HB2  MET   1           HB2      MET   1   8.698  -2.726  -1.141
    6    HB3  MET   1           HB3      MET   1   6.973  -2.502  -0.842
    7    HG2  MET   1           HG2      MET   1   7.020  -4.512   0.666
    8    HG3  MET   1           HG3      MET   1   8.779  -4.531   0.515
    9    HE1  MET   1           HE1      MET   1   9.518  -1.338   0.579
   10    HE2  MET   1           HE2      MET   1   9.833  -1.197   2.318
   11    HE3  MET   1           HE3      MET   1  10.387  -2.636   1.435
   12    H    ALA   2           H        ALA   2   5.133  -3.347  -2.808
   13    HA   ALA   2           HA       ALA   2   5.680  -2.838  -5.566
   14    HB1  ALA   2           HB1      ALA   2   3.480  -1.777  -3.739
   15    HB2  ALA   2           HB2      ALA   2   3.461  -1.762  -5.515
   16    HB3  ALA   2           HB3      ALA   2   3.445  -3.307  -4.647
   17    H    TYR   3           H        TYR   3   6.336  -0.854  -2.767
   18    HA   TYR   3           HA       TYR   3   7.561   1.225  -4.436
   19    HB2  TYR   3           HB2      TYR   3   6.401   3.056  -3.285
   20    HB3  TYR   3           HB3      TYR   3   5.280   2.053  -4.175
   21    HD1  TYR   3           HD1      TYR   3   6.385   3.072  -0.790
   22    HD2  TYR   3           HD2      TYR   3   3.573   0.715  -3.066
   23    HE1  TYR   3           HE1      TYR   3   4.984   2.784   1.240
   24    HE2  TYR   3           HE2      TYR   3   2.169   0.430  -1.027
   25    HH   TYR   3           HH       TYR   3   3.080   1.868   2.126
   26    H    GLY   4           H        GLY   4   8.717   2.849  -2.976
   27    HA2  GLY   4           HA2      GLY   4   9.348   2.570  -0.310
   28    HA3  GLY   4           HA3      GLY   4  10.422   1.403  -1.087
   29    H    ARG   5           H        ARG   5  10.861   3.009  -3.504
   30    HA   ARG   5           HA       ARG   5  13.020   4.724  -2.604
   31    HB2  ARG   5           HB2      ARG   5  11.851   4.237  -5.381
   32    HB3  ARG   5           HB3      ARG   5  13.302   5.187  -5.055
   33    HG2  ARG   5           HG2      ARG   5  14.352   3.179  -3.969
   34    HG3  ARG   5           HG3      ARG   5  12.946   2.228  -4.466
   35    HD2  ARG   5           HD2      ARG   5  14.640   1.855  -6.111
   36    HD3  ARG   5           HD3      ARG   5  13.416   2.873  -6.856
   37    HE   ARG   5           HE       ARG   5  14.937   4.709  -6.905
   38   HH11  ARG   5          HH11      ARG   5  16.542   2.037  -5.269
   39   HH12  ARG   5          HH12      ARG   5  18.093   2.806  -5.442
   40   HH21  ARG   5          HH21      ARG   5  16.775   5.560  -7.068
   41   HH22  ARG   5          HH22      ARG   5  18.257   4.788  -6.477
   42    H    GLU   6           H        GLU   6   9.917   5.598  -2.295
   43    HA   GLU   6           HA       GLU   6   9.540   7.936  -3.775
   44    HB2  GLU   6           HB2      GLU   6   7.848   8.552  -2.171
   45    HB3  GLU   6           HB3      GLU   6   7.778   6.829  -2.531
   46    HG2  GLU   6           HG2      GLU   6   8.979   6.345  -0.392
   47    HG3  GLU   6           HG3      GLU   6   9.001   8.070  -0.024
   48    H    ASP   7           H        ASP   7  11.427   7.694  -0.756
   49    HA   ASP   7           HA       ASP   7  11.813  10.535  -0.428
   50    HB2  ASP   7           HB2      ASP   7  12.140   8.858   1.364
   51    HB3  ASP   7           HB3      ASP   7  13.508   8.176   0.482
   52    H    VAL   8           H        VAL   8  13.520   8.072  -2.298
   53    HA   VAL   8           HA       VAL   8  15.711   9.828  -3.166
   54    HB   VAL   8           HB       VAL   8  14.831   7.195  -4.427
   55   HG11  VAL   8          HG11      VAL   8  17.231   7.105  -5.101
   56   HG12  VAL   8          HG12      VAL   8  16.392   8.488  -5.797
   57   HG13  VAL   8          HG13      VAL   8  17.476   8.720  -4.406
   58   HG21  VAL   8          HG21      VAL   8  16.603   6.119  -3.055
   59   HG22  VAL   8          HG22      VAL   8  16.812   7.635  -2.150
   60   HG23  VAL   8          HG23      VAL   8  15.285   6.728  -2.057
   61    H    ALA   9           H        ALA   9  12.556   8.732  -4.415
   62    HA   ALA   9           HA       ALA   9  12.675   9.854  -6.992
   63    HB1  ALA   9           HB1      ALA   9  10.937   8.274  -6.140
   64    HB2  ALA   9           HB2      ALA   9  10.203   9.624  -5.237
   65    HB3  ALA   9           HB3      ALA   9  10.269   9.675  -7.003
   66    H    ASN  10           H        ASN  10  11.843  11.513  -3.917
   67    HA   ASN  10           HA       ASN  10  11.252  14.057  -5.066
   68    HB2  ASN  10           HB2      ASN  10  10.962  13.474  -2.637
   69    HB3  ASN  10           HB3      ASN  10  12.712  13.498  -2.441
   70   HD21  ASN  10          HD22      ASN  10   9.834  15.489  -2.864
   71   HD22  ASN  10          HD21      ASN  10  10.664  17.008  -2.590
   72    H    THR  11           H        THR  11  14.496  12.979  -3.916
   73    HA   THR  11           HA       THR  11  15.937  15.188  -4.935
   74    HB   THR  11           HB       THR  11  16.910  12.314  -4.664
   75    HG1  THR  11           HG1      THR  11  17.445  12.958  -2.574
   76   HG21  THR  11          HG21      THR  11  19.094  13.388  -4.159
   77   HG22  THR  11          HG22      THR  11  18.556  13.772  -5.798
   78   HG23  THR  11          HG23      THR  11  18.389  14.984  -4.507
   79    H    ARG  12           H        ARG  12  15.238  12.034  -6.490
   80    HA   ARG  12           HA       ARG  12  16.580  12.617  -8.975
   81    HB2  ARG  12           HB2      ARG  12  14.480  10.596  -8.111
   82    HB3  ARG  12           HB3      ARG  12  15.056  10.656  -9.771
   83    HG2  ARG  12           HG2      ARG  12  17.047  10.475  -7.467
   84    HG3  ARG  12           HG3      ARG  12  16.228   9.047  -8.074
   85    HD2  ARG  12           HD2      ARG  12  17.029   9.604 -10.394
   86    HD3  ARG  12           HD3      ARG  12  17.962  10.934  -9.712
   87    HE   ARG  12           HE       ARG  12  19.539   9.429  -8.915
   88   HH11  ARG  12          HH11      ARG  12  16.676   7.424  -9.620
   89   HH12  ARG  12          HH12      ARG  12  17.726   6.022  -9.772
   90   HH21  ARG  12          HH21      ARG  12  20.612   7.400  -8.990
   91   HH22  ARG  12          HH22      ARG  12  19.637   5.983  -9.385
   92    H    ALA  13           H        ALA  13  13.124  13.209  -8.050
   93    HA   ALA  13           HA       ALA  13  12.272  14.126 -10.597
   94    HB1  ALA  13           HB1      ALA  13  10.738  13.677  -8.751
   95    HB2  ALA  13           HB2      ALA  13  11.420  15.033  -7.826
   96    HB3  ALA  13           HB3      ALA  13  10.554  15.330  -9.350
   97    H    ARG  14           H        ARG  14  13.657  15.944  -7.845
   98    HA   ARG  14           HA       ARG  14  13.779  18.518  -9.109
   99    HB2  ARG  14           HB2      ARG  14  15.355  17.280  -6.808
  100    HB3  ARG  14           HB3      ARG  14  15.402  18.998  -7.218
  101    HG2  ARG  14           HG2      ARG  14  13.141  19.353  -6.586
  102    HG3  ARG  14           HG3      ARG  14  12.731  17.642  -6.695
  103    HD2  ARG  14           HD2      ARG  14  12.787  18.275  -4.384
  104    HD3  ARG  14           HD3      ARG  14  14.074  17.116  -4.738
  105    HE   ARG  14           HE       ARG  14  15.037  19.842  -4.889
  106   HH11  ARG  14          HH11      ARG  14  14.199  17.360  -2.540
  107   HH12  ARG  14          HH12      ARG  14  15.332  17.983  -1.368
  108   HH21  ARG  14          HH21      ARG  14  16.448  20.569  -3.323
  109   HH22  ARG  14          HH22      ARG  14  16.547  19.751  -1.795
  110    H    GLU  15           H        GLU  15  16.216  15.953  -8.888
  111    HA   GLU  15           HA       GLU  15  18.295  17.228 -10.408
  112    HB2  GLU  15           HB2      GLU  15  18.503  15.216  -8.905
  113    HB3  GLU  15           HB3      GLU  15  17.595  14.291 -10.092
  114    HG2  GLU  15           HG2      GLU  15  19.836  13.756 -10.433
  115    HG3  GLU  15           HG3      GLU  15  19.359  14.791 -11.780
  116    H    THR  16           H        THR  16  15.761  14.927 -11.492
  117    HA   THR  16           HA       THR  16  16.396  14.927 -14.258
  118    HB   THR  16           HB       THR  16  13.721  14.503 -12.868
  119    HG1  THR  16           HG1      THR  16  15.148  13.074 -12.126
  120   HG21  THR  16          HG21      THR  16  13.498  14.675 -15.409
  121   HG22  THR  16          HG22      THR  16  14.573  13.262 -15.504
  122   HG23  THR  16          HG23      THR  16  13.025  13.127 -14.665
  123    H    ALA  17           H        ALA  17  14.317  17.126 -12.385
  124    HA   ALA  17           HA       ALA  17  13.488  18.744 -14.602
  125    HB1  ALA  17           HB1      ALA  17  12.298  18.664 -12.458
  126    HB2  ALA  17           HB2      ALA  17  13.705  19.348 -11.620
  127    HB3  ALA  17           HB3      ALA  17  12.832  20.329 -12.810
  128    H    ALA  18           H        ALA  18  16.209  19.219 -12.258
  129    HA   ALA  18           HA       ALA  18  17.150  21.659 -13.393
  130    HB1  ALA  18           HB1      ALA  18  19.245  21.103 -12.207
  131    HB2  ALA  18           HB2      ALA  18  17.828  20.793 -11.185
  132    HB3  ALA  18           HB3      ALA  18  18.678  19.437 -11.958
  133    H    ARG  19           H        ARG  19  17.976  18.261 -14.169
  134    HA   ARG  19           HA       ARG  19  19.843  18.890 -16.303
  135    HB2  ARG  19           HB2      ARG  19  18.237  16.377 -15.688
  136    HB3  ARG  19           HB3      ARG  19  19.493  16.510 -16.933
  137    HG2  ARG  19           HG2      ARG  19  21.189  17.052 -15.250
  138    HG3  ARG  19           HG3      ARG  19  19.978  16.944 -13.963
  139    HD2  ARG  19           HD2      ARG  19  19.522  14.568 -14.667
  140    HD3  ARG  19           HD3      ARG  19  20.853  14.712 -15.832
  141    HE   ARG  19           HE       ARG  19  21.412  15.293 -12.957
  142   HH11  ARG  19          HH11      ARG  19  21.902  12.983 -15.553
  143   HH12  ARG  19          HH12      ARG  19  23.085  12.105 -14.619
  144   HH21  ARG  19          HH21      ARG  19  22.777  14.227 -11.898
  145   HH22  ARG  19          HH22      ARG  19  23.610  12.807 -12.540
  146    H    PHE  20           H        PHE  20  16.294  18.171 -16.382
  147    HA   PHE  20           HA       PHE  20  16.043  18.498 -19.198
  148    HB2  PHE  20           HB2      PHE  20  14.192  17.594 -17.942
  149    HB3  PHE  20           HB3      PHE  20  14.081  19.048 -16.954
  150    HD1  PHE  20           HD1      PHE  20  14.267  18.386 -20.692
  151    HD2  PHE  20           HD2      PHE  20  12.197  20.340 -17.442
  152    HE1  PHE  20           HE1      PHE  20  12.735  19.468 -22.297
  153    HE2  PHE  20           HE2      PHE  20  10.671  21.421 -19.073
  154    HZ   PHE  20           HZ       PHE  20  10.961  21.010 -21.513
  155    H    THR  21           H        THR  21  16.008  20.991 -16.613
  156    HA   THR  21           HA       THR  21  15.514  23.222 -18.312
  157    HB   THR  21           HB       THR  21  17.234  23.212 -15.802
  158    HG1  THR  21           HG1      THR  21  15.193  22.333 -15.410
  159   HG21  THR  21          HG21      THR  21  16.313  25.546 -15.568
  160   HG22  THR  21          HG22      THR  21  17.414  25.350 -16.933
  161   HG23  THR  21          HG23      THR  21  15.657  25.414 -17.211
  162    H    ALA  22           H        ALA  22  18.677  21.644 -17.508
  163    HA   ALA  22           HA       ALA  22  20.204  23.333 -19.253
  164    HB1  ALA  22           HB1      ALA  22  20.755  20.473 -18.350
  165    HB2  ALA  22           HB2      ALA  22  21.935  21.613 -19.024
  166    HB3  ALA  22           HB3      ALA  22  21.183  21.947 -17.452
  167    H    ALA  23           H        ALA  23  18.452  20.290 -19.940
  168    HA   ALA  23           HA       ALA  23  19.337  20.066 -22.672
  169    HB1  ALA  23           HB1      ALA  23  17.486  18.483 -22.907
  170    HB2  ALA  23           HB2      ALA  23  18.396  18.192 -21.417
  171    HB3  ALA  23           HB3      ALA  23  16.809  19.003 -21.355
  172    H    LEU  24           H        LEU  24  16.593  21.841 -21.221
  173    HA   LEU  24           HA       LEU  24  15.535  22.789 -23.734
  174    HB2  LEU  24           HB2      LEU  24  14.258  22.662 -21.620
  175    HB3  LEU  24           HB3      LEU  24  15.313  23.864 -20.900
  176    HG   LEU  24           HG       LEU  24  14.521  25.533 -22.622
  177   HD11  LEU  24          HD11      LEU  24  13.793  23.984 -24.397
  178   HD12  LEU  24          HD12      LEU  24  12.537  23.321 -23.328
  179   HD13  LEU  24          HD13      LEU  24  12.452  25.008 -23.878
  180   HD21  LEU  24          HD21      LEU  24  13.485  25.387 -20.369
  181   HD22  LEU  24          HD22      LEU  24  12.305  25.864 -21.603
  182   HD23  LEU  24          HD23      LEU  24  12.321  24.197 -20.984
  183    H    GLU  25           H        GLU  25  18.044  24.041 -21.514
  184    HA   GLU  25           HA       GLU  25  18.602  26.461 -22.949
  185    HB2  GLU  25           HB2      GLU  25  19.496  25.753 -20.642
  186    HB3  GLU  25           HB3      GLU  25  20.691  24.794 -21.506
  187    HG2  GLU  25           HG2      GLU  25  21.454  26.851 -22.700
  188    HG3  GLU  25           HG3      GLU  25  20.267  27.795 -21.798
  189    H    LEU  26           H        LEU  26  20.020  23.168 -23.297
  190    HA   LEU  26           HA       LEU  26  21.632  23.592 -25.586
  191    HB2  LEU  26           HB2      LEU  26  21.794  21.529 -24.421
  192    HB3  LEU  26           HB3      LEU  26  20.067  21.262 -24.494
  193    HG   LEU  26           HG       LEU  26  20.239  20.872 -26.978
  194   HD11  LEU  26          HD11      LEU  26  22.397  22.014 -27.383
  195   HD12  LEU  26          HD12      LEU  26  23.224  20.812 -26.366
  196   HD13  LEU  26          HD13      LEU  26  22.451  20.318 -27.890
  197   HD21  LEU  26          HD21      LEU  26  21.098  18.602 -26.695
  198   HD22  LEU  26          HD22      LEU  26  21.807  19.053 -25.125
  199   HD23  LEU  26          HD23      LEU  26  20.041  19.078 -25.353
  200    H    ALA  27           H        ALA  27  18.172  22.681 -25.482
  201    HA   ALA  27           HA       ALA  27  17.703  22.740 -28.254
  202    HB1  ALA  27           HB1      ALA  27  15.343  23.020 -27.660
  203    HB2  ALA  27           HB2      ALA  27  16.135  21.843 -26.592
  204    HB3  ALA  27           HB3      ALA  27  15.790  23.481 -26.003
  205    H    ILE  28           H        ILE  28  17.535  25.558 -25.993
  206    HA   ILE  28           HA       ILE  28  16.908  27.517 -28.024
  207    HB   ILE  28           HB       ILE  28  18.302  27.785 -25.333
  208   HG12  ILE  28          HG12      ILE  28  15.451  28.579 -26.053
  209   HG13  ILE  28          HG13      ILE  28  15.830  26.957 -25.487
  210   HG21  ILE  28          HG21      ILE  28  18.882  29.738 -26.715
  211   HG22  ILE  28          HG22      ILE  28  17.176  29.960 -27.162
  212   HG23  ILE  28          HG23      ILE  28  17.716  30.212 -25.489
  213   HD11  ILE  28          HD11      ILE  28  16.809  27.923 -23.406
  214   HD12  ILE  28          HD12      ILE  28  16.180  29.510 -23.917
  215   HD13  ILE  28          HD13      ILE  28  15.067  28.150 -23.630
  216    H    ASP  29           H        ASP  29  20.051  26.410 -26.698
  217    HA   ASP  29           HA       ASP  29  21.736  27.955 -28.406
  218    HB2  ASP  29           HB2      ASP  29  22.298  26.694 -26.233
  219    HB3  ASP  29           HB3      ASP  29  22.360  25.233 -27.229
  220    H    ARG  30           H        ARG  30  19.705  25.367 -29.277
  221    HA   ARG  30           HA       ARG  30  21.227  24.949 -31.822
  222    HB2  ARG  30           HB2      ARG  30  19.145  23.225 -30.419
  223    HB3  ARG  30           HB3      ARG  30  19.699  22.914 -32.070
  224    HG2  ARG  30           HG2      ARG  30  21.491  22.981 -29.613
  225    HG3  ARG  30           HG3      ARG  30  20.819  21.518 -30.316
  226    HD2  ARG  30           HD2      ARG  30  22.119  21.726 -32.306
  227    HD3  ARG  30           HD3      ARG  30  22.582  23.388 -31.952
  228    HE   ARG  30           HE       ARG  30  23.864  20.984 -30.921
  229   HH11  ARG  30          HH11      ARG  30  23.400  24.416 -30.172
  230   HH12  ARG  30          HH12      ARG  30  24.642  24.385 -28.969
  231   HH21  ARG  30          HH21      ARG  30  25.477  21.064 -29.637
  232   HH22  ARG  30          HH22      ARG  30  25.921  22.527 -28.746
  233    H    ALA  31           H        ALA  31  18.071  26.030 -30.585
  234    HA   ALA  31           HA       ALA  31  16.852  26.424 -33.144
  235    HB1  ALA  31           HB1      ALA  31  15.350  27.936 -31.930
  236    HB2  ALA  31           HB2      ALA  31  15.658  26.499 -30.947
  237    HB3  ALA  31           HB3      ALA  31  16.485  28.019 -30.562
  238    H    THR  32           H        THR  32  19.182  28.463 -31.404
  239    HA   THR  32           HA       THR  32  19.014  30.673 -33.274
  240    HB   THR  32           HB       THR  32  19.887  30.731 -30.902
  241    HG1  THR  32           HG1      THR  32  21.324  32.353 -31.425
  242   HG21  THR  32          HG21      THR  32  22.493  29.832 -32.200
  243   HG22  THR  32          HG22      THR  32  22.250  30.335 -30.514
  244   HG23  THR  32          HG23      THR  32  21.520  28.831 -31.095
  245    H    LEU  33           H        LEU  33  20.388  27.552 -33.625
  246    HA   LEU  33           HA       LEU  33  22.315  28.418 -35.681
  247    HB2  LEU  33           HB2      LEU  33  22.095  25.871 -34.042
  248    HB3  LEU  33           HB3      LEU  33  23.335  26.178 -35.258
  249    HG   LEU  33           HG       LEU  33  22.975  27.603 -32.604
  250   HD11  LEU  33          HD11      LEU  33  25.218  25.849 -33.684
  251   HD12  LEU  33          HD12      LEU  33  25.137  26.596 -32.071
  252   HD13  LEU  33          HD13      LEU  33  23.975  25.342 -32.521
  253   HD21  LEU  33          HD21      LEU  33  25.106  28.780 -33.153
  254   HD22  LEU  33          HD22      LEU  33  25.037  28.110 -34.799
  255   HD23  LEU  33          HD23      LEU  33  23.798  29.255 -34.240
  256    H    SER  34           H        SER  34  19.556  26.304 -35.142
  257    HA   SER  34           HA       SER  34  19.957  24.588 -37.394
  258    HB2  SER  34           HB2      SER  34  17.494  25.046 -35.667
  259    HB3  SER  34           HB3      SER  34  17.738  23.704 -36.798
  260    HG   SER  34           HG       SER  34  19.251  24.312 -34.485
  261    H    GLY  35           H        GLY  35  18.306  27.674 -37.270
  262    HA2  GLY  35           HA2      GLY  35  17.428  28.905 -39.053
  263    HA3  GLY  35           HA3      GLY  35  17.704  27.542 -40.136
  264    H    GLN  36           H        GLN  36  16.013  26.193 -37.725
  265    HA   GLN  36           HA       GLN  36  13.269  27.111 -38.318
  266    HB2  GLN  36           HB2      GLN  36  13.676  25.033 -39.712
  267    HB3  GLN  36           HB3      GLN  36  14.187  24.205 -38.242
  268    HG2  GLN  36           HG2      GLN  36  11.820  24.645 -37.321
  269    HG3  GLN  36           HG3      GLN  36  11.386  25.094 -38.969
  270   HE21  GLN  36          HE22      GLN  36  12.354  22.477 -36.746
  271   HE22  GLN  36          HE21      GLN  36  11.928  21.176 -37.875
  272    HA   PRO  37           HA       PRO  37  13.087  26.834 -33.767
  273    HB2  PRO  37           HB2      PRO  37  10.451  25.497 -34.480
  274    HB3  PRO  37           HB3      PRO  37  10.795  26.615 -33.124
  275    HG2  PRO  37           HG2      PRO  37   9.674  27.607 -35.359
  276    HG3  PRO  37           HG3      PRO  37  11.086  28.465 -34.651
  277    HD2  PRO  37           HD2      PRO  37  11.028  26.631 -37.020
  278    HD3  PRO  37           HD3      PRO  37  11.925  28.156 -36.785
  279    H    VAL  38           H        VAL  38  13.231  25.260 -32.137
  280    HA   VAL  38           HA       VAL  38  13.900  22.468 -33.061
  281    HB   VAL  38           HB       VAL  38  15.234  24.280 -31.031
  282   HG11  VAL  38          HG11      VAL  38  16.849  22.517 -30.546
  283   HG12  VAL  38          HG12      VAL  38  15.251  22.056 -29.982
  284   HG13  VAL  38          HG13      VAL  38  15.907  21.351 -31.480
  285   HG21  VAL  38          HG21      VAL  38  15.897  24.564 -33.400
  286   HG22  VAL  38          HG22      VAL  38  17.215  23.751 -32.534
  287   HG23  VAL  38          HG23      VAL  38  16.121  22.835 -33.582
  288    H    GLY  39           H        GLY  39  13.560  20.756 -31.348
  289    HA2  GLY  39           HA2      GLY  39  11.547  21.546 -29.316
  290    HA3  GLY  39           HA3      GLY  39  11.013  20.469 -30.596
  291    H    ILE  40           H        ILE  40  10.629  19.679 -28.182
  292    HA   ILE  40           HA       ILE  40  12.606  17.500 -27.698
  293    HB   ILE  40           HB       ILE  40  11.343  19.155 -25.483
  294   HG12  ILE  40          HG12      ILE  40  14.228  19.094 -26.485
  295   HG13  ILE  40          HG13      ILE  40  13.104  20.437 -26.660
  296   HG21  ILE  40          HG21      ILE  40  13.320  16.824 -25.442
  297   HG22  ILE  40          HG22      ILE  40  12.813  17.755 -24.018
  298   HG23  ILE  40          HG23      ILE  40  11.641  16.786 -24.882
  299   HD11  ILE  40          HD11      ILE  40  14.284  19.455 -24.055
  300   HD12  ILE  40          HD12      ILE  40  14.572  20.986 -24.886
  301   HD13  ILE  40          HD13      ILE  40  12.971  20.662 -24.191
  302    H    HIS  41           H        HIS  41  11.636  15.695 -28.037
  303    HA   HIS  41           HA       HIS  41   8.758  15.249 -27.748
  304    HB2  HIS  41           HB2      HIS  41   9.593  14.032 -29.548
  305    HB3  HIS  41           HB3      HIS  41  11.124  13.718 -28.774
  306    HD1  HIS  41           HD1      HIS  41  11.241  11.519 -27.196
  307    HD2  HIS  41           HD2      HIS  41   7.486  12.402 -28.871
  308    HE1  HIS  41           HE1      HIS  41   9.779   9.479 -26.773
  309    H    PHE  42           H        PHE  42   7.862  13.888 -26.266
  310    HA   PHE  42           HA       PHE  42   9.470  12.964 -23.921
  311    HB2  PHE  42           HB2      PHE  42   7.093  14.837 -23.938
  312    HB3  PHE  42           HB3      PHE  42   7.299  13.706 -22.617
  313    HD1  PHE  42           HD1      PHE  42   9.186  13.774 -21.094
  314    HD2  PHE  42           HD2      PHE  42   8.665  16.772 -24.153
  315    HE1  PHE  42           HE1      PHE  42  10.720  15.293 -19.865
  316    HE2  PHE  42           HE2      PHE  42  10.231  18.280 -22.934
  317    HZ   PHE  42           HZ       PHE  42  11.218  17.539 -20.767
  318    H    SER  43           H        SER  43   8.939  11.085 -23.106
  319    HA   SER  43           HA       SER  43   6.387   9.720 -23.837
  320    HB2  SER  43           HB2      SER  43   7.467   7.634 -23.744
  321    HB3  SER  43           HB3      SER  43   8.505   8.659 -24.746
  322    HG   SER  43           HG       SER  43   9.691   7.483 -23.185
  323    H    ASP  44           H        ASP  44   6.188   7.831 -21.925
  324    HA   ASP  44           HA       ASP  44   5.683   9.244 -19.468
  325    HB2  ASP  44           HB2      ASP  44   4.982   7.099 -18.625
  326    HB3  ASP  44           HB3      ASP  44   4.343   7.341 -20.243
  327    H    SER  45           H        SER  45   8.652   8.032 -20.678
  328    HA   SER  45           HA       SER  45   9.871   8.109 -17.956
  329    HB2  SER  45           HB2      SER  45  10.995   5.978 -18.333
  330    HB3  SER  45           HB3      SER  45   9.236   5.787 -18.392
  331    HG   SER  45           HG       SER  45  10.287   4.692 -20.114
  332    H    ALA  46           H        ALA  46  10.308   8.933 -21.304
  333    HA   ALA  46           HA       ALA  46  13.087   9.811 -20.709
  334    HB1  ALA  46           HB1      ALA  46  13.273   7.603 -21.819
  335    HB2  ALA  46           HB2      ALA  46  12.258   8.183 -23.159
  336    HB3  ALA  46           HB3      ALA  46  13.862   8.879 -22.889
  337    H    TRP  47           H        TRP  47  13.950  11.187 -22.453
  338    HA   TRP  47           HA       TRP  47  11.912  12.823 -23.902
  339    HB2  TRP  47           HB2      TRP  47  13.411  14.775 -23.564
  340    HB3  TRP  47           HB3      TRP  47  12.701  14.171 -22.080
  341    HD1  TRP  47           HD1      TRP  47  14.256  13.690 -20.154
  342    HE1  TRP  47           HE1      TRP  47  16.787  13.676 -19.755
  343    HE3  TRP  47           HE3      TRP  47  15.905  14.156 -25.003
  344    HZ2  TRP  47           HZ2      TRP  47  19.192  13.568 -21.327
  345    HZ3  TRP  47           HZ3      TRP  47  18.329  13.985 -25.507
  346    HH2  TRP  47           HH2      TRP  47  19.976  13.715 -23.689
  347    H    ARG  48           H        ARG  48  12.757  13.824 -25.863
  348    HA   ARG  48           HA       ARG  48  15.353  12.872 -26.955
  349    HB2  ARG  48           HB2      ARG  48  13.774  11.129 -27.664
  350    HB3  ARG  48           HB3      ARG  48  12.648  12.339 -28.230
  351    HG2  ARG  48           HG2      ARG  48  14.225  13.004 -30.043
  352    HG3  ARG  48           HG3      ARG  48  15.359  11.777 -29.478
  353    HD2  ARG  48           HD2      ARG  48  14.139  10.792 -31.293
  354    HD3  ARG  48           HD3      ARG  48  13.537  10.047 -29.815
  355    HE   ARG  48           HE       ARG  48  12.081  12.389 -30.984
  356   HH11  ARG  48          HH11      ARG  48  11.998   8.915 -30.454
  357   HH12  ARG  48          HH12      ARG  48  10.288   8.827 -30.835
  358   HH21  ARG  48          HH21      ARG  48   9.912  12.166 -31.419
  359   HH22  ARG  48          HH22      ARG  48   9.164  10.584 -31.316
  360    H    ILE  49           H        ILE  49  16.378  14.523 -27.833
  361    HA   ILE  49           HA       ILE  49  14.936  17.069 -28.309
  362    HB   ILE  49           HB       ILE  49  17.873  16.579 -28.836
  363   HG12  ILE  49          HG12      ILE  49  17.534  15.762 -26.572
  364   HG13  ILE  49          HG13      ILE  49  18.487  17.233 -26.605
  365   HG21  ILE  49          HG21      ILE  49  17.008  18.702 -29.655
  366   HG22  ILE  49          HG22      ILE  49  16.209  19.039 -28.111
  367   HG23  ILE  49          HG23      ILE  49  17.977  19.031 -28.211
  368   HD11  ILE  49          HD11      ILE  49  16.578  18.551 -25.798
  369   HD12  ILE  49          HD12      ILE  49  15.530  17.112 -25.884
  370   HD13  ILE  49          HD13      ILE  49  16.867  17.165 -24.730
  371    H    MET  50           H        MET  50  14.571  17.958 -30.330
  372    HA   MET  50           HA       MET  50  15.318  16.356 -32.730
  373    HB2  MET  50           HB2      MET  50  12.504  17.223 -31.946
  374    HB3  MET  50           HB3      MET  50  12.959  16.524 -33.510
  375    HG2  MET  50           HG2      MET  50  13.777  14.483 -32.358
  376    HG3  MET  50           HG3      MET  50  13.309  15.171 -30.811
  377    HE1  MET  50           HE1      MET  50  11.418  14.835 -34.328
  378    HE2  MET  50           HE2      MET  50  12.169  13.265 -33.971
  379    HE3  MET  50           HE3      MET  50  10.399  13.437 -33.952
  380    H    VAL  51           H        VAL  51  15.425  17.394 -34.616
  381    HA   VAL  51           HA       VAL  51  15.413  20.379 -34.720
  382    HB   VAL  51           HB       VAL  51  17.731  20.110 -35.812
  383   HG11  VAL  51          HG11      VAL  51  18.892  20.252 -33.742
  384   HG12  VAL  51          HG12      VAL  51  17.320  21.008 -33.522
  385   HG13  VAL  51          HG13      VAL  51  17.596  19.386 -32.869
  386   HG21  VAL  51          HG21      VAL  51  17.687  17.659 -36.172
  387   HG22  VAL  51          HG22      VAL  51  19.100  18.217 -35.263
  388   HG23  VAL  51          HG23      VAL  51  17.765  17.416 -34.415
  389    HA   PRO  52           HA       PRO  52  14.131  19.825 -38.976
  390    HB2  PRO  52           HB2      PRO  52  15.733  21.552 -40.445
  391    HB3  PRO  52           HB3      PRO  52  14.352  22.059 -39.438
  392    HG2  PRO  52           HG2      PRO  52  17.286  21.943 -38.654
  393    HG3  PRO  52           HG3      PRO  52  16.167  23.326 -38.480
  394    HD2  PRO  52           HD2      PRO  52  16.609  21.747 -36.382
  395    HD3  PRO  52           HD3      PRO  52  14.927  22.192 -36.755
  396    H    GLY  53           H        GLY  53  14.806  19.227 -41.143
  397    HA2  GLY  53           HA2      GLY  53  17.492  18.295 -41.717
  398    HA3  GLY  53           HA3      GLY  53  16.298  16.986 -41.640
  399    H    LYS  54           H        LYS  54  17.566  17.516 -44.000
  400    HA   LYS  54           HA       LYS  54  17.467  18.025 -46.191
  401    HB2  LYS  54           HB2      LYS  54  15.441  16.697 -46.203
  402    HB3  LYS  54           HB3      LYS  54  14.464  18.095 -45.739
  403    HG2  LYS  54           HG2      LYS  54  15.064  19.240 -47.854
  404    HG3  LYS  54           HG3      LYS  54  16.040  17.839 -48.336
  405    HD2  LYS  54           HD2      LYS  54  14.037  16.441 -48.430
  406    HD3  LYS  54           HD3      LYS  54  13.045  17.750 -47.740
  407    HE2  LYS  54           HE2      LYS  54  13.580  19.198 -49.675
  408    HE3  LYS  54           HE3      LYS  54  14.575  17.918 -50.375
  409    HZ1  LYS  54           HZ1      LYS  54  12.347  17.925 -51.347
  410    HZ2  LYS  54           HZ2      LYS  54  12.567  16.532 -50.536
  411    HZ3  LYS  54           HZ3      LYS  54  11.645  17.716 -49.894
  412    H    THR  55           H        THR  55  15.267  20.300 -44.566
  413    HA   THR  55           HA       THR  55  16.596  22.599 -45.862
  414    HB   THR  55           HB       THR  55  15.006  21.985 -47.537
  415    HG1  THR  55           HG1      THR  55  13.972  23.888 -47.659
  416   HG21  THR  55          HG21      THR  55  12.596  21.914 -47.213
  417   HG22  THR  55          HG22      THR  55  13.346  20.681 -46.190
  418   HG23  THR  55          HG23      THR  55  12.770  22.201 -45.473
  419    HA   PRO  56           HA       PRO  56  15.032  24.503 -42.027
  420    HB2  PRO  56           HB2      PRO  56  15.957  27.027 -42.354
  421    HB3  PRO  56           HB3      PRO  56  17.074  25.656 -42.075
  422    HG2  PRO  56           HG2      PRO  56  16.315  26.939 -44.723
  423    HG3  PRO  56           HG3      PRO  56  17.955  26.556 -44.110
  424    HD2  PRO  56           HD2      PRO  56  16.545  24.896 -45.808
  425    HD3  PRO  56           HD3      PRO  56  17.705  24.277 -44.599
  426    H    SER  57           H        SER  57  14.153  25.316 -45.312
  427    HA   SER  57           HA       SER  57  12.425  27.559 -44.712
  428    HB2  SER  57           HB2      SER  57  12.735  25.924 -47.257
  429    HB3  SER  57           HB3      SER  57  11.970  27.515 -47.125
  430    HG   SER  57           HG       SER  57  13.962  28.388 -46.508
  431    H    ALA  58           H        ALA  58  11.786  24.264 -44.322
  432    HA   ALA  58           HA       ALA  58   8.877  24.757 -44.232
  433    HB1  ALA  58           HB1      ALA  58   8.398  22.720 -45.557
  434    HB2  ALA  58           HB2      ALA  58   9.279  23.914 -46.528
  435    HB3  ALA  58           HB3      ALA  58  10.133  22.501 -45.867
  436    H    TRP  59           H        TRP  59   7.758  23.332 -42.894
  437    HA   TRP  59           HA       TRP  59   8.981  22.471 -40.513
  438    HB2  TRP  59           HB2      TRP  59   6.667  23.068 -40.616
  439    HB3  TRP  59           HB3      TRP  59   6.325  21.833 -41.816
  440    HD1  TRP  59           HD1      TRP  59   6.006  19.357 -41.025
  441    HE1  TRP  59           HE1      TRP  59   5.292  18.338 -38.785
  442    HE3  TRP  59           HE3      TRP  59   7.114  23.305 -37.943
  443    HZ2  TRP  59           HZ2      TRP  59   5.086  19.169 -36.032
  444    HZ3  TRP  59           HZ3      TRP  59   6.649  23.152 -35.507
  445    HH2  TRP  59           HH2      TRP  59   5.623  21.106 -34.544
  446    H    ARG  60           H        ARG  60  10.408  20.920 -40.245
  447    HA   ARG  60           HA       ARG  60   9.754  18.138 -40.977
  448    HB2  ARG  60           HB2      ARG  60  11.034  19.116 -42.909
  449    HB3  ARG  60           HB3      ARG  60  12.348  19.527 -41.826
  450    HG2  ARG  60           HG2      ARG  60  12.776  17.546 -43.215
  451    HG3  ARG  60           HG3      ARG  60  12.899  17.170 -41.498
  452    HD2  ARG  60           HD2      ARG  60  10.846  15.916 -41.538
  453    HD3  ARG  60           HD3      ARG  60  10.335  16.677 -43.044
  454    HE   ARG  60           HE       ARG  60  11.627  15.239 -44.289
  455   HH11  ARG  60          HH11      ARG  60  12.469  14.503 -40.894
  456   HH12  ARG  60          HH12      ARG  60  13.285  13.069 -41.406
  457   HH21  ARG  60          HH21      ARG  60  12.716  13.412 -44.740
  458   HH22  ARG  60          HH22      ARG  60  13.442  12.483 -43.469
  459    H    TRP  61           H        TRP  61  10.912  16.603 -39.712
  460    HA   TRP  61           HA       TRP  61  12.575  17.655 -37.484
  461    HB2  TRP  61           HB2      TRP  61  10.164  15.825 -37.237
  462    HB3  TRP  61           HB3      TRP  61  11.343  16.126 -35.966
  463    HD1  TRP  61           HD1      TRP  61   8.106  17.331 -37.059
  464    HE1  TRP  61           HE1      TRP  61   7.527  19.621 -36.030
  465    HE3  TRP  61           HE3      TRP  61  12.720  18.607 -35.272
  466    HZ2  TRP  61           HZ2      TRP  61   8.867  21.672 -34.505
  467    HZ3  TRP  61           HZ3      TRP  61  13.044  20.731 -34.039
  468    HH2  TRP  61           HH2      TRP  61  11.135  22.257 -33.628
  469    H    VAL  62           H        VAL  62  14.060  16.376 -36.672
  470    HA   VAL  62           HA       VAL  62  14.503  13.540 -37.394
  471    HB   VAL  62           HB       VAL  62  16.646  15.720 -37.623
  472   HG11  VAL  62          HG11      VAL  62  17.551  13.470 -37.111
  473   HG12  VAL  62          HG12      VAL  62  16.689  12.804 -38.518
  474   HG13  VAL  62          HG13      VAL  62  17.997  13.985 -38.728
  475   HG21  VAL  62          HG21      VAL  62  15.179  14.341 -39.904
  476   HG22  VAL  62          HG22      VAL  62  15.174  16.082 -39.520
  477   HG23  VAL  62          HG23      VAL  62  16.657  15.312 -40.074
  478    HA   PRO  63           HA       PRO  63  15.762  13.937 -32.978
  479    HB2  PRO  63           HB2      PRO  63  17.380  11.732 -32.678
  480    HB3  PRO  63           HB3      PRO  63  15.594  11.663 -32.704
  481    HG2  PRO  63           HG2      PRO  63  17.500  11.165 -35.008
  482    HG3  PRO  63           HG3      PRO  63  16.119  10.151 -34.475
  483    HD2  PRO  63           HD2      PRO  63  15.858  11.890 -36.525
  484    HD3  PRO  63           HD3      PRO  63  14.539  11.697 -35.339
  485    H    LEU  64           H        LEU  64  17.626  14.659 -31.831
  486    HA   LEU  64           HA       LEU  64  19.430  16.119 -33.403
  487    HB2  LEU  64           HB2      LEU  64  18.540  16.792 -31.235
  488    HB3  LEU  64           HB3      LEU  64  19.513  15.574 -30.414
  489    HG   LEU  64           HG       LEU  64  21.549  16.806 -30.817
  490   HD11  LEU  64          HD11      LEU  64  21.278  17.544 -33.129
  491   HD12  LEU  64          HD12      LEU  64  19.904  18.569 -32.668
  492   HD13  LEU  64          HD13      LEU  64  21.542  18.964 -32.113
  493   HD21  LEU  64          HD21      LEU  64  19.419  18.859 -30.195
  494   HD22  LEU  64          HD22      LEU  64  20.090  17.684 -29.030
  495   HD23  LEU  64          HD23      LEU  64  21.136  18.913 -29.753
  496    H    GLN  65           H        GLN  65  19.854  13.167 -33.869
  497    HA   GLN  65           HA       GLN  65  22.427  12.413 -32.794
  498    HB2  GLN  65           HB2      GLN  65  20.896  11.372 -35.208
  499    HB3  GLN  65           HB3      GLN  65  22.392  10.665 -34.568
  500    HG2  GLN  65           HG2      GLN  65  21.252  10.438 -32.321
  501    HG3  GLN  65           HG3      GLN  65  19.739  10.918 -33.098
  502   HE21  GLN  65          HE22      GLN  65  22.159   8.352 -32.793
  503   HE22  GLN  65          HE21      GLN  65  21.159   7.120 -33.564
  504    H    GLU  66           H        GLU  66  21.680  14.765 -35.138
  505    HA   GLU  66           HA       GLU  66  24.134  14.757 -36.663
  506    HB2  GLU  66           HB2      GLU  66  22.242  17.021 -35.894
  507    HB3  GLU  66           HB3      GLU  66  23.522  17.144 -37.098
  508    HG2  GLU  66           HG2      GLU  66  21.101  15.295 -37.274
  509    HG3  GLU  66           HG3      GLU  66  21.290  16.828 -38.106
  510    H    ASP  67           H        ASP  67  23.451  15.688 -33.357
  511    HA   ASP  67           HA       ASP  67  26.264  16.578 -33.005
  512    HB2  ASP  67           HB2      ASP  67  24.809  18.576 -33.486
  513    HB3  ASP  67           HB3      ASP  67  23.803  18.142 -32.108
  514    H    ALA  68           H        ALA  68  23.560  14.948 -31.719
  515    HA   ALA  68           HA       ALA  68  25.094  14.161 -29.286
  516    HB1  ALA  68           HB1      ALA  68  22.915  13.961 -28.141
  517    HB2  ALA  68           HB2      ALA  68  23.175  15.621 -28.705
  518    HB3  ALA  68           HB3      ALA  68  22.079  14.544 -29.597
  519    H    ALA  69           H        ALA  69  25.789  12.903 -31.381
  520    HA   ALA  69           HA       ALA  69  24.448  11.259 -32.931
  521    HB1  ALA  69           HB1      ALA  69  26.515   9.965 -33.216
  522    HB2  ALA  69           HB2      ALA  69  26.834  11.703 -33.078
  523    HB3  ALA  69           HB3      ALA  69  27.142  10.628 -31.692
  524    H    ASP  70           H        ASP  70  25.306  10.197 -29.665
  525    HA   ASP  70           HA       ASP  70  23.452   7.866 -29.933
  526    HB2  ASP  70           HB2      ASP  70  25.886   7.245 -30.124
  527    HB3  ASP  70           HB3      ASP  70  26.134   7.875 -28.497
  528    H    GLU  71           H        GLU  71  23.280  10.663 -28.756
  529    HA   GLU  71           HA       GLU  71  22.414  10.003 -25.963
  530    HB2  GLU  71           HB2      GLU  71  24.185  12.327 -26.831
  531    HB3  GLU  71           HB3      GLU  71  23.491  12.118 -25.221
  532    HG2  GLU  71           HG2      GLU  71  24.729   9.963 -24.983
  533    HG3  GLU  71           HG3      GLU  71  25.508  10.259 -26.541
  534    H    SER  72           H        SER  72  21.397  11.181 -28.895
  535    HA   SER  72           HA       SER  72  20.003  13.551 -28.347
  536    HB2  SER  72           HB2      SER  72  18.687  12.948 -30.373
  537    HB3  SER  72           HB3      SER  72  20.437  12.764 -30.582
  538    HG   SER  72           HG       SER  72  18.502  10.712 -30.203
  539    H    GLN  73           H        GLN  73  19.185  10.412 -27.187
  540    HA   GLN  73           HA       GLN  73  16.785  11.554 -25.952
  541    HB2  GLN  73           HB2      GLN  73  15.334   9.765 -26.459
  542    HB3  GLN  73           HB3      GLN  73  16.050  10.242 -27.986
  543    HG2  GLN  73           HG2      GLN  73  16.715   7.768 -26.350
  544    HG3  GLN  73           HG3      GLN  73  15.760   7.836 -27.819
  545   HE21  GLN  73          HE22      GLN  73  18.990   8.000 -26.500
  546   HE22  GLN  73          HE21      GLN  73  19.819   7.710 -28.042
  547    H    ASN  74           H        ASN  74  16.455  10.895 -23.804
  548    HA   ASN  74           HA       ASN  74  17.874   8.617 -22.719
  549    HB2  ASN  74           HB2      ASN  74  19.587  10.696 -23.051
  550    HB3  ASN  74           HB3      ASN  74  18.889  11.187 -21.516
  551   HD21  ASN  74          HD22      ASN  74  21.552  10.716 -21.593
  552   HD22  ASN  74          HD21      ASN  74  21.903   9.203 -20.779
  553    H    ASP  75           H        ASP  75  17.995   8.855 -20.220
  554    HA   ASP  75           HA       ASP  75  15.741  10.247 -18.945
  555    HB2  ASP  75           HB2      ASP  75  14.924   8.236 -17.861
  556    HB3  ASP  75           HB3      ASP  75  14.816   8.065 -19.610
  557    H    TRP  76           H        TRP  76  15.936  10.028 -16.507
  558    HA   TRP  76           HA       TRP  76  18.793   9.936 -15.615
  559    HB2  TRP  76           HB2      TRP  76  16.776  12.196 -15.376
  560    HB3  TRP  76           HB3      TRP  76  18.287  12.153 -14.482
  561    HD1  TRP  76           HD1      TRP  76  20.365  11.347 -16.612
  562    HE1  TRP  76           HE1      TRP  76  21.025  12.959 -18.498
  563    HE3  TRP  76           HE3      TRP  76  16.132  14.224 -16.739
  564    HZ2  TRP  76           HZ2      TRP  76  19.920  15.296 -19.784
  565    HZ3  TRP  76           HZ3      TRP  76  15.946  16.102 -18.327
  566    HH2  TRP  76           HH2      TRP  76  17.838  16.673 -19.832
  567    H    ASP  77           H        ASP  77  16.265   8.250 -15.025
  568    HA   ASP  77           HA       ASP  77  16.481   8.261 -12.066
  569    HB2  ASP  77           HB2      ASP  77  14.197   8.653 -11.712
  570    HB3  ASP  77           HB3      ASP  77  14.640   9.881 -12.883
  571    H    GLU  78           H        GLU  78  15.130   6.519 -11.090
  572    HA   GLU  78           HA       GLU  78  14.426   4.243 -12.839
  573    HB2  GLU  78           HB2      GLU  78  15.613   2.593 -11.594
  574    HB3  GLU  78           HB3      GLU  78  16.757   3.847 -12.051
  575    HG2  GLU  78           HG2      GLU  78  16.115   4.796  -9.618
  576    HG3  GLU  78           HG3      GLU  78  15.699   3.116  -9.325
  577    H    GLU  79           H        GLU  79  13.219   6.428 -11.045
  578    HA   GLU  79           HA       GLU  79  11.155   4.793  -9.713
  579    HB2  GLU  79           HB2      GLU  79  11.438   5.852  -7.557
  580    HB3  GLU  79           HB3      GLU  79  12.890   4.985  -8.002
  581    HG2  GLU  79           HG2      GLU  79  12.626   7.991  -8.456
  582    HG3  GLU  79           HG3      GLU  79  13.111   7.305  -6.906
  583    H    LEU  80           H        LEU  80  11.498   7.164 -11.879
  584    HA   LEU  80           HA       LEU  80   9.178   8.740 -10.838
  585    HB2  LEU  80           HB2      LEU  80  11.038   9.474 -13.116
  586    HB3  LEU  80           HB3      LEU  80   9.732  10.440 -12.472
  587    HG   LEU  80           HG       LEU  80  12.367   9.859 -11.078
  588   HD11  LEU  80          HD11      LEU  80  12.795  12.167 -11.425
  589   HD12  LEU  80          HD12      LEU  80  12.386  11.446 -12.974
  590   HD13  LEU  80          HD13      LEU  80  11.176  12.435 -12.125
  591   HD21  LEU  80          HD21      LEU  80  10.559   9.973  -9.400
  592   HD22  LEU  80          HD22      LEU  80  11.576  11.415  -9.350
  593   HD23  LEU  80          HD23      LEU  80   9.975  11.490 -10.122
  594    H    SER  81           H        SER  81   7.537   9.260 -12.240
  595    HA   SER  81           HA       SER  81   7.300   7.970 -14.927
  596    HB2  SER  81           HB2      SER  81   5.157   8.194 -12.768
  597    HB3  SER  81           HB3      SER  81   4.844   7.782 -14.467
  598    HG   SER  81           HG       SER  81   5.041   5.902 -13.243
  599    H    ILE  82           H        ILE  82   6.965   9.507 -16.455
  600    HA   ILE  82           HA       ILE  82   6.480  12.302 -15.579
  601    HB   ILE  82           HB       ILE  82   7.961  10.973 -17.825
  602   HG12  ILE  82          HG12      ILE  82   9.518  12.885 -17.449
  603   HG13  ILE  82          HG13      ILE  82   8.435  13.525 -16.216
  604   HG21  ILE  82          HG21      ILE  82   7.996  13.041 -19.172
  605   HG22  ILE  82          HG22      ILE  82   6.412  12.284 -19.147
  606   HG23  ILE  82          HG23      ILE  82   6.714  13.726 -18.150
  607   HD11  ILE  82          HD11      ILE  82   8.905  11.608 -14.765
  608   HD12  ILE  82          HD12      ILE  82   9.862  10.832 -16.058
  609   HD13  ILE  82          HD13      ILE  82  10.426  12.337 -15.310
  610    H    HIS  83           H        HIS  83   4.873  13.521 -16.318
  611    HA   HIS  83           HA       HIS  83   2.916  12.514 -18.320
  612    HB2  HIS  83           HB2      HIS  83   2.170  13.675 -15.602
  613    HB3  HIS  83           HB3      HIS  83   1.048  13.195 -16.869
  614    HD1  HIS  83           HD1      HIS  83   0.581  10.529 -17.087
  615    HD2  HIS  83           HD2      HIS  83   3.349  11.704 -14.143
  616    HE1  HIS  83           HE1      HIS  83   1.003   8.475 -15.640
  617    H    LEU  84           H        LEU  84   1.667  14.317 -19.301
  618    HA   LEU  84           HA       LEU  84   2.776  17.049 -18.866
  619    HB2  LEU  84           HB2      LEU  84   2.755  15.563 -21.537
  620    HB3  LEU  84           HB3      LEU  84   2.895  17.299 -21.374
  621    HG   LEU  84           HG       LEU  84   4.969  16.714 -19.810
  622   HD11  LEU  84          HD11      LEU  84   4.907  14.376 -21.778
  623   HD12  LEU  84          HD12      LEU  84   6.258  14.827 -20.713
  624   HD13  LEU  84          HD13      LEU  84   4.758  14.227 -20.018
  625   HD21  LEU  84          HD21      LEU  84   5.039  18.068 -21.869
  626   HD22  LEU  84          HD22      LEU  84   6.412  16.961 -21.790
  627   HD23  LEU  84          HD23      LEU  84   5.037  16.590 -22.856
  628    H    GLN  85           H        GLN  85   1.597  18.745 -19.865
  629    HA   GLN  85           HA       GLN  85  -0.890  18.259 -21.260
  630    HB2  GLN  85           HB2      GLN  85  -2.374  19.515 -19.769
  631    HB3  GLN  85           HB3      GLN  85  -1.769  18.051 -19.031
  632    HG2  GLN  85           HG2      GLN  85  -1.457  19.350 -17.232
  633    HG3  GLN  85           HG3      GLN  85   0.056  19.786 -18.002
  634   HE21  GLN  85          HE22      GLN  85  -0.009  21.910 -19.327
  635   HE22  GLN  85          HE21      GLN  85  -1.103  23.154 -18.738
  636    HA   PRO  86           HA       PRO  86  -2.527  19.610 -22.300
  637    HB2  PRO  86           HB2      PRO  86  -2.854  20.807 -24.713
  638    HB3  PRO  86           HB3      PRO  86  -3.196  21.657 -23.176
  639    HG2  PRO  86           HG2      PRO  86  -0.660  21.793 -24.846
  640    HG3  PRO  86           HG3      PRO  86  -1.636  23.157 -24.208
  641    HD2  PRO  86           HD2      PRO  86   0.578  22.218 -22.909
  642    HD3  PRO  86           HD3      PRO  86  -0.849  22.817 -22.015
  643    H    PHE  87           H        PHE  87   0.679  19.570 -23.552
  644    HA   PHE  87           HA       PHE  87   0.454  17.685 -25.688
  645    HB2  PHE  87           HB2      PHE  87   2.734  18.267 -23.752
  646    HB3  PHE  87           HB3      PHE  87   2.882  17.424 -25.281
  647    HD1  PHE  87           HD2      PHE  87   1.261  19.096 -27.147
  648    HD2  PHE  87           HD1      PHE  87   4.048  20.214 -24.039
  649    HE1  PHE  87           HE2      PHE  87   1.691  21.245 -28.297
  650    HE2  PHE  87           HE1      PHE  87   4.498  22.349 -25.225
  651    HZ   PHE  87           HZ       PHE  87   3.304  22.873 -27.343
  652    H    LYS  88           H        LYS  88   1.722  15.564 -25.487
  653    HA   LYS  88           HA       LYS  88   0.435  13.904 -23.345
  654    HB2  LYS  88           HB2      LYS  88   0.720  13.358 -26.329
  655    HB3  LYS  88           HB3      LYS  88   0.064  12.220 -25.148
  656    HG2  LYS  88           HG2      LYS  88  -1.841  13.663 -24.696
  657    HG3  LYS  88           HG3      LYS  88  -1.150  14.977 -25.652
  658    HD2  LYS  88           HD2      LYS  88  -2.865  13.949 -26.950
  659    HD3  LYS  88           HD3      LYS  88  -1.300  13.620 -27.704
  660    HE2  LYS  88           HE2      LYS  88  -1.295  11.339 -26.707
  661    HE3  LYS  88           HE3      LYS  88  -2.827  11.683 -25.893
  662    HZ1  LYS  88           HZ1      LYS  88  -3.864  11.923 -28.089
  663    HZ2  LYS  88           HZ2      LYS  88  -2.451  11.611 -28.844
  664    HZ3  LYS  88           HZ3      LYS  88  -3.178  10.453 -27.960
  665    HA   PRO  89           HA       PRO  89   4.611  12.167 -23.035
  666    HB2  PRO  89           HB2      PRO  89   4.222  10.316 -21.091
  667    HB3  PRO  89           HB3      PRO  89   4.031  12.055 -20.768
  668    HG2  PRO  89           HG2      PRO  89   1.847  10.053 -21.444
  669    HG3  PRO  89           HG3      PRO  89   1.906  11.188 -20.059
  670    HD2  PRO  89           HD2      PRO  89   0.594  11.773 -22.391
  671    HD3  PRO  89           HD3      PRO  89   1.422  13.033 -21.428
  672    H    ASP  90           H        ASP  90   3.911  11.472 -25.419
  673    HA   ASP  90           HA       ASP  90   4.212   8.559 -25.726
  674    HB2  ASP  90           HB2      ASP  90   1.763   8.854 -25.424
  675    HB3  ASP  90           HB3      ASP  90   1.742  10.036 -26.733
  676    H    ASP  91           H        ASP  91   4.948   7.933 -27.813
  677    HA   ASP  91           HA       ASP  91   6.277  10.083 -29.231
  678    HB2  ASP  91           HB2      ASP  91   7.334   7.881 -28.711
  679    HB3  ASP  91           HB3      ASP  91   6.332   7.151 -29.967
  680    H    SER  92           H        SER  92   4.555  11.275 -29.956
  681    HA   SER  92           HA       SER  92   2.822  10.552 -32.129
  682    HB2  SER  92           HB2      SER  92   2.551  13.042 -32.259
  683    HB3  SER  92           HB3      SER  92   2.340  12.388 -30.626
  684    HG   SER  92           HG       SER  92   3.696  14.173 -30.528
  685    H    ASN  93           H        ASN  93   6.059  10.353 -32.343
  686    HA   ASN  93           HA       ASN  93   7.648  10.519 -33.874
  687    HB2  ASN  93           HB2      ASN  93   5.442  10.724 -35.955
  688    HB3  ASN  93           HB3      ASN  93   7.108  10.232 -36.228
  689   HD21  ASN  93          HD22      ASN  93   7.847   8.245 -34.877
  690   HD22  ASN  93          HD21      ASN  93   6.645   6.981 -34.723
  691    H    GLN  94           H        GLN  94   6.539  13.013 -32.683
  692    HA   GLN  94           HA       GLN  94   8.267  14.887 -34.154
  693    HB2  GLN  94           HB2      GLN  94   6.607  16.656 -34.179
  694    HB3  GLN  94           HB3      GLN  94   5.951  15.286 -35.044
  695    HG2  GLN  94           HG2      GLN  94   4.400  14.786 -33.306
  696    HG3  GLN  94           HG3      GLN  94   5.270  15.732 -32.100
  697   HE21  GLN  94          HE22      GLN  94   5.051  18.006 -32.011
  698   HE22  GLN  94          HE21      GLN  94   3.783  18.817 -32.932
  699    HA   PRO  95           HA       PRO  95   8.945  16.080 -29.846
  700    HB2  PRO  95           HB2      PRO  95   9.391  18.763 -29.899
  701    HB3  PRO  95           HB3      PRO  95  10.583  17.542 -30.450
  702    HG2  PRO  95           HG2      PRO  95   8.658  19.182 -32.127
  703    HG3  PRO  95           HG3      PRO  95  10.401  18.877 -32.419
  704    HD2  PRO  95           HD2      PRO  95   8.454  17.452 -33.663
  705    HD3  PRO  95           HD3      PRO  95   9.987  16.690 -33.175
  706    H    GLN  96           H        GLN  96   7.795  16.839 -28.074
  707    HA   GLN  96           HA       GLN  96   5.019  17.761 -28.434
  708    HB2  GLN  96           HB2      GLN  96   6.799  16.947 -26.100
  709    HB3  GLN  96           HB3      GLN  96   5.373  17.928 -25.811
  710    HG2  GLN  96           HG2      GLN  96   4.725  15.696 -25.433
  711    HG3  GLN  96           HG3      GLN  96   3.943  16.240 -26.914
  712   HE21  GLN  96          HE22      GLN  96   3.668  13.792 -26.933
  713   HE22  GLN  96          HE21      GLN  96   4.870  12.891 -27.801
  714    H    VAL  97           H        VAL  97   7.940  18.994 -26.772
  715    HA   VAL  97           HA       VAL  97   6.837  21.740 -26.553
  716    HB   VAL  97           HB       VAL  97   9.554  20.607 -25.735
  717   HG11  VAL  97          HG11      VAL  97   9.662  22.499 -24.165
  718   HG12  VAL  97          HG12      VAL  97   9.553  23.082 -25.824
  719   HG13  VAL  97          HG13      VAL  97   8.116  23.115 -24.776
  720   HG21  VAL  97          HG21      VAL  97   8.649  20.480 -23.436
  721   HG22  VAL  97          HG22      VAL  97   7.039  20.922 -24.044
  722   HG23  VAL  97          HG23      VAL  97   7.798  19.384 -24.515
  723    H    VAL  98           H        VAL  98   7.591  23.527 -27.700
  724    HA   VAL  98           HA       VAL  98   9.862  23.111 -29.598
  725    HB   VAL  98           HB       VAL  98   7.178  24.298 -30.308
  726   HG11  VAL  98          HG11      VAL  98   8.884  25.734 -31.342
  727   HG12  VAL  98          HG12      VAL  98   9.748  24.299 -31.951
  728   HG13  VAL  98          HG13      VAL  98   8.135  24.715 -32.566
  729   HG21  VAL  98          HG21      VAL  98   7.277  21.851 -30.506
  730   HG22  VAL  98          HG22      VAL  98   7.238  22.588 -32.107
  731   HG23  VAL  98          HG23      VAL  98   8.773  21.970 -31.457
  732    H    ILE  99           H        ILE  99  11.141  24.792 -29.988
  733    HA   ILE  99           HA       ILE  99  11.101  27.104 -28.089
  734    HB   ILE  99           HB       ILE  99  13.448  25.401 -29.080
  735   HG12  ILE  99          HG12      ILE  99  13.734  24.925 -26.553
  736   HG13  ILE  99          HG13      ILE  99  12.034  25.325 -26.397
  737   HG21  ILE  99          HG21      ILE  99  14.106  27.725 -28.659
  738   HG22  ILE  99          HG22      ILE  99  13.361  27.672 -27.048
  739   HG23  ILE  99          HG23      ILE  99  14.769  26.660 -27.450
  740   HD11  ILE  99          HD11      ILE  99  13.121  23.166 -28.256
  741   HD12  ILE  99          HD12      ILE  99  12.627  22.870 -26.576
  742   HD13  ILE  99          HD13      ILE  99  11.429  23.392 -27.754
  743    H    LEU 100           H        LEU 100  11.421  29.079 -29.036
  744    HA   LEU 100           HA       LEU 100  12.362  29.216 -31.867
  745    HB2  LEU 100           HB2      LEU 100  11.371  31.478 -30.111
  746    HB3  LEU 100           HB3      LEU 100  11.673  31.504 -31.847
  747    HG   LEU 100           HG       LEU 100   9.370  30.217 -30.358
  748   HD11  LEU 100          HD11      LEU 100   9.458  32.125 -32.741
  749   HD12  LEU 100          HD12      LEU 100   8.035  31.667 -31.779
  750   HD13  LEU 100          HD13      LEU 100   9.319  32.661 -31.068
  751   HD21  LEU 100          HD21      LEU 100   8.546  29.390 -32.555
  752   HD22  LEU 100          HD22      LEU 100  10.087  29.880 -33.296
  753   HD23  LEU 100          HD23      LEU 100  10.040  28.578 -32.081
  754    H    ALA 101           H        ALA 101  14.022  30.670 -32.429
  755    HA   ALA 101           HA       ALA 101  16.422  30.539 -30.935
  756    HB1  ALA 101           HB1      ALA 101  17.274  32.118 -32.629
  757    HB2  ALA 101           HB2      ALA 101  16.266  30.869 -33.388
  758    HB3  ALA 101           HB3      ALA 101  15.616  32.502 -33.128
  759    H    ASP 102           H        ASP 102  13.858  32.887 -30.684
  760    HA   ASP 102           HA       ASP 102  15.286  35.020 -29.349
  761    HB2  ASP 102           HB2      ASP 102  13.231  35.360 -30.625
  762    HB3  ASP 102           HB3      ASP 102  12.357  34.231 -29.595
  763    H    GLY 103           H        GLY 103  14.174  31.915 -28.252
  764    HA2  GLY 103           HA2      GLY 103  14.502  30.997 -26.145
  765    HA3  GLY 103           HA3      GLY 103  14.673  32.596 -25.414
  766    H    GLN 104           H        GLN 104  11.894  32.447 -27.420
  767    HA   GLN 104           HA       GLN 104  10.098  32.046 -25.109
  768    HB2  GLN 104           HB2      GLN 104   8.307  32.826 -26.500
  769    HB3  GLN 104           HB3      GLN 104   9.631  33.985 -26.435
  770    HG2  GLN 104           HG2      GLN 104  10.396  33.099 -28.695
  771    HG3  GLN 104           HG3      GLN 104   8.908  32.134 -28.738
  772   HE21  GLN 104          HE22      GLN 104  10.165  35.491 -28.439
  773   HE22  GLN 104          HE21      GLN 104   8.742  36.236 -29.179
  774    H    ILE 105           H        ILE 105   8.610  30.425 -25.064
  775    HA   ILE 105           HA       ILE 105   9.279  27.969 -26.647
  776    HB   ILE 105           HB       ILE 105   8.673  27.935 -23.687
  777   HG12  ILE 105          HG12      ILE 105  10.573  29.432 -23.697
  778   HG13  ILE 105          HG13      ILE 105  10.965  27.886 -22.992
  779   HG21  ILE 105          HG21      ILE 105  10.157  26.057 -25.544
  780   HG22  ILE 105          HG22      ILE 105  10.075  25.843 -23.783
  781   HG23  ILE 105          HG23      ILE 105   8.597  25.785 -24.746
  782   HD11  ILE 105          HD11      ILE 105  12.209  27.237 -25.010
  783   HD12  ILE 105          HD12      ILE 105  11.802  28.800 -25.767
  784   HD13  ILE 105          HD13      ILE 105  12.803  28.753 -24.321
  785    H    THR 106           H        THR 106   7.538  26.402 -26.780
  786    HA   THR 106           HA       THR 106   4.833  27.279 -26.815
  787    HB   THR 106           HB       THR 106   4.387  24.758 -26.629
  788    HG1  THR 106           HG1      THR 106   6.376  24.372 -25.537
  789   HG21  THR 106          HG21      THR 106   5.303  24.264 -28.854
  790   HG22  THR 106          HG22      THR 106   4.516  25.852 -28.800
  791   HG23  THR 106          HG23      THR 106   6.289  25.749 -28.770
  792    HA   PRO 107           HA       PRO 107   4.469  27.330 -22.298
  793    HB2  PRO 107           HB2      PRO 107   1.846  28.120 -22.025
  794    HB3  PRO 107           HB3      PRO 107   3.203  29.220 -22.403
  795    HG2  PRO 107           HG2      PRO 107   1.226  27.980 -24.313
  796    HG3  PRO 107           HG3      PRO 107   1.830  29.670 -24.259
  797    HD2  PRO 107           HD2      PRO 107   2.821  27.788 -25.987
  798    HD3  PRO 107           HD3      PRO 107   3.845  29.082 -25.295
  799    H    PHE 108           H        PHE 108   4.186  25.601 -21.004
  800    HA   PHE 108           HA       PHE 108   2.002  23.709 -21.256
  801    HB2  PHE 108           HB2      PHE 108   3.111  21.845 -22.047
  802    HB3  PHE 108           HB3      PHE 108   3.723  23.100 -23.096
  803    HD1  PHE 108           HD2      PHE 108   6.006  24.261 -22.223
  804    HD2  PHE 108           HD1      PHE 108   4.627  20.353 -21.045
  805    HE1  PHE 108           HE2      PHE 108   8.315  23.641 -21.622
  806    HE2  PHE 108           HE1      PHE 108   6.960  19.721 -20.480
  807    HZ   PHE 108           HZ       PHE 108   8.795  21.361 -20.729
  808    H    SER 109           H        SER 109   2.399  21.728 -19.827
  809    HA   SER 109           HA       SER 109   4.163  22.334 -17.547
  810    HB2  SER 109           HB2      SER 109   1.305  21.398 -17.136
  811    HB3  SER 109           HB3      SER 109   2.530  21.633 -15.885
  812    HG   SER 109           HG       SER 109   1.481  23.655 -17.590
  813    H    LEU 110           H        LEU 110   4.917  20.590 -16.476
  814    HA   LEU 110           HA       LEU 110   4.563  17.851 -17.602
  815    HB2  LEU 110           HB2      LEU 110   6.359  18.413 -18.844
  816    HB3  LEU 110           HB3      LEU 110   6.862  19.723 -17.787
  817    HG   LEU 110           HG       LEU 110   7.960  18.163 -16.274
  818   HD11  LEU 110          HD11      LEU 110   8.399  15.816 -17.011
  819   HD12  LEU 110          HD12      LEU 110   6.679  16.040 -16.708
  820   HD13  LEU 110          HD13      LEU 110   7.280  16.036 -18.373
  821   HD21  LEU 110          HD21      LEU 110   9.816  17.607 -17.802
  822   HD22  LEU 110          HD22      LEU 110   8.747  17.827 -19.203
  823   HD23  LEU 110          HD23      LEU 110   9.161  19.210 -18.173
  824    H    LEU 111           H        LEU 111   4.249  16.455 -16.018
  825    HA   LEU 111           HA       LEU 111   4.897  17.190 -13.199
  826    HB2  LEU 111           HB2      LEU 111   2.533  17.202 -13.782
  827    HB3  LEU 111           HB3      LEU 111   2.615  15.570 -14.410
  828    HG   LEU 111           HG       LEU 111   3.472  16.012 -11.559
  829   HD11  LEU 111          HD11      LEU 111   1.128  15.872 -10.781
  830   HD12  LEU 111          HD12      LEU 111   1.456  17.344 -11.704
  831   HD13  LEU 111          HD13      LEU 111   0.569  16.002 -12.466
  832   HD21  LEU 111          HD21      LEU 111   3.482  13.695 -12.597
  833   HD22  LEU 111          HD22      LEU 111   2.410  13.832 -11.202
  834   HD23  LEU 111          HD23      LEU 111   1.737  13.846 -12.845
  835    H    MET 112           H        MET 112   5.682  15.644 -11.829
  836    HA   MET 112           HA       MET 112   6.669  13.064 -12.988
  837    HB2  MET 112           HB2      MET 112   8.096  14.964 -11.074
  838    HB3  MET 112           HB3      MET 112   8.650  13.337 -11.493
  839    HG2  MET 112           HG2      MET 112   8.900  13.982 -13.837
  840    HG3  MET 112           HG3      MET 112   8.272  15.598 -13.497
  841    HE1  MET 112           HE1      MET 112  11.072  14.880 -14.996
  842    HE2  MET 112           HE2      MET 112  10.345  16.498 -14.823
  843    HE3  MET 112           HE3      MET 112  12.036  16.225 -14.343
  844    H    ALA 113           H        ALA 113   6.107  11.342 -11.802
  845    HA   ALA 113           HA       ALA 113   5.158  11.668  -8.979
  846    HB1  ALA 113           HB1      ALA 113   3.421   9.969  -9.558
  847    HB2  ALA 113           HB2      ALA 113   3.239  11.442 -10.530
  848    HB3  ALA 113           HB3      ALA 113   3.971   9.990 -11.243
  849    H    ASN 114           H        ASN 114   5.466   9.756  -7.624
  850    HA   ASN 114           HA       ASN 114   7.936   8.331  -8.190
  851    HB2  ASN 114           HB2      ASN 114   7.378   8.740  -5.883
  852    HB3  ASN 114           HB3      ASN 114   5.800   7.960  -6.063
  853   HD21  ASN 114          HD22      ASN 114   9.291   7.165  -6.666
  854   HD22  ASN 114          HD21      ASN 114   9.132   5.550  -5.996
  855    H    ALA 115           H        ALA 115   8.181   6.471  -9.333
  856    HA   ALA 115           HA       ALA 115   6.093   5.349 -10.871
  857    HB1  ALA 115           HB1      ALA 115   8.838   4.206 -10.205
  858    HB2  ALA 115           HB2      ALA 115   7.809   3.739 -11.577
  859    HB3  ALA 115           HB3      ALA 115   8.470   5.378 -11.498
  860    H    GLY 116           H        GLY 116   6.834   4.566  -7.566
  861    HA2  GLY 116           HA2      GLY 116   5.730   1.817  -7.706
  862    HA3  GLY 116           HA3      GLY 116   6.453   2.619  -6.315
  863    H    THR 117           H        THR 117   5.026   4.852  -5.797
  864    HA   THR 117           HA       THR 117   2.427   3.866  -4.933
  865    HB   THR 117           HB       THR 117   2.208   6.087  -3.939
  866    HG1  THR 117           HG1      THR 117   4.038   7.502  -4.198
  867   HG21  THR 117          HG21      THR 117   4.064   6.077  -2.400
  868   HG22  THR 117          HG22      THR 117   3.627   4.396  -2.752
  869   HG23  THR 117          HG23      THR 117   5.062   5.124  -3.515
  870    H    GLY 118           H        GLY 118   3.575   5.856  -7.606
  871    HA2  GLY 118           HA2      GLY 118   2.452   6.700  -9.449
  872    HA3  GLY 118           HA3      GLY 118   0.901   6.160  -8.792
  873    H    GLU 119           H        GLU 119   2.610   7.862  -6.369
  874    HA   GLU 119           HA       GLU 119   0.695  10.037  -6.486
  875    HB2  GLU 119           HB2      GLU 119   1.406   8.805  -4.424
  876    HB3  GLU 119           HB3      GLU 119   2.995   9.577  -4.550
  877    HG2  GLU 119           HG2      GLU 119   1.933  11.797  -4.369
  878    HG3  GLU 119           HG3      GLU 119   0.337  11.047  -4.349
  879    HA   PRO 120           HA       PRO 120   3.364  12.981  -8.695
  880    HB2  PRO 120           HB2      PRO 120   1.730  14.928  -7.076
  881    HB3  PRO 120           HB3      PRO 120   2.217  15.010  -8.799
  882    HG2  PRO 120           HG2      PRO 120  -0.284  14.201  -8.121
  883    HG3  PRO 120           HG3      PRO 120   0.623  13.321  -9.394
  884    HD2  PRO 120           HD2      PRO 120   0.252  12.564  -6.487
  885    HD3  PRO 120           HD3      PRO 120   0.154  11.538  -7.953
  886    H    LEU 121           H        LEU 121   5.189  14.046  -8.288
  887    HA   LEU 121           HA       LEU 121   6.148  14.408  -5.497
  888    HB2  LEU 121           HB2      LEU 121   7.082  12.899  -7.824
  889    HB3  LEU 121           HB3      LEU 121   8.223  14.179  -7.530
  890    HG   LEU 121           HG       LEU 121   8.972  12.266  -6.469
  891   HD11  LEU 121          HD11      LEU 121   7.801  13.957  -4.205
  892   HD12  LEU 121          HD12      LEU 121   9.279  12.998  -4.191
  893   HD13  LEU 121          HD13      LEU 121   9.164  14.467  -5.216
  894   HD21  LEU 121          HD21      LEU 121   6.356  12.116  -4.894
  895   HD22  LEU 121          HD22      LEU 121   6.821  11.050  -6.225
  896   HD23  LEU 121          HD23      LEU 121   7.754  11.035  -4.715
  897    H    LEU 122           H        LEU 122   6.271  15.703  -8.787
  898    HA   LEU 122           HA       LEU 122   6.905  18.445  -7.899
  899    HB2  LEU 122           HB2      LEU 122   9.081  16.978  -8.128
  900    HB3  LEU 122           HB3      LEU 122   8.706  16.946  -9.846
  901    HG   LEU 122           HG       LEU 122   8.768  19.556  -9.699
  902   HD11  LEU 122          HD11      LEU 122   8.791  19.630  -7.171
  903   HD12  LEU 122          HD12      LEU 122  10.369  18.833  -7.196
  904   HD13  LEU 122          HD13      LEU 122  10.173  20.452  -7.910
  905   HD21  LEU 122          HD21      LEU 122  11.198  19.511  -9.999
  906   HD22  LEU 122          HD22      LEU 122  11.279  17.896  -9.260
  907   HD23  LEU 122          HD23      LEU 122  10.453  18.134 -10.815
  908    H    THR 123           H        THR 123   6.571  19.959  -9.610
  909    HA   THR 123           HA       THR 123   5.727  18.954 -12.256
  910    HB   THR 123           HB       THR 123   4.042  21.060 -10.860
  911    HG1  THR 123           HG1      THR 123   3.916  18.289 -10.754
  912   HG21  THR 123          HG21      THR 123   3.490  19.283 -13.261
  913   HG22  THR 123          HG22      THR 123   2.397  20.500 -12.572
  914   HG23  THR 123          HG23      THR 123   3.889  21.016 -13.332
  915    H    LEU 124           H        LEU 124   6.080  20.345 -13.881
  916    HA   LEU 124           HA       LEU 124   7.689  22.796 -13.379
  917    HB2  LEU 124           HB2      LEU 124   7.928  20.844 -15.708
  918    HB3  LEU 124           HB3      LEU 124   9.012  22.177 -15.313
  919    HG   LEU 124           HG       LEU 124   8.680  19.618 -13.685
  920   HD11  LEU 124          HD11      LEU 124  10.908  19.053 -14.471
  921   HD12  LEU 124          HD12      LEU 124   9.888  19.358 -15.877
  922   HD13  LEU 124          HD13      LEU 124  11.041  20.594 -15.350
  923   HD21  LEU 124          HD21      LEU 124   9.304  21.557 -12.282
  924   HD22  LEU 124          HD22      LEU 124  10.573  20.351 -12.391
  925   HD23  LEU 124          HD23      LEU 124  10.685  21.854 -13.357
  926    H    VAL 125           H        VAL 125   7.195  24.547 -14.694
  927    HA   VAL 125           HA       VAL 125   4.781  24.378 -16.453
  928    HB   VAL 125           HB       VAL 125   4.954  26.264 -14.069
  929   HG11  VAL 125          HG11      VAL 125   2.717  25.754 -16.070
  930   HG12  VAL 125          HG12      VAL 125   2.584  26.762 -14.615
  931   HG13  VAL 125          HG13      VAL 125   3.673  27.245 -15.911
  932   HG21  VAL 125          HG21      VAL 125   4.494  24.019 -13.210
  933   HG22  VAL 125          HG22      VAL 125   3.048  25.011 -13.122
  934   HG23  VAL 125          HG23      VAL 125   3.203  23.799 -14.415
  935    H    CYS 126           H        CYS 126   4.896  25.651 -18.187
  936    HA   CYS 126           HA       CYS 126   6.891  27.888 -18.245
  937    HB2  CYS 126           HB2      CYS 126   7.411  25.866 -19.706
  938    HB3  CYS 126           HB3      CYS 126   5.912  26.182 -20.574
  939    HG   CYS 126           HG       CYS 126   8.554  28.162 -20.139
  940    H    SER 127           H        SER 127   5.872  29.783 -18.095
  941    HA   SER 127           HA       SER 127   3.192  30.317 -19.033
  942    HB2  SER 127           HB2      SER 127   5.420  32.271 -18.342
  943    HB3  SER 127           HB3      SER 127   3.686  32.627 -18.411
  944    HG   SER 127           HG       SER 127   3.372  31.205 -16.669
  945    H    GLY 128           H        GLY 128   6.051  29.986 -20.826
  946    HA2  GLY 128           HA2      GLY 128   5.504  30.180 -23.295
  947    HA3  GLY 128           HA3      GLY 128   5.180  31.882 -22.983
  948    H    SER 129           H        SER 129   7.816  31.076 -21.044
  949    HA   SER 129           HA       SER 129   9.869  31.731 -23.092
  950    HB2  SER 129           HB2      SER 129   9.231  33.456 -20.670
  951    HB3  SER 129           HB3      SER 129  10.668  33.629 -21.692
  952    HG   SER 129           HG       SER 129   8.975  35.059 -22.291
  953    H    TRP 130           H        TRP 130  11.974  31.354 -22.543
  954    HA   TRP 130           HA       TRP 130  12.701  29.369 -20.721
  955    HB2  TRP 130           HB2      TRP 130  14.044  29.888 -22.601
  956    HB3  TRP 130           HB3      TRP 130  14.150  31.588 -22.181
  957    HD1  TRP 130           HD1      TRP 130  16.169  32.390 -20.894
  958    HE1  TRP 130           HE1      TRP 130  18.115  31.326 -19.604
  959    HE3  TRP 130           HE3      TRP 130  14.709  27.495 -21.140
  960    HZ2  TRP 130           HZ2      TRP 130  18.940  28.679 -18.784
  961    HZ3  TRP 130           HZ3      TRP 130  16.064  25.737 -20.025
  962    HH2  TRP 130           HH2      TRP 130  18.168  26.316 -18.860
  963    HA   PRO 131           HA       PRO 131  13.385  28.355 -19.134
  964    HB2  PRO 131           HB2      PRO 131  14.170  27.627 -16.683
  965    HB3  PRO 131           HB3      PRO 131  15.327  28.379 -17.817
  966    HG2  PRO 131           HG2      PRO 131  13.847  29.683 -15.531
  967    HG3  PRO 131           HG3      PRO 131  15.577  29.829 -15.990
  968    HD2  PRO 131           HD2      PRO 131  13.580  31.648 -16.732
  969    HD3  PRO 131           HD3      PRO 131  15.101  31.397 -17.633
  970    H    LEU 132           H        LEU 132  12.057  26.627 -17.929
  971    HA   LEU 132           HA       LEU 132   9.549  27.813 -16.963
  972    HB2  LEU 132           HB2      LEU 132   8.486  26.206 -17.850
  973    HB3  LEU 132           HB3      LEU 132   9.915  25.844 -18.758
  974    HG   LEU 132           HG       LEU 132   9.044  24.426 -16.197
  975   HD11  LEU 132          HD11      LEU 132   8.354  22.594 -17.733
  976   HD12  LEU 132          HD12      LEU 132   7.424  24.055 -18.061
  977   HD13  LEU 132          HD13      LEU 132   8.764  23.613 -19.121
  978   HD21  LEU 132          HD21      LEU 132  11.480  24.261 -16.608
  979   HD22  LEU 132          HD22      LEU 132  10.692  22.710 -16.914
  980   HD23  LEU 132          HD23      LEU 132  11.172  23.741 -18.279
  981    H    ASP 133           H        ASP 133   8.422  26.858 -15.185
  982    HA   ASP 133           HA       ASP 133   9.942  27.432 -12.810
  983    HB2  ASP 133           HB2      ASP 133   7.627  28.231 -13.446
  984    HB3  ASP 133           HB3      ASP 133   7.046  26.583 -13.202
  985    H    GLN 134           H        GLN 134   9.331  26.219 -10.771
  986    HA   GLN 134           HA       GLN 134   9.079  23.263 -10.993
  987    HB2  GLN 134           HB2      GLN 134  11.137  24.669  -9.214
  988    HB3  GLN 134           HB3      GLN 134  10.691  22.966  -9.136
  989    HG2  GLN 134           HG2      GLN 134  11.486  22.780 -11.559
  990    HG3  GLN 134           HG3      GLN 134  12.183  24.386 -11.369
  991   HE21  GLN 134          HE22      GLN 134  12.166  21.067  -9.868
  992   HE22  GLN 134          HE21      GLN 134  13.840  21.180  -9.351
  993    H    THR 135           H        THR 135   7.632  22.478  -9.537
  994    HA   THR 135           HA       THR 135   7.143  23.804  -6.942
  995    HB   THR 135           HB       THR 135   5.622  24.872  -8.599
  996    HG1  THR 135           HG1      THR 135   4.998  24.817  -6.484
  997   HG21  THR 135          HG21      THR 135   5.073  22.990 -10.079
  998   HG22  THR 135          HG22      THR 135   4.231  22.166  -8.736
  999   HG23  THR 135          HG23      THR 135   3.623  23.704  -9.379
 1000    H    LEU 136           H        LEU 136   5.661  22.465  -5.567
 1001    HA   LEU 136           HA       LEU 136   6.031  19.534  -6.043
 1002    HB2  LEU 136           HB2      LEU 136   5.348  21.209  -3.602
 1003    HB3  LEU 136           HB3      LEU 136   4.933  19.502  -3.690
 1004    HG   LEU 136           HG       LEU 136   7.294  18.884  -4.027
 1005   HD11  LEU 136          HD11      LEU 136   8.274  20.885  -5.017
 1006   HD12  LEU 136          HD12      LEU 136   7.868  21.843  -3.572
 1007   HD13  LEU 136          HD13      LEU 136   9.080  20.543  -3.488
 1008   HD21  LEU 136          HD21      LEU 136   6.793  20.634  -1.585
 1009   HD22  LEU 136          HD22      LEU 136   6.288  18.939  -1.775
 1010   HD23  LEU 136          HD23      LEU 136   8.010  19.344  -1.722
 1011    H    ALA 137           H        ALA 137   4.348  18.308  -6.619
 1012    HA   ALA 137           HA       ALA 137   2.366  17.890  -7.716
 1013    HB1  ALA 137           HB1      ALA 137   1.520  18.502  -4.859
 1014    HB2  ALA 137           HB2      ALA 137   0.670  17.435  -6.000
 1015    HB3  ALA 137           HB3      ALA 137   2.292  17.004  -5.426
 1016    H    ARG 138           H        ARG 138   2.668  19.988  -8.956
 1017    HA   ARG 138           HA       ARG 138   1.809  21.710 -10.123
 1018    HB2  ARG 138           HB2      ARG 138  -0.928  20.781  -9.208
 1019    HB3  ARG 138           HB3      ARG 138  -0.497  21.598 -10.706
 1020    HG2  ARG 138           HG2      ARG 138   0.910  19.564 -11.295
 1021    HG3  ARG 138           HG3      ARG 138   0.158  18.728  -9.935
 1022    HD2  ARG 138           HD2      ARG 138  -1.290  19.982 -12.299
 1023    HD3  ARG 138           HD3      ARG 138  -0.922  18.259 -12.116
 1024    HE   ARG 138           HE       ARG 138  -2.339  18.967  -9.803
 1025   HH11  ARG 138          HH11      ARG 138  -3.083  18.859 -13.226
 1026   HH12  ARG 138          HH12      ARG 138  -4.780  18.613 -12.934
 1027   HH21  ARG 138          HH21      ARG 138  -4.517  18.656  -9.517
 1028   HH22  ARG 138          HH22      ARG 138  -5.558  18.497 -10.895
 1029    H    ASP 139           H        ASP 139   1.999  22.323  -6.962
 1030    HA   ASP 139           HA       ASP 139  -0.117  24.004  -6.364
 1031    HB2  ASP 139           HB2      ASP 139   1.513  23.103  -4.759
 1032    HB3  ASP 139           HB3      ASP 139   2.713  24.263  -5.320
 1033    H    THR 140           H        THR 140   2.703  25.061  -8.260
 1034    HA   THR 140           HA       THR 140   1.686  27.849  -8.327
 1035    HB   THR 140           HB       THR 140   3.593  28.327  -9.787
 1036    HG1  THR 140           HG1      THR 140   5.034  26.791 -10.291
 1037   HG21  THR 140          HG21      THR 140   3.955  28.490  -7.383
 1038   HG22  THR 140          HG22      THR 140   4.384  26.772  -7.297
 1039   HG23  THR 140          HG23      THR 140   5.415  27.902  -8.199
 1040    H    ARG 141           H        ARG 141   0.894  25.064 -10.106
 1041    HA   ARG 141           HA       ARG 141   0.905  26.125 -12.777
 1042    HB2  ARG 141           HB2      ARG 141   1.051  23.733 -12.178
 1043    HB3  ARG 141           HB3      ARG 141  -0.633  23.744 -11.667
 1044    HG2  ARG 141           HG2      ARG 141   0.048  24.663 -14.469
 1045    HG3  ARG 141           HG3      ARG 141   0.128  22.942 -14.100
 1046    HD2  ARG 141           HD2      ARG 141  -2.167  22.825 -13.458
 1047    HD3  ARG 141           HD3      ARG 141  -2.371  24.567 -13.472
 1048    HE   ARG 141           HE       ARG 141  -2.354  22.762 -15.791
 1049   HH11  ARG 141          HH21      ARG 141  -2.052  26.179 -14.917
 1050   HH12  ARG 141          HH22      ARG 141  -2.691  26.666 -16.464
 1051   HH21  ARG 141          HH11      ARG 141  -3.138  23.456 -17.616
 1052   HH22  ARG 141          HH12      ARG 141  -3.300  25.169 -17.974
 1053    HA   PRO 142           HA       PRO 142  -3.917  26.878 -12.059
 1054    HB2  PRO 142           HB2      PRO 142  -3.472  28.309  -9.429
 1055    HB3  PRO 142           HB3      PRO 142  -4.966  27.540 -10.056
 1056    HG2  PRO 142           HG2      PRO 142  -3.410  26.204  -8.297
 1057    HG3  PRO 142           HG3      PRO 142  -4.052  25.346  -9.738
 1058    HD2  PRO 142           HD2      PRO 142  -1.299  26.499  -9.299
 1059    HD3  PRO 142           HD3      PRO 142  -1.772  24.939 -10.042
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1   1.951   9.518   0.211
    2    H2   MET   1           H2       MET   1   0.828   9.372   1.399
    3    H3   MET   1           H3       MET   1   2.317   9.957   1.749
    4    HA   MET   1           HA       MET   1   2.061   7.653   2.492
    5    HB2  MET   1           HB2      MET   1   1.811   7.113  -0.508
    6    HB3  MET   1           HB3      MET   1   2.074   5.883   0.725
    7    HG2  MET   1           HG2      MET   1  -0.063   6.504   1.819
    8    HG3  MET   1           HG3      MET   1  -0.373   7.670   0.525
    9    HE1  MET   1           HE1      MET   1  -2.430   5.418   1.416
   10    HE2  MET   1           HE2      MET   1  -2.745   6.593   0.116
   11    HE3  MET   1           HE3      MET   1  -3.006   4.858  -0.170
   12    H    ALA   2           H        ALA   2   3.869   6.009   2.211
   13    HA   ALA   2           HA       ALA   2   6.302   7.003   0.866
   14    HB1  ALA   2           HB1      ALA   2   7.613   6.817   2.967
   15    HB2  ALA   2           HB2      ALA   2   6.370   8.073   3.092
   16    HB3  ALA   2           HB3      ALA   2   6.121   6.495   3.874
   17    H    TYR   3           H        TYR   3   8.007   5.401   0.860
   18    HA   TYR   3           HA       TYR   3   7.167   2.560   1.218
   19    HB2  TYR   3           HB2      TYR   3   6.437   3.483  -1.014
   20    HB3  TYR   3           HB3      TYR   3   8.117   3.853  -1.360
   21    HD1  TYR   3           HD2      TYR   3   6.920   0.623   0.187
   22    HD2  TYR   3           HD1      TYR   3   8.205   2.667  -3.387
   23    HE1  TYR   3           HE2      TYR   3   7.110  -1.553  -0.981
   24    HE2  TYR   3           HE1      TYR   3   8.391   0.460  -4.567
   25    HH   TYR   3           HH       TYR   3   7.636  -2.628  -2.934
   26    H    GLY   4           H        GLY   4   9.581   4.851   1.668
   27    HA2  GLY   4           HA2      GLY   4  11.776   4.576   2.444
   28    HA3  GLY   4           HA3      GLY   4  11.752   2.858   2.021
   29    H    ARG   5           H        ARG   5  10.736   5.441  -0.106
   30    HA   ARG   5           HA       ARG   5  13.074   5.156  -1.966
   31    HB2  ARG   5           HB2      ARG   5  11.403   3.343  -2.411
   32    HB3  ARG   5           HB3      ARG   5  10.162   4.565  -2.689
   33    HG2  ARG   5           HG2      ARG   5  11.482   5.437  -4.630
   34    HG3  ARG   5           HG3      ARG   5  12.711   4.201  -4.330
   35    HD2  ARG   5           HD2      ARG   5   9.774   3.633  -4.941
   36    HD3  ARG   5           HD3      ARG   5  11.032   3.657  -6.162
   37    HE   ARG   5           HE       ARG   5  10.558   1.574  -4.138
   38   HH11  ARG   5          HH11      ARG   5  12.980   2.810  -6.387
   39   HH12  ARG   5          HH12      ARG   5  13.757   1.247  -6.491
   40   HH21  ARG   5          HH21      ARG   5  11.636  -0.354  -4.334
   41   HH22  ARG   5          HH22      ARG   5  13.031  -0.465  -5.357
   42    H    GLU   6           H        GLU   6  10.179   6.855  -0.988
   43    HA   GLU   6           HA       GLU   6   9.889   8.863  -2.858
   44    HB2  GLU   6           HB2      GLU   6   8.736  10.086  -1.123
   45    HB3  GLU   6           HB3      GLU   6   8.296   8.391  -1.123
   46    HG2  GLU   6           HG2      GLU   6  10.143   9.768   0.868
   47    HG3  GLU   6           HG3      GLU   6   8.466   9.324   1.140
   48    H    ASP   7           H        ASP   7  12.283   8.983  -0.181
   49    HA   ASP   7           HA       ASP   7  13.136  11.670  -0.777
   50    HB2  ASP   7           HB2      ASP   7  13.520  10.514   1.377
   51    HB3  ASP   7           HB3      ASP   7  14.598   9.370   0.578
   52    H    VAL   8           H        VAL   8  14.215   8.500  -1.953
   53    HA   VAL   8           HA       VAL   8  16.487   9.516  -3.468
   54    HB   VAL   8           HB       VAL   8  15.040   6.898  -4.017
   55   HG11  VAL   8          HG11      VAL   8  17.270   6.176  -4.757
   56   HG12  VAL   8          HG12      VAL   8  16.805   7.635  -5.638
   57   HG13  VAL   8          HG13      VAL   8  17.962   7.748  -4.300
   58   HG21  VAL   8          HG21      VAL   8  17.177   7.439  -1.907
   59   HG22  VAL   8          HG22      VAL   8  15.519   6.864  -1.614
   60   HG23  VAL   8          HG23      VAL   8  16.667   5.827  -2.458
   61    H    ALA   9           H        ALA   9  13.093   8.654  -4.256
   62    HA   ALA   9           HA       ALA   9  13.199   9.319  -7.025
   63    HB1  ALA   9           HB1      ALA   9  10.758   9.434  -6.859
   64    HB2  ALA   9           HB2      ALA   9  11.368   8.045  -5.944
   65    HB3  ALA   9           HB3      ALA   9  10.853   9.516  -5.087
   66    H    ASN  10           H        ASN  10  12.261  11.456  -4.219
   67    HA   ASN  10           HA       ASN  10  12.013  13.806  -5.847
   68    HB2  ASN  10           HB2      ASN  10  11.061  13.597  -3.575
   69    HB3  ASN  10           HB3      ASN  10  12.687  13.522  -2.889
   70   HD21  ASN  10          HD22      ASN  10  10.532  15.735  -4.872
   71   HD22  ASN  10          HD21      ASN  10  11.336  17.151  -4.263
   72    H    THR  11           H        THR  11  14.922  12.400  -4.282
   73    HA   THR  11           HA       THR  11  16.718  14.521  -5.006
   74    HB   THR  11           HB       THR  11  17.326  11.547  -4.751
   75    HG1  THR  11           HG1      THR  11  16.461  12.337  -2.870
   76   HG21  THR  11          HG21      THR  11  19.188  12.735  -5.828
   77   HG22  THR  11          HG22      THR  11  19.128  14.003  -4.583
   78   HG23  THR  11          HG23      THR  11  19.604  12.344  -4.156
   79    H    ARG  12           H        ARG  12  15.982  11.458  -6.767
   80    HA   ARG  12           HA       ARG  12  17.469  12.113  -9.129
   81    HB2  ARG  12           HB2      ARG  12  15.123  10.231  -8.621
   82    HB3  ARG  12           HB3      ARG  12  15.928  10.342 -10.183
   83    HG2  ARG  12           HG2      ARG  12  17.406   9.654  -7.606
   84    HG3  ARG  12           HG3      ARG  12  16.705   8.453  -8.692
   85    HD2  ARG  12           HD2      ARG  12  18.128   9.225 -10.540
   86    HD3  ARG  12           HD3      ARG  12  18.823  10.482  -9.526
   87    HE   ARG  12           HE       ARG  12  19.337   7.553  -9.350
   88   HH11  ARG  12          HH11      ARG  12  20.260  10.741  -8.060
   89   HH12  ARG  12          HH12      ARG  12  21.478   9.984  -7.069
   90   HH21  ARG  12          HH21      ARG  12  20.891   6.813  -8.265
   91   HH22  ARG  12          HH22      ARG  12  21.891   7.809  -7.203
   92    H    ALA  13           H        ALA  13  14.101  12.922  -8.293
   93    HA   ALA  13           HA       ALA  13  13.264  13.951 -10.760
   94    HB1  ALA  13           HB1      ALA  13  12.598  15.076  -8.031
   95    HB2  ALA  13           HB2      ALA  13  11.615  15.086  -9.514
   96    HB3  ALA  13           HB3      ALA  13  11.965  13.553  -8.689
   97    H    ARG  14           H        ARG  14  15.037  15.631  -8.134
   98    HA   ARG  14           HA       ARG  14  15.102  18.245  -9.378
   99    HB2  ARG  14           HB2      ARG  14  16.954  16.952  -7.332
  100    HB3  ARG  14           HB3      ARG  14  16.922  18.673  -7.708
  101    HG2  ARG  14           HG2      ARG  14  14.821  19.011  -6.680
  102    HG3  ARG  14           HG3      ARG  14  14.391  17.298  -6.739
  103    HD2  ARG  14           HD2      ARG  14  16.221  16.766  -5.163
  104    HD3  ARG  14           HD3      ARG  14  16.618  18.483  -5.023
  105    HE   ARG  14           HE       ARG  14  14.286  17.023  -3.914
  106   HH11  ARG  14          HH11      ARG  14  15.702  20.221  -4.274
  107   HH12  ARG  14          HH12      ARG  14  14.810  20.834  -2.913
  108   HH21  ARG  14          HH21      ARG  14  13.288  17.811  -2.246
  109   HH22  ARG  14          HH22      ARG  14  13.467  19.488  -1.756
  110    H    GLU  15           H        GLU  15  17.390  15.533  -9.349
  111    HA   GLU  15           HA       GLU  15  19.381  16.728 -11.055
  112    HB2  GLU  15           HB2      GLU  15  18.591  13.825 -10.535
  113    HB3  GLU  15           HB3      GLU  15  20.033  14.307 -11.442
  114    HG2  GLU  15           HG2      GLU  15  20.916  15.471  -9.457
  115    HG3  GLU  15           HG3      GLU  15  19.487  15.028  -8.527
  116    H    THR  16           H        THR  16  16.620  14.600 -11.848
  117    HA   THR  16           HA       THR  16  16.968  14.524 -14.666
  118    HB   THR  16           HB       THR  16  14.389  14.377 -13.049
  119    HG1  THR  16           HG1      THR  16  15.816  12.846 -12.385
  120   HG21  THR  16          HG21      THR  16  15.024  13.240 -15.803
  121   HG22  THR  16          HG22      THR  16  13.566  12.916 -14.839
  122   HG23  THR  16          HG23      THR  16  13.870  14.553 -15.463
  123    H    ALA  17           H        ALA  17  15.148  16.835 -12.651
  124    HA   ALA  17           HA       ALA  17  14.252  18.462 -14.821
  125    HB1  ALA  17           HB1      ALA  17  13.150  18.425 -12.638
  126    HB2  ALA  17           HB2      ALA  17  14.610  19.077 -11.859
  127    HB3  ALA  17           HB3      ALA  17  13.698  20.073 -13.015
  128    H    ALA  18           H        ALA  18  17.153  18.823 -12.689
  129    HA   ALA  18           HA       ALA  18  18.107  21.221 -13.922
  130    HB1  ALA  18           HB1      ALA  18  19.636  18.935 -12.591
  131    HB2  ALA  18           HB2      ALA  18  20.268  20.564 -12.917
  132    HB3  ALA  18           HB3      ALA  18  18.932  20.346 -11.769
  133    H    ARG  19           H        ARG  19  18.723  17.775 -14.698
  134    HA   ARG  19           HA       ARG  19  20.475  18.244 -16.912
  135    HB2  ARG  19           HB2      ARG  19  20.292  16.089 -15.687
  136    HB3  ARG  19           HB3      ARG  19  18.650  15.871 -16.291
  137    HG2  ARG  19           HG2      ARG  19  20.192  14.490 -17.556
  138    HG3  ARG  19           HG3      ARG  19  19.502  15.727 -18.605
  139    HD2  ARG  19           HD2      ARG  19  21.641  17.085 -18.245
  140    HD3  ARG  19           HD3      ARG  19  22.285  15.695 -17.373
  141    HE   ARG  19           HE       ARG  19  22.554  14.556 -19.388
  142   HH11  ARG  19          HH11      ARG  19  20.575  17.396 -20.073
  143   HH12  ARG  19          HH12      ARG  19  20.880  17.262 -21.784
  144   HH21  ARG  19          HH21      ARG  19  22.793  14.438 -21.583
  145   HH22  ARG  19          HH22      ARG  19  22.036  15.608 -22.614
  146    H    PHE  20           H        PHE  20  16.933  17.816 -16.834
  147    HA   PHE  20           HA       PHE  20  16.468  18.216 -19.622
  148    HB2  PHE  20           HB2      PHE  20  14.766  17.341 -18.028
  149    HB3  PHE  20           HB3      PHE  20  14.739  18.886 -17.204
  150    HD1  PHE  20           HD2      PHE  20  14.355  17.509 -20.712
  151    HD2  PHE  20           HD1      PHE  20  13.102  20.452 -17.808
  152    HE1  PHE  20           HE2      PHE  20  12.595  18.297 -22.256
  153    HE2  PHE  20           HE1      PHE  20  11.398  21.292 -19.401
  154    HZ   PHE  20           HZ       PHE  20  11.144  20.214 -21.637
  155    H    THR  21           H        THR  21  16.619  20.624 -16.950
  156    HA   THR  21           HA       THR  21  16.024  22.904 -18.552
  157    HB   THR  21           HB       THR  21  17.780  22.785 -16.066
  158    HG1  THR  21           HG1      THR  21  15.773  21.928 -15.662
  159   HG21  THR  21          HG21      THR  21  16.852  25.116 -15.701
  160   HG22  THR  21          HG22      THR  21  17.988  24.987 -17.043
  161   HG23  THR  21          HG23      THR  21  16.236  25.082 -17.360
  162    H    ALA  22           H        ALA  22  19.235  21.392 -17.837
  163    HA   ALA  22           HA       ALA  22  20.737  23.111 -19.551
  164    HB1  ALA  22           HB1      ALA  22  21.217  20.198 -18.777
  165    HB2  ALA  22           HB2      ALA  22  22.426  21.316 -19.444
  166    HB3  ALA  22           HB3      ALA  22  21.724  21.623 -17.844
  167    H    ALA  23           H        ALA  23  18.984  20.089 -20.312
  168    HA   ALA  23           HA       ALA  23  19.832  19.909 -23.041
  169    HB1  ALA  23           HB1      ALA  23  18.734  18.101 -21.603
  170    HB2  ALA  23           HB2      ALA  23  17.187  18.905 -21.927
  171    HB3  ALA  23           HB3      ALA  23  18.159  18.255 -23.263
  172    H    LEU  24           H        LEU  24  17.056  21.586 -21.557
  173    HA   LEU  24           HA       LEU  24  15.926  22.530 -24.031
  174    HB2  LEU  24           HB2      LEU  24  14.767  22.221 -21.816
  175    HB3  LEU  24           HB3      LEU  24  15.665  23.602 -21.197
  176    HG   LEU  24           HG       LEU  24  14.562  25.019 -23.017
  177   HD11  LEU  24          HD11      LEU  24  12.844  22.504 -23.321
  178   HD12  LEU  24          HD12      LEU  24  12.477  24.094 -24.015
  179   HD13  LEU  24          HD13      LEU  24  13.899  23.198 -24.570
  180   HD21  LEU  24          HD21      LEU  24  12.409  25.151 -21.836
  181   HD22  LEU  24          HD22      LEU  24  12.713  23.568 -21.084
  182   HD23  LEU  24          HD23      LEU  24  13.739  24.961 -20.679
  183    H    GLU  25           H        GLU  25  18.368  23.876 -21.801
  184    HA   GLU  25           HA       GLU  25  18.741  26.394 -23.129
  185    HB2  GLU  25           HB2      GLU  25  19.727  25.657 -20.887
  186    HB3  GLU  25           HB3      GLU  25  20.933  24.763 -21.806
  187    HG2  GLU  25           HG2      GLU  25  21.615  26.882 -22.938
  188    HG3  GLU  25           HG3      GLU  25  20.412  27.757 -21.990
  189    H    LEU  26           H        LEU  26  20.308  23.213 -23.644
  190    HA   LEU  26           HA       LEU  26  21.876  23.756 -25.924
  191    HB2  LEU  26           HB2      LEU  26  22.272  21.682 -25.070
  192    HB3  LEU  26           HB3      LEU  26  20.629  21.438 -24.581
  193    HG   LEU  26           HG       LEU  26  20.063  20.957 -27.056
  194   HD11  LEU  26          HD11      LEU  26  22.184  21.847 -28.017
  195   HD12  LEU  26          HD12      LEU  26  23.089  20.594 -27.140
  196   HD13  LEU  26          HD13      LEU  26  21.933  20.139 -28.411
  197   HD21  LEU  26          HD21      LEU  26  20.820  18.625 -26.821
  198   HD22  LEU  26          HD22      LEU  26  21.854  19.102 -25.453
  199   HD23  LEU  26          HD23      LEU  26  20.082  19.245 -25.341
  200    H    ALA  27           H        ALA  27  18.406  22.932 -25.810
  201    HA   ALA  27           HA       ALA  27  17.970  23.092 -28.634
  202    HB1  ALA  27           HB1      ALA  27  16.441  21.960 -27.079
  203    HB2  ALA  27           HB2      ALA  27  16.051  23.501 -26.297
  204    HB3  ALA  27           HB3      ALA  27  15.583  23.228 -27.986
  205    H    ILE  28           H        ILE  28  17.590  25.602 -26.091
  206    HA   ILE  28           HA       ILE  28  16.665  27.715 -27.806
  207    HB   ILE  28           HB       ILE  28  18.132  27.731 -25.139
  208   HG12  ILE  28          HG12      ILE  28  15.222  28.429 -25.679
  209   HG13  ILE  28          HG13      ILE  28  15.716  26.758 -25.413
  210   HG21  ILE  28          HG21      ILE  28  17.350  30.104 -24.908
  211   HG22  ILE  28          HG22      ILE  28  18.541  29.913 -26.185
  212   HG23  ILE  28          HG23      ILE  28  16.820  30.071 -26.603
  213   HD11  ILE  28          HD11      ILE  28  14.879  27.637 -23.380
  214   HD12  ILE  28          HD12      ILE  28  16.617  27.323 -23.213
  215   HD13  ILE  28          HD13      ILE  28  16.040  28.993 -23.421
  216    H    ASP  29           H        ASP  29  19.969  26.832 -26.754
  217    HA   ASP  29           HA       ASP  29  21.361  28.869 -28.142
  218    HB2  ASP  29           HB2      ASP  29  22.267  27.444 -26.324
  219    HB3  ASP  29           HB3      ASP  29  22.248  26.052 -27.408
  220    H    ARG  30           H        ARG  30  20.042  25.824 -29.367
  221    HA   ARG  30           HA       ARG  30  21.477  26.165 -31.944
  222    HB2  ARG  30           HB2      ARG  30  21.401  23.957 -30.898
  223    HB3  ARG  30           HB3      ARG  30  19.632  23.934 -31.000
  224    HG2  ARG  30           HG2      ARG  30  19.689  23.937 -33.408
  225    HG3  ARG  30           HG3      ARG  30  21.412  24.359 -33.440
  226    HD2  ARG  30           HD2      ARG  30  22.006  22.157 -32.569
  227    HD3  ARG  30           HD3      ARG  30  20.283  21.717 -32.466
  228    HE   ARG  30           HE       ARG  30  20.768  22.613 -35.107
  229   HH11  ARG  30          HH11      ARG  30  21.779  19.811 -33.199
  230   HH12  ARG  30          HH12      ARG  30  21.630  18.784 -34.637
  231   HH21  ARG  30          HH21      ARG  30  20.794  21.141 -36.820
  232   HH22  ARG  30          HH22      ARG  30  21.171  19.453 -36.440
  233    H    ALA  31           H        ALA  31  18.151  26.598 -30.765
  234    HA   ALA  31           HA       ALA  31  16.857  26.735 -33.269
  235    HB1  ALA  31           HB1      ALA  31  16.262  28.287 -30.703
  236    HB2  ALA  31           HB2      ALA  31  15.123  28.009 -32.041
  237    HB3  ALA  31           HB3      ALA  31  15.708  26.643 -31.075
  238    H    THR  32           H        THR  32  18.857  29.262 -31.792
  239    HA   THR  32           HA       THR  32  18.120  31.254 -33.813
  240    HB   THR  32           HB       THR  32  18.871  31.746 -31.457
  241    HG1  THR  32           HG1      THR  32  19.889  33.611 -32.114
  242   HG21  THR  32          HG21      THR  32  20.907  30.301 -31.403
  243   HG22  THR  32          HG22      THR  32  21.669  31.370 -32.605
  244   HG23  THR  32          HG23      THR  32  21.241  31.989 -30.997
  245    H    LEU  33           H        LEU  33  20.205  28.536 -33.899
  246    HA   LEU  33           HA       LEU  33  21.993  29.716 -35.916
  247    HB2  LEU  33           HB2      LEU  33  22.213  27.169 -34.277
  248    HB3  LEU  33           HB3      LEU  33  23.422  27.749 -35.418
  249    HG   LEU  33           HG       LEU  33  22.597  29.134 -32.836
  250   HD11  LEU  33          HD11      LEU  33  24.847  28.517 -32.076
  251   HD12  LEU  33          HD12      LEU  33  23.918  27.078 -32.510
  252   HD13  LEU  33          HD13      LEU  33  25.164  27.693 -33.620
  253   HD21  LEU  33          HD21      LEU  33  24.553  30.612 -33.255
  254   HD22  LEU  33          HD22      LEU  33  24.759  29.873 -34.858
  255   HD23  LEU  33          HD23      LEU  33  23.303  30.823 -34.482
  256    H    SER  34           H        SER  34  19.767  26.991 -35.454
  257    HA   SER  34           HA       SER  34  20.465  25.769 -38.027
  258    HB2  SER  34           HB2      SER  34  18.399  25.052 -35.925
  259    HB3  SER  34           HB3      SER  34  18.719  24.102 -37.394
  260    HG   SER  34           HG       SER  34  20.811  24.881 -35.675
  261    H    GLY  35           H        GLY  35  18.280  28.280 -37.302
  262    HA2  GLY  35           HA2      GLY  35  17.152  29.528 -38.909
  263    HA3  GLY  35           HA3      GLY  35  17.398  28.245 -40.092
  264    H    GLN  36           H        GLN  36  16.033  26.739 -37.508
  265    HA   GLN  36           HA       GLN  36  13.219  27.519 -37.867
  266    HB2  GLN  36           HB2      GLN  36  13.587  25.621 -39.462
  267    HB3  GLN  36           HB3      GLN  36  14.242  24.662 -38.148
  268    HG2  GLN  36           HG2      GLN  36  11.905  24.954 -37.021
  269    HG3  GLN  36           HG3      GLN  36  11.367  25.496 -38.608
  270   HE21  GLN  36          HE22      GLN  36  12.243  22.792 -36.561
  271   HE22  GLN  36          HE21      GLN  36  11.932  21.547 -37.780
  272    HA   PRO  37           HA       PRO  37  13.248  26.924 -33.356
  273    HB2  PRO  37           HB2      PRO  37  10.634  25.574 -34.137
  274    HB3  PRO  37           HB3      PRO  37  10.967  26.562 -32.685
  275    HG2  PRO  37           HG2      PRO  37   9.792  27.740 -34.783
  276    HG3  PRO  37           HG3      PRO  37  11.201  28.559 -34.021
  277    HD2  PRO  37           HD2      PRO  37  11.116  26.947 -36.554
  278    HD3  PRO  37           HD3      PRO  37  12.007  28.453 -36.197
  279    H    VAL  38           H        VAL  38  13.458  25.285 -31.829
  280    HA   VAL  38           HA       VAL  38  14.035  22.507 -32.828
  281    HB   VAL  38           HB       VAL  38  15.217  23.981 -30.437
  282   HG11  VAL  38          HG11      VAL  38  15.838  21.209 -31.561
  283   HG12  VAL  38          HG12      VAL  38  16.829  22.056 -30.367
  284   HG13  VAL  38          HG13      VAL  38  15.196  21.574 -29.941
  285   HG21  VAL  38          HG21      VAL  38  16.100  24.795 -32.611
  286   HG22  VAL  38          HG22      VAL  38  17.328  23.894 -31.726
  287   HG23  VAL  38          HG23      VAL  38  16.471  23.144 -33.094
  288    H    GLY  39           H        GLY  39  13.419  20.734 -31.133
  289    HA2  GLY  39           HA2      GLY  39  11.317  21.596 -29.247
  290    HA3  GLY  39           HA3      GLY  39  10.753  20.710 -30.653
  291    H    ILE  40           H        ILE  40  10.090  19.730 -28.362
  292    HA   ILE  40           HA       ILE  40  11.776  17.306 -27.992
  293    HB   ILE  40           HB       ILE  40  10.601  18.844 -25.654
  294   HG12  ILE  40          HG12      ILE  40  13.480  18.779 -26.643
  295   HG13  ILE  40          HG13      ILE  40  12.415  20.184 -26.589
  296   HG21  ILE  40          HG21      ILE  40  11.925  17.222 -24.317
  297   HG22  ILE  40          HG22      ILE  40  10.792  16.383 -25.351
  298   HG23  ILE  40          HG23      ILE  40  12.504  16.452 -25.808
  299   HD11  ILE  40          HD11      ILE  40  13.643  18.755 -24.234
  300   HD12  ILE  40          HD12      ILE  40  13.890  20.419 -24.773
  301   HD13  ILE  40          HD13      ILE  40  12.318  19.948 -24.087
  302    H    HIS  41           H        HIS  41  10.692  15.569 -28.213
  303    HA   HIS  41           HA       HIS  41   7.753  15.485 -28.147
  304    HB2  HIS  41           HB2      HIS  41   8.841  14.541 -30.124
  305    HB3  HIS  41           HB3      HIS  41   9.886  13.544 -29.121
  306    HD1  HIS  41           HD1      HIS  41   8.815  11.306 -28.139
  307    HD2  HIS  41           HD2      HIS  41   6.131  13.912 -30.041
  308    HE1  HIS  41           HE1      HIS  41   6.569  10.161 -28.102
  309    H    PHE  42           H        PHE  42   6.685  13.941 -26.830
  310    HA   PHE  42           HA       PHE  42   8.170  12.827 -24.479
  311    HB2  PHE  42           HB2      PHE  42   5.835  14.760 -24.522
  312    HB3  PHE  42           HB3      PHE  42   6.215  13.763 -23.131
  313    HD1  PHE  42           HD1      PHE  42   8.191  14.116 -21.763
  314    HD2  PHE  42           HD2      PHE  42   7.317  16.714 -25.106
  315    HE1  PHE  42           HE1      PHE  42   9.746  15.821 -20.852
  316    HE2  PHE  42           HE2      PHE  42   8.872  18.405 -24.177
  317    HZ   PHE  42           HZ       PHE  42  10.070  17.972 -22.051
  318    H    SER  43           H        SER  43   7.368  11.034 -23.565
  319    HA   SER  43           HA       SER  43   4.690   9.995 -24.348
  320    HB2  SER  43           HB2      SER  43   5.460   7.815 -24.595
  321    HB3  SER  43           HB3      SER  43   6.674   8.775 -25.453
  322    HG   SER  43           HG       SER  43   7.657   7.257 -24.098
  323    H    ASP  44           H        ASP  44   4.223   8.063 -22.654
  324    HA   ASP  44           HA       ASP  44   4.214   9.299 -20.016
  325    HB2  ASP  44           HB2      ASP  44   2.355   7.930 -21.144
  326    HB3  ASP  44           HB3      ASP  44   3.310   6.499 -20.757
  327    H    SER  45           H        SER  45   6.668   7.745 -21.564
  328    HA   SER  45           HA       SER  45   7.850   6.582 -19.065
  329    HB2  SER  45           HB2      SER  45   7.848   5.319 -21.831
  330    HB3  SER  45           HB3      SER  45   8.686   4.693 -20.400
  331    HG   SER  45           HG       SER  45   6.662   3.676 -20.738
  332    H    ALA  46           H        ALA  46   8.452   8.405 -22.030
  333    HA   ALA  46           HA       ALA  46  11.206   8.977 -21.156
  334    HB1  ALA  46           HB1      ALA  46  11.421   6.900 -22.519
  335    HB2  ALA  46           HB2      ALA  46  10.591   7.707 -23.868
  336    HB3  ALA  46           HB3      ALA  46  12.182   8.277 -23.321
  337    H    TRP  47           H        TRP  47  12.248  10.473 -22.830
  338    HA   TRP  47           HA       TRP  47  10.382  12.281 -24.260
  339    HB2  TRP  47           HB2      TRP  47  11.628  14.237 -23.308
  340    HB3  TRP  47           HB3      TRP  47  10.603  13.380 -22.170
  341    HD1  TRP  47           HD1      TRP  47  14.195  14.345 -22.741
  342    HE1  TRP  47           HE1      TRP  47  15.605  13.719 -20.685
  343    HE3  TRP  47           HE3      TRP  47  10.748  11.525 -20.196
  344    HZ2  TRP  47           HZ2      TRP  47  15.324  12.096 -18.326
  345    HZ3  TRP  47           HZ3      TRP  47  11.377  10.397 -18.077
  346    HH2  TRP  47           HH2      TRP  47  13.649  10.687 -17.121
  347    H    ARG  48           H        ARG  48  11.350  13.345 -26.001
  348    HA   ARG  48           HA       ARG  48  14.027  12.382 -26.909
  349    HB2  ARG  48           HB2      ARG  48  12.304  10.733 -27.606
  350    HB3  ARG  48           HB3      ARG  48  11.326  12.023 -28.284
  351    HG2  ARG  48           HG2      ARG  48  13.304  12.464 -29.909
  352    HG3  ARG  48           HG3      ARG  48  13.947  10.916 -29.352
  353    HD2  ARG  48           HD2      ARG  48  11.226  11.433 -30.637
  354    HD3  ARG  48           HD3      ARG  48  12.620  10.705 -31.437
  355    HE   ARG  48           HE       ARG  48  12.366   8.906 -29.529
  356   HH11  ARG  48          HH11      ARG  48   9.640  10.294 -31.339
  357   HH12  ARG  48          HH12      ARG  48   8.724   8.804 -31.073
  358   HH21  ARG  48          HH21      ARG  48  10.969   7.135 -29.301
  359   HH22  ARG  48          HH22      ARG  48   9.383   7.251 -30.064
  360    H    ILE  49           H        ILE  49  15.171  14.058 -27.478
  361    HA   ILE  49           HA       ILE  49  13.863  16.591 -28.224
  362    HB   ILE  49           HB       ILE  49  16.833  15.951 -28.109
  363   HG12  ILE  49          HG12      ILE  49  14.815  16.865 -26.012
  364   HG13  ILE  49          HG13      ILE  49  15.878  15.465 -25.949
  365   HG21  ILE  49          HG21      ILE  49  16.270  17.987 -29.429
  366   HG22  ILE  49          HG22      ILE  49  15.304  18.605 -28.076
  367   HG23  ILE  49          HG23      ILE  49  17.059  18.421 -27.922
  368   HD11  ILE  49          HD11      ILE  49  16.658  18.384 -25.620
  369   HD12  ILE  49          HD12      ILE  49  16.665  17.089 -24.417
  370   HD13  ILE  49          HD13      ILE  49  17.836  17.044 -25.759
  371    H    MET  50           H        MET  50  13.779  17.521 -30.217
  372    HA   MET  50           HA       MET  50  14.853  16.039 -32.550
  373    HB2  MET  50           HB2      MET  50  11.948  16.931 -32.325
  374    HB3  MET  50           HB3      MET  50  12.740  16.225 -33.743
  375    HG2  MET  50           HG2      MET  50  13.355  14.299 -32.001
  376    HG3  MET  50           HG3      MET  50  11.939  14.905 -31.163
  377    HE1  MET  50           HE1      MET  50   9.110  14.208 -33.840
  378    HE2  MET  50           HE2      MET  50   9.517  14.974 -32.289
  379    HE3  MET  50           HE3      MET  50  10.064  15.705 -33.816
  380    H    VAL  51           H        VAL  51  14.988  17.241 -34.461
  381    HA   VAL  51           HA       VAL  51  15.166  20.208 -34.160
  382    HB   VAL  51           HB       VAL  51  17.140  18.873 -33.254
  383   HG11  VAL  51          HG11      VAL  51  17.761  18.285 -36.167
  384   HG12  VAL  51          HG12      VAL  51  18.784  17.941 -34.765
  385   HG13  VAL  51          HG13      VAL  51  17.245  17.095 -34.960
  386   HG21  VAL  51          HG21      VAL  51  17.979  20.728 -35.466
  387   HG22  VAL  51          HG22      VAL  51  17.348  21.233 -33.864
  388   HG23  VAL  51          HG23      VAL  51  18.820  20.288 -33.965
  389    HA   PRO  52           HA       PRO  52  14.319  20.124 -38.634
  390    HB2  PRO  52           HB2      PRO  52  16.111  22.036 -39.619
  391    HB3  PRO  52           HB3      PRO  52  14.522  22.389 -38.891
  392    HG2  PRO  52           HG2      PRO  52  17.232  22.320 -37.510
  393    HG3  PRO  52           HG3      PRO  52  16.020  23.633 -37.440
  394    HD2  PRO  52           HD2      PRO  52  16.064  21.912 -35.449
  395    HD3  PRO  52           HD3      PRO  52  14.492  22.222 -36.198
  396    H    GLY  53           H        GLY  53  15.052  18.975 -40.349
  397    HA2  GLY  53           HA2      GLY  53  17.949  18.169 -40.524
  398    HA3  GLY  53           HA3      GLY  53  16.624  17.027 -40.729
  399    H    LYS  54           H        LYS  54  15.258  19.466 -42.238
  400    HA   LYS  54           HA       LYS  54  16.776  19.869 -44.663
  401    HB2  LYS  54           HB2      LYS  54  15.786  17.534 -44.963
  402    HB3  LYS  54           HB3      LYS  54  14.179  18.256 -44.867
  403    HG2  LYS  54           HG2      LYS  54  14.634  19.582 -46.899
  404    HG3  LYS  54           HG3      LYS  54  16.302  18.970 -46.940
  405    HD2  LYS  54           HD2      LYS  54  15.439  16.663 -47.251
  406    HD3  LYS  54           HD3      LYS  54  13.772  17.279 -47.198
  407    HE2  LYS  54           HE2      LYS  54  14.239  18.701 -49.183
  408    HE3  LYS  54           HE3      LYS  54  15.899  18.097 -49.232
  409    HZ1  LYS  54           HZ1      LYS  54  14.473  16.889 -50.784
  410    HZ2  LYS  54           HZ2      LYS  54  15.002  15.862 -49.638
  411    HZ3  LYS  54           HZ3      LYS  54  13.468  16.419 -49.593
  412    H    THR  55           H        THR  55  15.759  21.514 -45.951
  413    HA   THR  55           HA       THR  55  14.955  23.663 -45.928
  414    HB   THR  55           HB       THR  55  13.641  22.439 -47.425
  415    HG1  THR  55           HG1      THR  55  11.976  23.890 -47.572
  416   HG21  THR  55          HG21      THR  55  11.363  21.678 -47.004
  417   HG22  THR  55          HG22      THR  55  12.514  20.769 -46.019
  418   HG23  THR  55          HG23      THR  55  11.523  22.035 -45.275
  419    HA   PRO  56           HA       PRO  56  13.953  24.514 -41.467
  420    HB2  PRO  56           HB2      PRO  56  16.015  26.600 -42.157
  421    HB3  PRO  56           HB3      PRO  56  15.773  25.709 -40.622
  422    HG2  PRO  56           HG2      PRO  56  17.781  25.017 -42.305
  423    HG3  PRO  56           HG3      PRO  56  16.798  23.751 -41.498
  424    HD2  PRO  56           HD2      PRO  56  16.530  24.818 -44.317
  425    HD3  PRO  56           HD3      PRO  56  16.529  23.127 -43.734
  426    H    SER  57           H        SER  57  14.187  26.305 -44.494
  427    HA   SER  57           HA       SER  57  12.710  28.629 -44.016
  428    HB2  SER  57           HB2      SER  57  12.695  26.864 -46.495
  429    HB3  SER  57           HB3      SER  57  12.304  28.595 -46.423
  430    HG   SER  57           HG       SER  57  14.458  28.239 -47.101
  431    H    ALA  58           H        ALA  58  11.484  25.383 -43.886
  432    HA   ALA  58           HA       ALA  58   8.679  26.403 -43.820
  433    HB1  ALA  58           HB1      ALA  58   7.981  24.371 -45.034
  434    HB2  ALA  58           HB2      ALA  58   9.071  25.381 -45.998
  435    HB3  ALA  58           HB3      ALA  58   9.691  23.904 -45.238
  436    H    TRP  59           H        TRP  59   9.086  23.016 -43.449
  437    HA   TRP  59           HA       TRP  59   9.285  23.033 -40.502
  438    HB2  TRP  59           HB2      TRP  59   6.974  23.631 -40.791
  439    HB3  TRP  59           HB3      TRP  59   6.745  22.430 -42.047
  440    HD1  TRP  59           HD1      TRP  59   6.273  19.967 -41.362
  441    HE1  TRP  59           HE1      TRP  59   5.369  18.898 -39.216
  442    HE3  TRP  59           HE3      TRP  59   7.313  23.755 -38.063
  443    HZ2  TRP  59           HZ2      TRP  59   4.983  19.649 -36.460
  444    HZ3  TRP  59           HZ3      TRP  59   6.659  23.542 -35.675
  445    HH2  TRP  59           HH2      TRP  59   5.475  21.513 -34.866
  446    H    ARG  60           H        ARG  60  10.615  21.404 -40.107
  447    HA   ARG  60           HA       ARG  60   9.932  18.674 -40.987
  448    HB2  ARG  60           HB2      ARG  60  11.512  19.589 -42.731
  449    HB3  ARG  60           HB3      ARG  60  12.678  19.923 -41.460
  450    HG2  ARG  60           HG2      ARG  60  13.243  17.947 -42.766
  451    HG3  ARG  60           HG3      ARG  60  13.024  17.521 -41.077
  452    HD2  ARG  60           HD2      ARG  60  10.986  16.359 -41.520
  453    HD3  ARG  60           HD3      ARG  60  10.725  17.236 -43.026
  454    HE   ARG  60           HE       ARG  60  12.076  15.791 -44.181
  455   HH11  ARG  60          HH11      ARG  60  12.484  14.862 -40.760
  456   HH12  ARG  60          HH12      ARG  60  13.367  13.454 -41.241
  457   HH21  ARG  60          HH21      ARG  60  13.200  13.972 -44.598
  458   HH22  ARG  60          HH22      ARG  60  13.754  12.965 -43.301
  459    H    TRP  61           H        TRP  61  10.788  17.080 -39.622
  460    HA   TRP  61           HA       TRP  61  12.430  17.928 -37.289
  461    HB2  TRP  61           HB2      TRP  61   9.865  16.291 -37.222
  462    HB3  TRP  61           HB3      TRP  61  10.985  16.462 -35.873
  463    HD1  TRP  61           HD1      TRP  61   8.009  18.094 -37.341
  464    HE1  TRP  61           HE1      TRP  61   7.594  20.416 -36.318
  465    HE3  TRP  61           HE3      TRP  61  12.438  18.682 -34.878
  466    HZ2  TRP  61           HZ2      TRP  61   9.004  22.281 -34.612
  467    HZ3  TRP  61           HZ3      TRP  61  12.894  20.742 -33.578
  468    HH2  TRP  61           HH2      TRP  61  11.198  22.542 -33.436
  469    H    VAL  62           H        VAL  62  13.871  16.486 -36.570
  470    HA   VAL  62           HA       VAL  62  13.732  13.637 -37.254
  471    HB   VAL  62           HB       VAL  62  15.100  14.671 -39.044
  472   HG11  VAL  62          HG11      VAL  62  16.151  16.547 -37.882
  473   HG12  VAL  62          HG12      VAL  62  17.103  15.423 -36.885
  474   HG13  VAL  62          HG13      VAL  62  17.354  15.506 -38.638
  475   HG21  VAL  62          HG21      VAL  62  15.507  12.342 -38.348
  476   HG22  VAL  62          HG22      VAL  62  16.960  13.135 -38.966
  477   HG23  VAL  62          HG23      VAL  62  16.768  12.910 -37.220
  478    HA   PRO  63           HA       PRO  63  14.995  13.503 -32.913
  479    HB2  PRO  63           HB2      PRO  63  16.529  11.045 -33.731
  480    HB3  PRO  63           HB3      PRO  63  15.437  11.300 -32.330
  481    HG2  PRO  63           HG2      PRO  63  14.559   9.949 -34.498
  482    HG3  PRO  63           HG3      PRO  63  13.501  11.146 -33.683
  483    HD2  PRO  63           HD2      PRO  63  15.138  11.489 -36.192
  484    HD3  PRO  63           HD3      PRO  63  13.457  12.010 -35.854
  485    H    LEU  64           H        LEU  64  16.596  14.530 -31.847
  486    HA   LEU  64           HA       LEU  64  18.820  15.636 -33.260
  487    HB2  LEU  64           HB2      LEU  64  17.659  16.839 -31.491
  488    HB3  LEU  64           HB3      LEU  64  18.067  15.588 -30.316
  489    HG   LEU  64           HG       LEU  64  20.475  16.170 -30.499
  490   HD11  LEU  64          HD11      LEU  64  20.548  17.052 -32.806
  491   HD12  LEU  64          HD12      LEU  64  19.526  18.423 -32.314
  492   HD13  LEU  64          HD13      LEU  64  21.163  18.227 -31.640
  493   HD21  LEU  64          HD21      LEU  64  19.076  17.264 -28.801
  494   HD22  LEU  64          HD22      LEU  64  20.357  18.338 -29.376
  495   HD23  LEU  64          HD23      LEU  64  18.692  18.573 -29.949
  496    H    GLN  65           H        GLN  65  20.390  14.214 -33.979
  497    HA   GLN  65           HA       GLN  65  21.778  12.505 -31.953
  498    HB2  GLN  65           HB2      GLN  65  20.598  11.504 -34.569
  499    HB3  GLN  65           HB3      GLN  65  21.788  10.632 -33.601
  500    HG2  GLN  65           HG2      GLN  65  20.148  10.797 -31.633
  501    HG3  GLN  65           HG3      GLN  65  18.950  11.329 -32.818
  502   HE21  GLN  65          HE22      GLN  65  17.857   9.295 -31.905
  503   HE22  GLN  65          HE21      GLN  65  18.248   7.793 -32.740
  504    H    GLU  66           H        GLU  66  22.202  14.670 -34.528
  505    HA   GLU  66           HA       GLU  66  24.312  13.636 -35.990
  506    HB2  GLU  66           HB2      GLU  66  24.056  16.567 -35.222
  507    HB3  GLU  66           HB3      GLU  66  24.876  15.885 -36.623
  508    HG2  GLU  66           HG2      GLU  66  22.938  16.505 -37.638
  509    HG3  GLU  66           HG3      GLU  66  22.476  14.870 -37.181
  510    H    ASP  67           H        ASP  67  24.579  14.993 -32.774
  511    HA   ASP  67           HA       ASP  67  27.247  13.771 -32.542
  512    HB2  ASP  67           HB2      ASP  67  27.567  16.241 -33.002
  513    HB3  ASP  67           HB3      ASP  67  26.640  16.598 -31.546
  514    H    ALA  68           H        ALA  68  24.683  12.931 -31.870
  515    HA   ALA  68           HA       ALA  68  24.891  12.304 -29.005
  516    HB1  ALA  68           HB1      ALA  68  23.584  14.382 -28.975
  517    HB2  ALA  68           HB2      ALA  68  22.484  13.754 -30.214
  518    HB3  ALA  68           HB3      ALA  68  22.521  13.015 -28.602
  519    H    ALA  69           H        ALA  69  25.510  10.709 -31.085
  520    HA   ALA  69           HA       ALA  69  23.627   9.490 -32.618
  521    HB1  ALA  69           HB1      ALA  69  26.155   8.251 -31.468
  522    HB2  ALA  69           HB2      ALA  69  25.263   7.658 -32.885
  523    HB3  ALA  69           HB3      ALA  69  26.030   9.257 -32.931
  524    H    ASP  70           H        ASP  70  21.928   8.174 -32.313
  525    HA   ASP  70           HA       ASP  70  20.339   6.926 -31.402
  526    HB2  ASP  70           HB2      ASP  70  22.194   5.274 -31.806
  527    HB3  ASP  70           HB3      ASP  70  22.553   5.339 -30.083
  528    H    GLU  71           H        GLU  71  21.578   9.160 -29.474
  529    HA   GLU  71           HA       GLU  71  19.977   8.312 -27.095
  530    HB2  GLU  71           HB2      GLU  71  21.521   9.367 -25.623
  531    HB3  GLU  71           HB3      GLU  71  22.303   8.115 -26.573
  532    HG2  GLU  71           HG2      GLU  71  23.402   9.764 -27.977
  533    HG3  GLU  71           HG3      GLU  71  22.510  11.084 -27.213
  534    H    SER  72           H        SER  72  19.072   9.882 -29.424
  535    HA   SER  72           HA       SER  72  18.429  12.555 -28.558
  536    HB2  SER  72           HB2      SER  72  16.496  12.255 -30.181
  537    HB3  SER  72           HB3      SER  72  18.103  11.993 -30.854
  538    HG   SER  72           HG       SER  72  16.105  10.096 -30.322
  539    H    GLN  73           H        GLN  73  16.914   9.404 -28.065
  540    HA   GLN  73           HA       GLN  73  14.851  10.559 -26.300
  541    HB2  GLN  73           HB2      GLN  73  13.715   8.572 -26.294
  542    HB3  GLN  73           HB3      GLN  73  14.252   8.763 -27.952
  543    HG2  GLN  73           HG2      GLN  73  15.462   6.888 -25.866
  544    HG3  GLN  73           HG3      GLN  73  14.362   6.436 -27.153
  545   HE21  GLN  73          HE22      GLN  73  17.653   7.505 -26.448
  546   HE22  GLN  73          HE21      GLN  73  18.345   6.867 -27.956
  547    H    ASN  74           H        ASN  74  14.790  10.310 -24.085
  548    HA   ASN  74           HA       ASN  74  17.225   9.169 -22.776
  549    HB2  ASN  74           HB2      ASN  74  16.183  12.024 -22.764
  550    HB3  ASN  74           HB3      ASN  74  17.214  11.401 -21.480
  551   HD21  ASN  74          HD22      ASN  74  17.151  12.361 -24.899
  552   HD22  ASN  74          HD21      ASN  74  18.846  12.028 -25.174
  553    H    ASP  75           H        ASP  75  17.196   8.995 -20.560
  554    HA   ASP  75           HA       ASP  75  14.674   8.689 -19.070
  555    HB2  ASP  75           HB2      ASP  75  14.782   6.730 -20.594
  556    HB3  ASP  75           HB3      ASP  75  16.396   6.348 -20.006
  557    H    TRP  76           H        TRP  76  16.475  10.407 -18.353
  558    HA   TRP  76           HA       TRP  76  18.904   9.746 -17.167
  559    HB2  TRP  76           HB2      TRP  76  17.066  12.119 -16.698
  560    HB3  TRP  76           HB3      TRP  76  18.774  12.084 -16.285
  561    HD1  TRP  76           HD1      TRP  76  19.955  10.821 -18.937
  562    HE1  TRP  76           HE1      TRP  76  20.024  12.180 -21.104
  563    HE3  TRP  76           HE3      TRP  76  16.394  14.337 -17.810
  564    HZ2  TRP  76           HZ2      TRP  76  18.789  14.551 -22.174
  565    HZ3  TRP  76           HZ3      TRP  76  15.814  16.071 -19.469
  566    HH2  TRP  76           HH2      TRP  76  17.001  16.208 -21.644
  567    H    ASP  77           H        ASP  77  16.647   8.176 -15.768
  568    HA   ASP  77           HA       ASP  77  17.510   8.684 -12.978
  569    HB2  ASP  77           HB2      ASP  77  15.352   9.054 -12.121
  570    HB3  ASP  77           HB3      ASP  77  15.475  10.126 -13.504
  571    H    GLU  78           H        GLU  78  16.224   7.121 -11.476
  572    HA   GLU  78           HA       GLU  78  15.744   4.453 -12.673
  573    HB2  GLU  78           HB2      GLU  78  17.209   3.349 -11.114
  574    HB3  GLU  78           HB3      GLU  78  18.123   4.591 -11.965
  575    HG2  GLU  78           HG2      GLU  78  17.618   6.116  -9.912
  576    HG3  GLU  78           HG3      GLU  78  17.135   4.632  -9.092
  577    H    GLU  79           H        GLU  79  14.057   6.670 -11.409
  578    HA   GLU  79           HA       GLU  79  12.638   5.091  -9.321
  579    HB2  GLU  79           HB2      GLU  79  13.796   7.858  -8.796
  580    HB3  GLU  79           HB3      GLU  79  12.723   6.992  -7.709
  581    HG2  GLU  79           HG2      GLU  79  15.562   6.216  -8.407
  582    HG3  GLU  79           HG3      GLU  79  14.989   6.951  -6.922
  583    H    LEU  80           H        LEU  80  12.317   7.131 -11.997
  584    HA   LEU  80           HA       LEU  80   9.804   8.392 -10.971
  585    HB2  LEU  80           HB2      LEU  80  11.549   9.306 -13.271
  586    HB3  LEU  80           HB3      LEU  80  10.250  10.186 -12.501
  587    HG   LEU  80           HG       LEU  80  13.000   9.641 -11.290
  588   HD11  LEU  80          HD11      LEU  80  11.679  12.219 -12.151
  589   HD12  LEU  80          HD12      LEU  80  13.344  11.960 -11.564
  590   HD13  LEU  80          HD13      LEU  80  12.857  11.305 -13.121
  591   HD21  LEU  80          HD21      LEU  80  10.536  11.035 -10.183
  592   HD22  LEU  80          HD22      LEU  80  11.371   9.638  -9.477
  593   HD23  LEU  80          HD23      LEU  80  12.175  11.213  -9.513
  594    H    SER  81           H        SER  81   8.167   8.833 -12.360
  595    HA   SER  81           HA       SER  81   8.006   7.639 -15.083
  596    HB2  SER  81           HB2      SER  81   6.700   6.294 -13.404
  597    HB3  SER  81           HB3      SER  81   5.764   7.754 -13.015
  598    HG   SER  81           HG       SER  81   4.812   6.355 -14.641
  599    H    ILE  82           H        ILE  82   7.364   9.186 -16.571
  600    HA   ILE  82           HA       ILE  82   6.946  11.952 -15.536
  601    HB   ILE  82           HB       ILE  82   8.499  10.759 -17.805
  602   HG12  ILE  82          HG12      ILE  82  10.027  12.659 -17.279
  603   HG13  ILE  82          HG13      ILE  82   8.903  13.221 -16.047
  604   HG21  ILE  82          HG21      ILE  82   7.219  13.510 -18.055
  605   HG22  ILE  82          HG22      ILE  82   8.560  12.908 -19.048
  606   HG23  ILE  82          HG23      ILE  82   6.998  12.110 -19.132
  607   HD11  ILE  82          HD11      ILE  82  10.907  11.957 -15.192
  608   HD12  ILE  82          HD12      ILE  82   9.357  11.275 -14.665
  609   HD13  ILE  82          HD13      ILE  82  10.280  10.499 -15.976
  610    H    HIS  83           H        HIS  83   5.240  13.123 -16.104
  611    HA   HIS  83           HA       HIS  83   3.329  12.104 -18.169
  612    HB2  HIS  83           HB2      HIS  83   2.526  13.302 -15.500
  613    HB3  HIS  83           HB3      HIS  83   1.475  12.580 -16.714
  614    HD1  HIS  83           HD1      HIS  83   2.359   9.690 -17.098
  615    HD2  HIS  83           HD2      HIS  83   2.972  11.778 -13.481
  616    HE1  HIS  83           HE1      HIS  83   2.704   7.940 -15.306
  617    H    LEU  84           H        LEU  84   2.649  13.652 -19.579
  618    HA   LEU  84           HA       LEU  84   3.668  16.415 -19.178
  619    HB2  LEU  84           HB2      LEU  84   4.520  14.558 -20.912
  620    HB3  LEU  84           HB3      LEU  84   3.156  15.114 -21.853
  621    HG   LEU  84           HG       LEU  84   5.311  16.021 -22.455
  622   HD11  LEU  84          HD11      LEU  84   3.221  17.368 -22.874
  623   HD12  LEU  84          HD12      LEU  84   3.684  18.373 -21.475
  624   HD13  LEU  84          HD13      LEU  84   4.746  18.271 -22.881
  625   HD21  LEU  84          HD21      LEU  84   6.341  16.157 -20.213
  626   HD22  LEU  84          HD22      LEU  84   6.564  17.611 -21.194
  627   HD23  LEU  84          HD23      LEU  84   5.370  17.615 -19.883
  628    H    GLN  85           H        GLN  85   2.506  18.159 -19.819
  629    HA   GLN  85           HA       GLN  85  -0.365  17.906 -20.544
  630    HB2  GLN  85           HB2      GLN  85   0.791  19.410 -18.137
  631    HB3  GLN  85           HB3      GLN  85  -0.856  19.520 -18.710
  632    HG2  GLN  85           HG2      GLN  85  -0.930  18.162 -16.812
  633    HG3  GLN  85           HG3      GLN  85  -1.207  17.104 -18.191
  634   HE21  GLN  85          HE22      GLN  85   2.152  18.119 -17.249
  635   HE22  GLN  85          HE21      GLN  85   2.560  16.502 -16.700
  636    HA   PRO  86           HA       PRO  86  -2.083  19.406 -20.867
  637    HB2  PRO  86           HB2      PRO  86  -3.308  20.832 -22.817
  638    HB3  PRO  86           HB3      PRO  86  -2.850  21.575 -21.254
  639    HG2  PRO  86           HG2      PRO  86  -1.317  21.678 -23.877
  640    HG3  PRO  86           HG3      PRO  86  -1.760  23.043 -22.801
  641    HD2  PRO  86           HD2      PRO  86   0.692  21.821 -22.692
  642    HD3  PRO  86           HD3      PRO  86  -0.108  22.465 -21.232
  643    H    PHE  87           H        PHE  87   0.196  19.420 -23.477
  644    HA   PHE  87           HA       PHE  87  -1.154  17.966 -25.500
  645    HB2  PHE  87           HB2      PHE  87   1.818  17.960 -24.854
  646    HB3  PHE  87           HB3      PHE  87   1.061  17.591 -26.396
  647    HD1  PHE  87           HD2      PHE  87  -0.083  19.429 -27.711
  648    HD2  PHE  87           HD1      PHE  87   2.383  20.219 -24.255
  649    HE1  PHE  87           HE2      PHE  87   0.221  21.779 -28.459
  650    HE2  PHE  87           HE1      PHE  87   2.665  22.570 -25.001
  651    HZ   PHE  87           HZ       PHE  87   1.619  23.337 -27.120
  652    H    LYS  88           H        LYS  88  -1.541  15.866 -25.786
  653    HA   LYS  88           HA       LYS  88  -1.236  13.932 -23.727
  654    HB2  LYS  88           HB2      LYS  88  -1.884  12.264 -25.562
  655    HB3  LYS  88           HB3      LYS  88  -3.012  13.519 -25.108
  656    HG2  LYS  88           HG2      LYS  88  -3.054  13.101 -27.478
  657    HG3  LYS  88           HG3      LYS  88  -2.612  14.764 -27.139
  658    HD2  LYS  88           HD2      LYS  88  -0.318  14.388 -27.772
  659    HD3  LYS  88           HD3      LYS  88  -0.538  12.633 -27.840
  660    HE2  LYS  88           HE2      LYS  88  -2.068  14.591 -29.610
  661    HE3  LYS  88           HE3      LYS  88  -0.489  13.940 -30.054
  662    HZ1  LYS  88           HZ1      LYS  88  -2.882  12.262 -29.525
  663    HZ2  LYS  88           HZ2      LYS  88  -2.269  12.598 -30.999
  664    HZ3  LYS  88           HZ3      LYS  88  -1.391  11.706 -29.943
  665    HA   PRO  89           HA       PRO  89   2.815  12.133 -24.570
  666    HB2  PRO  89           HB2      PRO  89   2.505   9.671 -23.408
  667    HB3  PRO  89           HB3      PRO  89   2.703  11.176 -22.452
  668    HG2  PRO  89           HG2      PRO  89   0.151   9.696 -23.138
  669    HG3  PRO  89           HG3      PRO  89   0.654  10.371 -21.557
  670    HD2  PRO  89           HD2      PRO  89  -1.044  11.678 -23.270
  671    HD3  PRO  89           HD3      PRO  89   0.099  12.555 -22.210
  672    H    ASP  90           H        ASP  90   3.633  10.871 -26.283
  673    HA   ASP  90           HA       ASP  90   1.849   9.020 -27.766
  674    HB2  ASP  90           HB2      ASP  90   1.550  11.661 -28.286
  675    HB3  ASP  90           HB3      ASP  90   2.940  11.380 -29.303
  676    H    ASP  91           H        ASP  91   3.237   9.145 -30.178
  677    HA   ASP  91           HA       ASP  91   6.124   8.883 -29.811
  678    HB2  ASP  91           HB2      ASP  91   5.272   6.564 -29.452
  679    HB3  ASP  91           HB3      ASP  91   4.534   6.614 -31.058
  680    H    SER  92           H        SER  92   4.778  10.943 -30.762
  681    HA   SER  92           HA       SER  92   3.756  10.871 -33.425
  682    HB2  SER  92           HB2      SER  92   3.038  12.476 -31.677
  683    HB3  SER  92           HB3      SER  92   4.645  13.212 -31.704
  684    HG   SER  92           HG       SER  92   2.594  13.318 -33.618
  685    H    ASN  93           H        ASN  93   4.439  11.951 -35.276
  686    HA   ASN  93           HA       ASN  93   7.263  11.887 -35.978
  687    HB2  ASN  93           HB2      ASN  93   5.354  11.340 -37.529
  688    HB3  ASN  93           HB3      ASN  93   4.851  13.029 -37.461
  689   HD21  ASN  93          HD22      ASN  93   5.460  14.054 -39.341
  690   HD22  ASN  93          HD21      ASN  93   6.973  13.759 -40.175
  691    H    GLN  94           H        GLN  94   5.398  14.190 -34.271
  692    HA   GLN  94           HA       GLN  94   7.430  16.313 -34.813
  693    HB2  GLN  94           HB2      GLN  94   5.766  18.010 -34.627
  694    HB3  GLN  94           HB3      GLN  94   5.214  16.878 -35.842
  695    HG2  GLN  94           HG2      GLN  94   3.490  16.035 -34.429
  696    HG3  GLN  94           HG3      GLN  94   4.236  16.655 -32.957
  697   HE21  GLN  94          HE22      GLN  94   4.118  18.908 -32.428
  698   HE22  GLN  94          HE21      GLN  94   2.914  19.920 -33.224
  699    HA   PRO  95           HA       PRO  95   7.689  16.442 -30.300
  700    HB2  PRO  95           HB2      PRO  95   8.466  18.989 -29.810
  701    HB3  PRO  95           HB3      PRO  95   9.549  17.820 -30.632
  702    HG2  PRO  95           HG2      PRO  95   7.739  19.901 -31.915
  703    HG3  PRO  95           HG3      PRO  95   9.494  19.639 -32.210
  704    HD2  PRO  95           HD2      PRO  95   7.606  18.573 -33.809
  705    HD3  PRO  95           HD3      PRO  95   9.079  17.655 -33.403
  706    H    GLN  96           H        GLN  96   6.550  17.257 -28.436
  707    HA   GLN  96           HA       GLN  96   3.961  18.651 -28.955
  708    HB2  GLN  96           HB2      GLN  96   5.145  17.378 -26.441
  709    HB3  GLN  96           HB3      GLN  96   3.652  18.288 -26.495
  710    HG2  GLN  96           HG2      GLN  96   2.915  16.083 -26.588
  711    HG3  GLN  96           HG3      GLN  96   2.786  16.640 -28.254
  712   HE21  GLN  96          HE22      GLN  96   2.752  14.137 -28.578
  713   HE22  GLN  96          HE21      GLN  96   4.337  13.357 -28.648
  714    H    VAL  97           H        VAL  97   7.168  19.249 -27.565
  715    HA   VAL  97           HA       VAL  97   6.353  22.035 -26.802
  716    HB   VAL  97           HB       VAL  97   8.655  20.286 -25.849
  717   HG11  VAL  97          HG11      VAL  97   9.107  22.049 -24.195
  718   HG12  VAL  97          HG12      VAL  97   9.351  22.657 -25.829
  719   HG13  VAL  97          HG13      VAL  97   7.873  23.086 -24.936
  720   HG21  VAL  97          HG21      VAL  97   7.469  20.403 -23.658
  721   HG22  VAL  97          HG22      VAL  97   6.124  21.249 -24.451
  722   HG23  VAL  97          HG23      VAL  97   6.514  19.571 -24.886
  723    H    VAL  98           H        VAL  98   7.322  23.750 -27.790
  724    HA   VAL  98           HA       VAL  98   9.635  23.249 -29.627
  725    HB   VAL  98           HB       VAL  98   7.086  24.738 -30.339
  726   HG11  VAL  98          HG11      VAL  98   9.666  24.399 -31.926
  727   HG12  VAL  98          HG12      VAL  98   8.138  25.028 -32.579
  728   HG13  VAL  98          HG13      VAL  98   8.980  25.932 -31.325
  729   HG21  VAL  98          HG21      VAL  98   6.941  23.052 -32.162
  730   HG22  VAL  98          HG22      VAL  98   8.372  22.229 -31.500
  731   HG23  VAL  98          HG23      VAL  98   6.855  22.293 -30.573
  732    H    ILE  99           H        ILE  99  11.083  24.798 -29.811
  733    HA   ILE  99           HA       ILE  99  11.043  27.049 -27.847
  734    HB   ILE  99           HB       ILE  99  13.353  25.337 -28.894
  735   HG12  ILE  99          HG12      ILE  99  13.606  24.826 -26.347
  736   HG13  ILE  99          HG13      ILE  99  11.903  25.239 -26.227
  737   HG21  ILE  99          HG21      ILE  99  13.359  27.575 -26.814
  738   HG22  ILE  99          HG22      ILE  99  14.727  26.542 -27.315
  739   HG23  ILE  99          HG23      ILE  99  14.038  27.675 -28.445
  740   HD11  ILE  99          HD11      ILE  99  11.325  23.380 -27.732
  741   HD12  ILE  99          HD12      ILE  99  13.053  23.065 -28.030
  742   HD13  ILE  99          HD13      ILE  99  12.349  22.798 -26.428
  743    H    LEU 100           H        LEU 100  11.120  29.022 -28.750
  744    HA   LEU 100           HA       LEU 100  11.965  29.304 -31.587
  745    HB2  LEU 100           HB2      LEU 100  10.820  31.427 -29.769
  746    HB3  LEU 100           HB3      LEU 100  11.018  31.505 -31.511
  747    HG   LEU 100           HG       LEU 100   8.990  29.886 -29.930
  748   HD11  LEU 100          HD11      LEU 100   8.520  32.298 -30.495
  749   HD12  LEU 100          HD12      LEU 100   8.675  31.894 -32.206
  750   HD13  LEU 100          HD13      LEU 100   7.379  31.165 -31.233
  751   HD21  LEU 100          HD21      LEU 100   8.132  29.015 -32.078
  752   HD22  LEU 100          HD22      LEU 100   9.520  29.730 -32.925
  753   HD23  LEU 100          HD23      LEU 100   9.755  28.408 -31.752
  754    H    ALA 101           H        ALA 101  13.336  31.022 -32.199
  755    HA   ALA 101           HA       ALA 101  15.900  30.653 -31.224
  756    HB1  ALA 101           HB1      ALA 101  16.490  32.471 -32.827
  757    HB2  ALA 101           HB2      ALA 101  15.344  31.301 -33.516
  758    HB3  ALA 101           HB3      ALA 101  14.777  32.894 -32.952
  759    H    ASP 102           H        ASP 102  13.697  33.116 -30.022
  760    HA   ASP 102           HA       ASP 102  15.940  34.662 -28.836
  761    HB2  ASP 102           HB2      ASP 102  14.532  36.520 -28.842
  762    HB3  ASP 102           HB3      ASP 102  14.278  35.740 -30.398
  763    H    GLY 103           H        GLY 103  14.246  32.136 -27.764
  764    HA2  GLY 103           HA2      GLY 103  14.516  31.364 -25.549
  765    HA3  GLY 103           HA3      GLY 103  14.578  33.012 -24.938
  766    H    GLN 104           H        GLN 104  11.886  32.416 -27.049
  767    HA   GLN 104           HA       GLN 104  10.083  31.990 -24.715
  768    HB2  GLN 104           HB2      GLN 104   8.288  32.893 -25.931
  769    HB3  GLN 104           HB3      GLN 104   9.647  34.011 -26.057
  770    HG2  GLN 104           HG2      GLN 104  10.153  32.903 -28.311
  771    HG3  GLN 104           HG3      GLN 104   8.581  32.106 -28.173
  772   HE21  GLN 104          HE22      GLN 104  10.266  34.965 -29.046
  773   HE22  GLN 104          HE21      GLN 104   8.844  35.972 -29.371
  774    H    ILE 105           H        ILE 105   8.660  30.296 -24.705
  775    HA   ILE 105           HA       ILE 105   9.187  28.013 -26.561
  776    HB   ILE 105           HB       ILE 105   9.425  27.967 -23.509
  777   HG12  ILE 105          HG12      ILE 105  11.668  26.881 -23.970
  778   HG13  ILE 105          HG13      ILE 105  11.482  27.328 -25.660
  779   HG21  ILE 105          HG21      ILE 105   9.956  25.552 -23.787
  780   HG22  ILE 105          HG22      ILE 105   8.308  25.912 -24.284
  781   HG23  ILE 105          HG23      ILE 105   9.578  25.685 -25.518
  782   HD11  ILE 105          HD11      ILE 105  12.052  29.507 -25.252
  783   HD12  ILE 105          HD12      ILE 105  11.389  29.489 -23.586
  784   HD13  ILE 105          HD13      ILE 105  12.940  28.718 -23.968
  785    H    THR 106           H        THR 106   7.402  26.609 -26.776
  786    HA   THR 106           HA       THR 106   4.768  27.543 -26.481
  787    HB   THR 106           HB       THR 106   4.193  25.067 -26.648
  788    HG1  THR 106           HG1      THR 106   6.168  24.470 -25.604
  789   HG21  THR 106          HG21      THR 106   6.183  26.162 -28.666
  790   HG22  THR 106          HG22      THR 106   5.076  24.791 -28.919
  791   HG23  THR 106          HG23      THR 106   4.426  26.423 -28.674
  792    HA   PRO 107           HA       PRO 107   4.266  27.086 -21.984
  793    HB2  PRO 107           HB2      PRO 107   1.350  27.212 -22.767
  794    HB3  PRO 107           HB3      PRO 107   2.196  28.031 -21.417
  795    HG2  PRO 107           HG2      PRO 107   1.594  29.386 -23.689
  796    HG3  PRO 107           HG3      PRO 107   3.187  29.611 -22.900
  797    HD2  PRO 107           HD2      PRO 107   2.506  27.908 -25.306
  798    HD3  PRO 107           HD3      PRO 107   3.908  28.990 -25.039
  799    H    PHE 108           H        PHE 108   4.420  25.179 -20.963
  800    HA   PHE 108           HA       PHE 108   2.456  23.054 -21.264
  801    HB2  PHE 108           HB2      PHE 108   3.799  21.335 -22.041
  802    HB3  PHE 108           HB3      PHE 108   4.248  22.656 -23.087
  803    HD1  PHE 108           HD1      PHE 108   6.384  23.999 -22.454
  804    HD2  PHE 108           HD2      PHE 108   5.447  20.133 -20.811
  805    HE1  PHE 108           HE1      PHE 108   8.751  23.688 -21.888
  806    HE2  PHE 108           HE2      PHE 108   7.842  19.810 -20.234
  807    HZ   PHE 108           HZ       PHE 108   9.501  21.582 -20.779
  808    H    SER 109           H        SER 109   3.075  21.155 -19.762
  809    HA   SER 109           HA       SER 109   4.814  21.942 -17.537
  810    HB2  SER 109           HB2      SER 109   1.870  21.324 -17.086
  811    HB3  SER 109           HB3      SER 109   3.099  21.449 -15.806
  812    HG   SER 109           HG       SER 109   3.204  23.558 -17.515
  813    H    LEU 110           H        LEU 110   5.550  20.304 -16.330
  814    HA   LEU 110           HA       LEU 110   5.323  17.518 -17.414
  815    HB2  LEU 110           HB2      LEU 110   7.239  18.395 -18.417
  816    HB3  LEU 110           HB3      LEU 110   7.567  19.507 -17.102
  817    HG   LEU 110           HG       LEU 110   8.476  17.739 -15.712
  818   HD11  LEU 110          HD11      LEU 110   8.062  15.951 -18.166
  819   HD12  LEU 110          HD12      LEU 110   9.003  15.519 -16.725
  820   HD13  LEU 110          HD13      LEU 110   7.257  15.739 -16.599
  821   HD21  LEU 110          HD21      LEU 110   9.679  17.836 -18.508
  822   HD22  LEU 110          HD22      LEU 110   9.929  19.032 -17.220
  823   HD23  LEU 110          HD23      LEU 110  10.526  17.379 -17.015
  824    H    LEU 111           H        LEU 111   4.883  16.061 -15.823
  825    HA   LEU 111           HA       LEU 111   5.462  16.793 -12.984
  826    HB2  LEU 111           HB2      LEU 111   3.084  16.947 -13.666
  827    HB3  LEU 111           HB3      LEU 111   3.086  15.252 -14.125
  828    HG   LEU 111           HG       LEU 111   4.007  15.940 -11.344
  829   HD11  LEU 111          HD11      LEU 111   1.079  15.997 -12.172
  830   HD12  LEU 111          HD12      LEU 111   1.688  16.009 -10.501
  831   HD13  LEU 111          HD13      LEU 111   2.036  17.372 -11.576
  832   HD21  LEU 111          HD21      LEU 111   2.122  13.765 -12.359
  833   HD22  LEU 111          HD22      LEU 111   3.867  13.543 -12.137
  834   HD23  LEU 111          HD23      LEU 111   2.846  13.879 -10.741
  835    H    MET 112           H        MET 112   6.246  15.237 -11.643
  836    HA   MET 112           HA       MET 112   7.178  12.676 -12.893
  837    HB2  MET 112           HB2      MET 112   8.588  14.486 -10.894
  838    HB3  MET 112           HB3      MET 112   9.173  12.908 -11.441
  839    HG2  MET 112           HG2      MET 112   9.340  13.754 -13.747
  840    HG3  MET 112           HG3      MET 112   8.715  15.326 -13.234
  841    HE1  MET 112           HE1      MET 112  10.701  16.604 -14.345
  842    HE2  MET 112           HE2      MET 112  12.413  16.207 -14.073
  843    HE3  MET 112           HE3      MET 112  11.359  15.054 -14.924
  844    H    ALA 113           H        ALA 113   6.558  10.896 -11.884
  845    HA   ALA 113           HA       ALA 113   5.596  10.994  -9.053
  846    HB1  ALA 113           HB1      ALA 113   3.849   9.409  -9.714
  847    HB2  ALA 113           HB2      ALA 113   3.718  10.924 -10.629
  848    HB3  ALA 113           HB3      ALA 113   4.409   9.477 -11.400
  849    H    ASN 114           H        ASN 114   6.316   9.446  -7.718
  850    HA   ASN 114           HA       ASN 114   8.611   7.961  -8.197
  851    HB2  ASN 114           HB2      ASN 114   7.626   8.653  -5.994
  852    HB3  ASN 114           HB3      ASN 114   6.405   7.407  -6.161
  853   HD21  ASN 114          HD22      ASN 114   8.840   7.975  -4.310
  854   HD22  ASN 114          HD21      ASN 114   9.519   6.356  -4.200
  855    H    ALA 115           H        ALA 115   9.059   6.159  -9.297
  856    HA   ALA 115           HA       ALA 115   7.180   4.689 -10.780
  857    HB1  ALA 115           HB1      ALA 115   9.125   3.260 -11.320
  858    HB2  ALA 115           HB2      ALA 115   9.546   4.980 -11.368
  859    HB3  ALA 115           HB3      ALA 115  10.035   3.984  -9.976
  860    H    GLY 116           H        GLY 116   8.028   4.193  -7.438
  861    HA2  GLY 116           HA2      GLY 116   6.805   1.440  -7.412
  862    HA3  GLY 116           HA3      GLY 116   8.023   2.034  -6.288
  863    H    THR 117           H        THR 117   7.018   4.497  -5.440
  864    HA   THR 117           HA       THR 117   4.862   3.731  -3.681
  865    HB   THR 117           HB       THR 117   5.755   6.583  -4.168
  866    HG1  THR 117           HG1      THR 117   7.339   6.116  -2.588
  867   HG21  THR 117          HG21      THR 117   3.922   6.356  -2.553
  868   HG22  THR 117          HG22      THR 117   4.821   5.098  -1.677
  869   HG23  THR 117          HG23      THR 117   5.419   6.772  -1.713
  870    H    GLY 118           H        GLY 118   4.904   5.300  -6.847
  871    HA2  GLY 118           HA2      GLY 118   3.193   5.750  -8.275
  872    HA3  GLY 118           HA3      GLY 118   2.058   5.032  -7.124
  873    H    GLU 119           H        GLU 119   4.174   7.847  -6.459
  874    HA   GLU 119           HA       GLU 119   1.800   9.609  -6.187
  875    HB2  GLU 119           HB2      GLU 119   2.406   8.456  -4.071
  876    HB3  GLU 119           HB3      GLU 119   4.046   9.118  -4.182
  877    HG2  GLU 119           HG2      GLU 119   3.121  11.393  -4.128
  878    HG3  GLU 119           HG3      GLU 119   1.482  10.735  -4.034
  879    HA   PRO 120           HA       PRO 120   4.420  12.675  -8.269
  880    HB2  PRO 120           HB2      PRO 120   2.904  14.572  -6.474
  881    HB3  PRO 120           HB3      PRO 120   3.287  14.727  -8.216
  882    HG2  PRO 120           HG2      PRO 120   0.821  13.927  -7.431
  883    HG3  PRO 120           HG3      PRO 120   1.632  13.100  -8.800
  884    HD2  PRO 120           HD2      PRO 120   1.412  12.198  -5.927
  885    HD3  PRO 120           HD3      PRO 120   1.212  11.254  -7.435
  886    H    LEU 121           H        LEU 121   6.302  13.760  -7.860
  887    HA   LEU 121           HA       LEU 121   6.984  14.618  -5.095
  888    HB2  LEU 121           HB2      LEU 121   9.238  13.655  -5.238
  889    HB3  LEU 121           HB3      LEU 121   7.976  12.468  -5.117
  890    HG   LEU 121           HG       LEU 121   9.980  11.975  -6.657
  891   HD11  LEU 121          HD11      LEU 121   8.751  10.686  -8.165
  892   HD12  LEU 121          HD12      LEU 121   7.891  10.699  -6.605
  893   HD13  LEU 121          HD13      LEU 121   7.295  11.684  -7.946
  894   HD21  LEU 121          HD21      LEU 121   9.946  14.161  -7.871
  895   HD22  LEU 121          HD22      LEU 121   9.938  12.723  -8.911
  896   HD23  LEU 121          HD23      LEU 121   8.455  13.630  -8.676
  897    H    LEU 122           H        LEU 122   6.940  15.446  -8.358
  898    HA   LEU 122           HA       LEU 122   8.022  18.020  -7.784
  899    HB2  LEU 122           HB2      LEU 122  10.124  16.530  -8.305
  900    HB3  LEU 122           HB3      LEU 122   9.511  16.506  -9.951
  901    HG   LEU 122           HG       LEU 122   9.545  19.146  -9.710
  902   HD11  LEU 122          HD11      LEU 122  11.194  20.027  -8.186
  903   HD12  LEU 122          HD12      LEU 122  10.051  19.085  -7.231
  904   HD13  LEU 122          HD13      LEU 122  11.635  18.395  -7.622
  905   HD21  LEU 122          HD21      LEU 122  12.172  17.640  -9.853
  906   HD22  LEU 122          HD22      LEU 122  11.014  17.807 -11.191
  907   HD23  LEU 122          HD23      LEU 122  11.778  19.247 -10.530
  908    H    THR 123           H        THR 123   7.488  19.526  -9.395
  909    HA   THR 123           HA       THR 123   6.337  18.609 -11.956
  910    HB   THR 123           HB       THR 123   4.971  20.907 -10.582
  911    HG1  THR 123           HG1      THR 123   4.472  18.179 -10.119
  912   HG21  THR 123          HG21      THR 123   3.038  20.151 -11.894
  913   HG22  THR 123          HG22      THR 123   4.427  20.551 -12.916
  914   HG23  THR 123          HG23      THR 123   4.027  18.850 -12.587
  915    H    LEU 124           H        LEU 124   6.717  20.007 -13.613
  916    HA   LEU 124           HA       LEU 124   8.343  22.427 -13.165
  917    HB2  LEU 124           HB2      LEU 124   9.043  19.940 -14.503
  918    HB3  LEU 124           HB3      LEU 124   8.860  21.188 -15.724
  919    HG   LEU 124           HG       LEU 124  10.390  22.656 -14.369
  920   HD11  LEU 124          HD11      LEU 124  11.863  21.599 -12.710
  921   HD12  LEU 124          HD12      LEU 124  10.180  21.491 -12.182
  922   HD13  LEU 124          HD13      LEU 124  10.971  20.062 -12.872
  923   HD21  LEU 124          HD21      LEU 124  11.535  19.989 -15.305
  924   HD22  LEU 124          HD22      LEU 124  11.191  21.398 -16.334
  925   HD23  LEU 124          HD23      LEU 124  12.449  21.501 -15.094
  926    H    VAL 125           H        VAL 125   7.789  24.171 -14.379
  927    HA   VAL 125           HA       VAL 125   5.375  23.949 -16.156
  928    HB   VAL 125           HB       VAL 125   5.721  25.891 -13.846
  929   HG11  VAL 125          HG11      VAL 125   3.461  25.579 -15.871
  930   HG12  VAL 125          HG12      VAL 125   3.369  26.554 -14.393
  931   HG13  VAL 125          HG13      VAL 125   4.507  27.000 -15.658
  932   HG21  VAL 125          HG21      VAL 125   3.819  23.542 -14.245
  933   HG22  VAL 125          HG22      VAL 125   5.094  23.680 -13.015
  934   HG23  VAL 125          HG23      VAL 125   3.702  24.748 -12.942
  935    H    CYS 126           H        CYS 126   5.465  25.027 -18.007
  936    HA   CYS 126           HA       CYS 126   7.420  27.266 -18.362
  937    HB2  CYS 126           HB2      CYS 126   7.707  25.329 -19.907
  938    HB3  CYS 126           HB3      CYS 126   6.030  25.495 -20.411
  939    HG   CYS 126           HG       CYS 126   7.361  26.497 -22.333
  940    H    SER 127           H        SER 127   6.418  29.149 -17.897
  941    HA   SER 127           HA       SER 127   3.613  29.712 -18.384
  942    HB2  SER 127           HB2      SER 127   4.306  32.018 -17.733
  943    HB3  SER 127           HB3      SER 127   4.816  30.781 -16.568
  944    HG   SER 127           HG       SER 127   6.509  32.254 -17.081
  945    H    GLY 128           H        GLY 128   6.385  29.748 -20.432
  946    HA2  GLY 128           HA2      GLY 128   5.517  30.179 -22.864
  947    HA3  GLY 128           HA3      GLY 128   5.312  31.830 -22.276
  948    H    SER 129           H        SER 129   8.015  30.973 -20.620
  949    HA   SER 129           HA       SER 129   9.969  31.203 -22.801
  950    HB2  SER 129           HB2      SER 129  10.932  33.300 -21.970
  951    HB3  SER 129           HB3      SER 129   9.260  33.529 -22.496
  952    HG   SER 129           HG       SER 129   9.672  34.534 -20.479
  953    H    TRP 130           H        TRP 130  12.154  31.181 -22.168
  954    HA   TRP 130           HA       TRP 130  12.849  29.133 -20.418
  955    HB2  TRP 130           HB2      TRP 130  14.191  29.708 -22.272
  956    HB3  TRP 130           HB3      TRP 130  14.312  31.391 -21.797
  957    HD1  TRP 130           HD1      TRP 130  16.320  32.141 -20.466
  958    HE1  TRP 130           HE1      TRP 130  18.321  31.022 -19.316
  959    HE3  TRP 130           HE3      TRP 130  14.899  27.242 -20.968
  960    HZ2  TRP 130           HZ2      TRP 130  19.222  28.343 -18.735
  961    HZ3  TRP 130           HZ3      TRP 130  16.347  25.435 -20.073
  962    HH2  TRP 130           HH2      TRP 130  18.502  25.976 -18.979
  963    HA   PRO 131           HA       PRO 131  13.607  28.038 -18.923
  964    HB2  PRO 131           HB2      PRO 131  14.504  27.169 -16.562
  965    HB3  PRO 131           HB3      PRO 131  15.596  28.039 -17.672
  966    HG2  PRO 131           HG2      PRO 131  14.138  29.131 -15.265
  967    HG3  PRO 131           HG3      PRO 131  15.855  29.345 -15.743
  968    HD2  PRO 131           HD2      PRO 131  13.805  31.173 -16.322
  969    HD3  PRO 131           HD3      PRO 131  15.310  31.015 -17.272
  970    H    LEU 132           H        LEU 132  12.515  26.189 -17.487
  971    HA   LEU 132           HA       LEU 132   9.824  26.977 -16.776
  972    HB2  LEU 132           HB2      LEU 132  11.362  24.345 -16.614
  973    HB3  LEU 132           HB3      LEU 132   9.783  24.561 -15.875
  974    HG   LEU 132           HG       LEU 132   8.989  25.432 -18.167
  975   HD11  LEU 132          HD11      LEU 132  10.112  24.341 -20.104
  976   HD12  LEU 132          HD12      LEU 132  11.087  25.605 -19.368
  977   HD13  LEU 132          HD13      LEU 132  11.458  23.895 -19.035
  978   HD21  LEU 132          HD21      LEU 132   8.313  23.256 -17.118
  979   HD22  LEU 132          HD22      LEU 132   8.299  23.252 -18.863
  980   HD23  LEU 132          HD23      LEU 132   9.644  22.473 -17.989
  981    H    ASP 133           H        ASP 133   8.848  26.633 -14.796
  982    HA   ASP 133           HA       ASP 133  10.433  27.380 -12.373
  983    HB2  ASP 133           HB2      ASP 133   7.439  27.349 -12.961
  984    HB3  ASP 133           HB3      ASP 133   8.135  27.674 -11.377
  985    H    GLN 134           H        GLN 134   9.916  26.141 -10.399
  986    HA   GLN 134           HA       GLN 134   9.370  23.258 -10.861
  987    HB2  GLN 134           HB2      GLN 134  11.762  23.811 -11.109
  988    HB3  GLN 134           HB3      GLN 134  11.759  24.605  -9.532
  989    HG2  GLN 134           HG2      GLN 134  11.331  22.434  -8.426
  990    HG3  GLN 134           HG3      GLN 134  11.232  21.645 -10.005
  991   HE21  GLN 134          HE22      GLN 134  13.125  20.364 -10.151
  992   HE22  GLN 134          HE21      GLN 134  14.725  21.007  -9.826
  993    H    THR 135           H        THR 135   8.408  22.197  -9.224
  994    HA   THR 135           HA       THR 135   8.112  23.288  -6.477
  995    HB   THR 135           HB       THR 135   6.162  24.243  -7.572
  996    HG1  THR 135           HG1      THR 135   5.617  23.340  -5.616
  997   HG21  THR 135          HG21      THR 135   5.462  21.447  -8.529
  998   HG22  THR 135          HG22      THR 135   4.527  22.937  -8.787
  999   HG23  THR 135          HG23      THR 135   6.075  22.745  -9.583
 1000    H    LEU 136           H        LEU 136   7.326  21.588  -4.975
 1001    HA   LEU 136           HA       LEU 136   8.086  18.906  -5.884
 1002    HB2  LEU 136           HB2      LEU 136   7.529  20.142  -3.176
 1003    HB3  LEU 136           HB3      LEU 136   7.515  18.395  -3.372
 1004    HG   LEU 136           HG       LEU 136   9.828  18.437  -4.251
 1005   HD11  LEU 136          HD11      LEU 136  11.254  20.425  -3.780
 1006   HD12  LEU 136          HD12      LEU 136  10.093  20.711  -5.071
 1007   HD13  LEU 136          HD13      LEU 136   9.788  21.372  -3.446
 1008   HD21  LEU 136          HD21      LEU 136   9.434  19.708  -1.512
 1009   HD22  LEU 136          HD22      LEU 136   9.330  17.972  -1.883
 1010   HD23  LEU 136          HD23      LEU 136  10.873  18.818  -2.051
 1011    H    ALA 137           H        ALA 137   5.336  20.532  -5.893
 1012    HA   ALA 137           HA       ALA 137   3.626  18.291  -6.530
 1013    HB1  ALA 137           HB1      ALA 137   3.213  19.476  -3.749
 1014    HB2  ALA 137           HB2      ALA 137   2.124  18.324  -4.558
 1015    HB3  ALA 137           HB3      ALA 137   3.752  17.823  -4.123
 1016    H    ARG 138           H        ARG 138   3.658  20.092  -8.245
 1017    HA   ARG 138           HA       ARG 138   2.508  21.561  -9.515
 1018    HB2  ARG 138           HB2      ARG 138   0.026  20.783  -7.961
 1019    HB3  ARG 138           HB3      ARG 138   0.152  21.289  -9.622
 1020    HG2  ARG 138           HG2      ARG 138  -0.040  19.112 -10.084
 1021    HG3  ARG 138           HG3      ARG 138   1.693  19.100  -9.824
 1022    HD2  ARG 138           HD2      ARG 138   0.817  17.242  -8.643
 1023    HD3  ARG 138           HD3      ARG 138   1.207  18.400  -7.395
 1024    HE   ARG 138           HE       ARG 138  -1.487  17.597  -8.358
 1025   HH11  ARG 138          HH11      ARG 138   0.176  19.664  -5.987
 1026   HH12  ARG 138          HH12      ARG 138  -1.224  19.648  -4.962
 1027   HH21  ARG 138          HH21      ARG 138  -3.187  17.753  -7.000
 1028   HH22  ARG 138          HH22      ARG 138  -3.058  18.666  -5.531
 1029    H    ASP 139           H        ASP 139   3.280  22.803  -6.673
 1030    HA   ASP 139           HA       ASP 139   1.279  24.740  -6.107
 1031    HB2  ASP 139           HB2      ASP 139   3.192  24.076  -4.622
 1032    HB3  ASP 139           HB3      ASP 139   4.268  25.016  -5.663
 1033    H    THR 140           H        THR 140   3.816  24.814  -8.552
 1034    HA   THR 140           HA       THR 140   3.336  27.620  -9.320
 1035    HB   THR 140           HB       THR 140   5.068  27.069 -11.075
 1036    HG1  THR 140           HG1      THR 140   6.094  25.102 -10.884
 1037   HG21  THR 140          HG21      THR 140   5.794  28.035  -8.943
 1038   HG22  THR 140          HG22      THR 140   5.842  26.426  -8.196
 1039   HG23  THR 140          HG23      THR 140   6.964  26.828  -9.506
 1040    H    ARG 141           H        ARG 141   1.502  24.949  -9.843
 1041    HA   ARG 141           HA       ARG 141   1.008  25.426 -12.753
 1042    HB2  ARG 141           HB2      ARG 141   2.026  23.272 -12.198
 1043    HB3  ARG 141           HB3      ARG 141   0.724  22.916 -11.087
 1044    HG2  ARG 141           HG2      ARG 141   0.502  21.695 -13.170
 1045    HG3  ARG 141           HG3      ARG 141  -0.890  22.736 -12.926
 1046    HD2  ARG 141           HD2      ARG 141   1.464  23.634 -14.608
 1047    HD3  ARG 141           HD3      ARG 141   0.229  22.560 -15.280
 1048    HE   ARG 141           HE       ARG 141  -1.313  24.601 -14.283
 1049   HH11  ARG 141          HH22      ARG 141   1.326  24.523 -16.593
 1050   HH12  ARG 141          HH21      ARG 141   0.732  25.955 -17.408
 1051   HH21  ARG 141          HH12      ARG 141  -1.993  26.262 -15.295
 1052   HH22  ARG 141          HH11      ARG 141  -1.161  26.942 -16.699
 1053    HA   PRO 142           HA       PRO 142  -3.046  26.673 -10.878
 1054    HB2  PRO 142           HB2      PRO 142  -3.625  28.662 -12.668
 1055    HB3  PRO 142           HB3      PRO 142  -2.603  28.907 -11.220
 1056    HG2  PRO 142           HG2      PRO 142  -1.709  28.388 -14.066
 1057    HG3  PRO 142           HG3      PRO 142  -1.109  29.633 -12.926
 1058    HD2  PRO 142           HD2      PRO 142   0.180  27.266 -13.312
 1059    HD3  PRO 142           HD3      PRO 142   0.135  28.054 -11.707
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1  10.718  -4.336  -7.087
    2    H2   MET   1           H2       MET   1  11.047  -3.329  -8.327
    3    H3   MET   1           H3       MET   1  11.729  -3.066  -6.867
    4    HA   MET   1           HA       MET   1   8.844  -2.844  -7.482
    5    HB2  MET   1           HB2      MET   1  10.340  -2.352  -4.862
    6    HB3  MET   1           HB3      MET   1   8.705  -1.781  -5.196
    7    HG2  MET   1           HG2      MET   1   7.908  -4.087  -5.486
    8    HG3  MET   1           HG3      MET   1   9.541  -4.702  -5.221
    9    HE1  MET   1           HE1      MET   1   6.350  -3.111  -3.637
   10    HE2  MET   1           HE2      MET   1   6.821  -2.855  -1.943
   11    HE3  MET   1           HE3      MET   1   7.511  -1.829  -3.215
   12    H    ALA   2           H        ALA   2   8.267  -0.934  -8.387
   13    HA   ALA   2           HA       ALA   2  10.237   1.136  -8.886
   14    HB1  ALA   2           HB1      ALA   2   8.610   0.387 -10.557
   15    HB2  ALA   2           HB2      ALA   2   7.266   0.919  -9.525
   16    HB3  ALA   2           HB3      ALA   2   8.393   2.108 -10.215
   17    H    TYR   3           H        TYR   3   9.049   0.716  -5.983
   18    HA   TYR   3           HA       TYR   3   8.963   3.528  -5.247
   19    HB2  TYR   3           HB2      TYR   3   6.796   3.540  -4.257
   20    HB3  TYR   3           HB3      TYR   3   6.620   3.107  -5.935
   21    HD1  TYR   3           HD2      TYR   3   6.221   0.624  -6.550
   22    HD2  TYR   3           HD1      TYR   3   5.917   2.155  -2.523
   23    HE1  TYR   3           HE2      TYR   3   4.827  -1.333  -5.906
   24    HE2  TYR   3           HE1      TYR   3   4.528   0.198  -1.887
   25    HH   TYR   3           HH       TYR   3   3.529  -1.739  -2.592
   26    H    GLY   4           H        GLY   4   8.329   3.588  -2.738
   27    HA2  GLY   4           HA2      GLY   4   8.578   2.594  -0.586
   28    HA3  GLY   4           HA3      GLY   4   9.640   1.355  -1.250
   29    H    ARG   5           H        ARG   5  10.417   4.444  -2.412
   30    HA   ARG   5           HA       ARG   5  12.476   5.139  -0.408
   31    HB2  ARG   5           HB2      ARG   5  14.307   4.906  -2.079
   32    HB3  ARG   5           HB3      ARG   5  13.594   3.379  -1.581
   33    HG2  ARG   5           HG2      ARG   5  12.262   3.290  -3.674
   34    HG3  ARG   5           HG3      ARG   5  12.984   4.812  -4.208
   35    HD2  ARG   5           HD2      ARG   5  15.212   3.786  -4.219
   36    HD3  ARG   5           HD3      ARG   5  14.552   2.269  -3.592
   37    HE   ARG   5           HE       ARG   5  14.365   3.314  -6.343
   38   HH11  ARG   5          HH11      ARG   5  13.067   0.826  -4.189
   39   HH12  ARG   5          HH12      ARG   5  12.157   0.128  -5.515
   40   HH21  ARG   5          HH21      ARG   5  12.982   2.496  -7.776
   41   HH22  ARG   5          HH22      ARG   5  12.247   0.908  -7.468
   42    H    GLU   6           H        GLU   6  10.462   6.683  -0.754
   43    HA   GLU   6           HA       GLU   6  10.161   8.382  -2.917
   44    HB2  GLU   6           HB2      GLU   6   8.680   8.154  -0.922
   45    HB3  GLU   6           HB3      GLU   6   9.814   9.140   0.008
   46    HG2  GLU   6           HG2      GLU   6   9.430  11.039  -1.560
   47    HG3  GLU   6           HG3      GLU   6   8.331  10.033  -2.508
   48    H    ASP   7           H        ASP   7  12.594   8.818  -0.324
   49    HA   ASP   7           HA       ASP   7  13.507  11.407  -1.103
   50    HB2  ASP   7           HB2      ASP   7  14.017  10.282   1.042
   51    HB3  ASP   7           HB3      ASP   7  15.008   9.098   0.188
   52    H    VAL   8           H        VAL   8  14.255   8.220  -2.444
   53    HA   VAL   8           HA       VAL   8  16.482   9.160  -4.118
   54    HB   VAL   8           HB       VAL   8  14.891   6.570  -4.332
   55   HG11  VAL   8          HG11      VAL   8  16.890   5.754  -5.539
   56   HG12  VAL   8          HG12      VAL   8  16.150   7.111  -6.390
   57   HG13  VAL   8          HG13      VAL   8  17.621   7.371  -5.428
   58   HG21  VAL   8          HG21      VAL   8  15.995   6.703  -2.121
   59   HG22  VAL   8          HG22      VAL   8  16.822   5.537  -3.156
   60   HG23  VAL   8          HG23      VAL   8  17.526   7.149  -2.902
   61    H    ALA   9           H        ALA   9  12.990   8.381  -4.590
   62    HA   ALA   9           HA       ALA   9  12.896   9.102  -7.365
   63    HB1  ALA   9           HB1      ALA   9  10.473   9.266  -7.007
   64    HB2  ALA   9           HB2      ALA   9  11.125   7.825  -6.200
   65    HB3  ALA   9           HB3      ALA   9  10.705   9.267  -5.246
   66    H    ASN  10           H        ASN  10  12.303  11.095  -4.440
   67    HA   ASN  10           HA       ASN  10  12.012  13.631  -5.667
   68    HB2  ASN  10           HB2      ASN  10  11.609  13.157  -3.251
   69    HB3  ASN  10           HB3      ASN  10  13.326  12.876  -3.012
   70   HD21  ASN  10          HD22      ASN  10  10.872  15.363  -3.578
   71   HD22  ASN  10          HD21      ASN  10  11.936  16.690  -3.161
   72    H    THR  11           H        THR  11  15.085  12.085  -4.591
   73    HA   THR  11           HA       THR  11  16.827  14.130  -5.508
   74    HB   THR  11           HB       THR  11  17.348  11.130  -5.452
   75    HG1  THR  11           HG1      THR  11  16.766  11.881  -3.437
   76   HG21  THR  11          HG21      THR  11  19.718  11.806  -5.141
   77   HG22  THR  11          HG22      THR  11  19.103  12.333  -6.712
   78   HG23  THR  11          HG23      THR  11  19.265  13.508  -5.390
   79    H    ARG  12           H        ARG  12  15.740  11.178  -7.295
   80    HA   ARG  12           HA       ARG  12  16.966  11.892  -9.781
   81    HB2  ARG  12           HB2      ARG  12  14.453  10.243  -9.191
   82    HB3  ARG  12           HB3      ARG  12  15.186  10.381 -10.781
   83    HG2  ARG  12           HG2      ARG  12  16.431   9.052  -8.345
   84    HG3  ARG  12           HG3      ARG  12  15.764   8.291  -9.779
   85    HD2  ARG  12           HD2      ARG  12  17.950   8.169 -10.367
   86    HD3  ARG  12           HD3      ARG  12  17.585   9.746 -11.057
   87    HE   ARG  12           HE       ARG  12  19.026  10.738  -9.494
   88   HH11  ARG  12          HH11      ARG  12  18.481   7.446  -8.348
   89   HH12  ARG  12          HH12      ARG  12  19.756   7.604  -7.175
   90   HH21  ARG  12          HH21      ARG  12  20.498  10.841  -8.112
   91   HH22  ARG  12          HH22      ARG  12  20.908   9.518  -7.008
   92    H    ALA  13           H        ALA  13  13.677  12.769  -8.576
   93    HA   ALA  13           HA       ALA  13  12.771  14.077 -10.908
   94    HB1  ALA  13           HB1      ALA  13  11.253  15.247  -9.423
   95    HB2  ALA  13           HB2      ALA  13  11.391  13.553  -8.921
   96    HB3  ALA  13           HB3      ALA  13  12.242  14.825  -8.014
   97    H    ARG  14           H        ARG  14  14.720  15.376  -8.213
   98    HA   ARG  14           HA       ARG  14  14.832  18.103  -9.213
   99    HB2  ARG  14           HB2      ARG  14  16.470  16.549  -7.157
  100    HB3  ARG  14           HB3      ARG  14  16.633  18.291  -7.427
  101    HG2  ARG  14           HG2      ARG  14  14.449  18.763  -6.622
  102    HG3  ARG  14           HG3      ARG  14  13.901  17.099  -6.836
  103    HD2  ARG  14           HD2      ARG  14  14.127  17.538  -4.505
  104    HD3  ARG  14           HD3      ARG  14  15.294  16.312  -5.024
  105    HE   ARG  14           HE       ARG  14  16.519  18.918  -5.021
  106   HH11  ARG  14          HH11      ARG  14  15.415  16.443  -2.784
  107   HH12  ARG  14          HH12      ARG  14  16.606  16.883  -1.583
  108   HH21  ARG  14          HH22      ARG  14  18.004  19.418  -3.426
  109   HH22  ARG  14          HH21      ARG  14  18.013  18.526  -1.938
  110    H    GLU  15           H        GLU  15  17.029  15.332  -9.467
  111    HA   GLU  15           HA       GLU  15  19.035  16.680 -11.078
  112    HB2  GLU  15           HB2      GLU  15  18.217  13.752 -10.829
  113    HB3  GLU  15           HB3      GLU  15  19.586  14.316 -11.807
  114    HG2  GLU  15           HG2      GLU  15  20.534  15.387  -9.714
  115    HG3  GLU  15           HG3      GLU  15  19.261  14.572  -8.798
  116    H    THR  16           H        THR  16  16.149  14.775 -11.987
  117    HA   THR  16           HA       THR  16  16.452  14.930 -14.802
  118    HB   THR  16           HB       THR  16  13.897  14.740 -13.155
  119    HG1  THR  16           HG1      THR  16  15.295  13.099 -12.698
  120   HG21  THR  16          HG21      THR  16  14.430  13.761 -15.977
  121   HG22  THR  16          HG22      THR  16  12.944  13.548 -15.043
  122   HG23  THR  16          HG23      THR  16  13.412  15.175 -15.585
  123    H    ALA  17           H        ALA  17  14.874  17.208 -12.560
  124    HA   ALA  17           HA       ALA  17  14.030  19.052 -14.586
  125    HB1  ALA  17           HB1      ALA  17  13.073  19.023 -12.328
  126    HB2  ALA  17           HB2      ALA  17  14.648  19.459 -11.630
  127    HB3  ALA  17           HB3      ALA  17  13.788  20.615 -12.668
  128    H    ALA  18           H        ALA  18  17.060  18.997 -12.614
  129    HA   ALA  18           HA       ALA  18  18.198  21.346 -13.789
  130    HB1  ALA  18           HB1      ALA  18  19.554  18.883 -12.599
  131    HB2  ALA  18           HB2      ALA  18  20.312  20.465 -12.876
  132    HB3  ALA  18           HB3      ALA  18  18.995  20.309 -11.697
  133    H    ARG  19           H        ARG  19  18.429  17.909 -14.719
  134    HA   ARG  19           HA       ARG  19  20.145  18.196 -17.020
  135    HB2  ARG  19           HB2      ARG  19  18.017  16.159 -16.228
  136    HB3  ARG  19           HB3      ARG  19  18.921  16.047 -17.721
  137    HG2  ARG  19           HG2      ARG  19  20.236  16.028 -14.979
  138    HG3  ARG  19           HG3      ARG  19  19.770  14.602 -15.910
  139    HD2  ARG  19           HD2      ARG  19  21.221  15.760 -17.819
  140    HD3  ARG  19           HD3      ARG  19  21.968  16.593 -16.459
  141    HE   ARG  19           HE       ARG  19  22.552  14.377 -15.508
  142   HH11  ARG  19          HH11      ARG  19  21.949  14.380 -18.992
  143   HH12  ARG  19          HH12      ARG  19  22.464  12.689 -19.096
  144   HH21  ARG  19          HH21      ARG  19  23.263  12.244 -15.910
  145   HH22  ARG  19          HH22      ARG  19  23.113  11.642 -17.559
  146    H    PHE  20           H        PHE  20  16.543  18.108 -16.832
  147    HA   PHE  20           HA       PHE  20  16.082  18.671 -19.563
  148    HB2  PHE  20           HB2      PHE  20  14.238  17.970 -18.220
  149    HB3  PHE  20           HB3      PHE  20  14.485  19.278 -17.067
  150    HD1  PHE  20           HD2      PHE  20  14.082  19.056 -20.841
  151    HD2  PHE  20           HD1      PHE  20  12.947  21.003 -17.161
  152    HE1  PHE  20           HE2      PHE  20  12.634  20.619 -22.098
  153    HE2  PHE  20           HE1      PHE  20  11.502  22.564 -18.433
  154    HZ   PHE  20           HZ       PHE  20  11.346  22.370 -20.918
  155    H    THR  21           H        THR  21  16.571  21.027 -16.869
  156    HA   THR  21           HA       THR  21  16.146  23.353 -18.434
  157    HB   THR  21           HB       THR  21  18.103  23.102 -16.118
  158    HG1  THR  21           HG1      THR  21  16.056  22.385 -15.522
  159   HG21  THR  21          HG21      THR  21  16.562  25.486 -17.266
  160   HG22  THR  21          HG22      THR  21  17.428  25.496 -15.721
  161   HG23  THR  21          HG23      THR  21  18.328  25.273 -17.223
  162    H    ALA  22           H        ALA  22  19.231  21.505 -18.002
  163    HA   ALA  22           HA       ALA  22  20.714  23.177 -19.812
  164    HB1  ALA  22           HB1      ALA  22  21.133  20.257 -19.022
  165    HB2  ALA  22           HB2      ALA  22  22.335  21.315 -19.790
  166    HB3  ALA  22           HB3      ALA  22  21.761  21.674 -18.150
  167    H    ALA  23           H        ALA  23  18.768  20.225 -20.407
  168    HA   ALA  23           HA       ALA  23  19.429  19.990 -23.192
  169    HB1  ALA  23           HB1      ALA  23  18.507  18.189 -21.813
  170    HB2  ALA  23           HB2      ALA  23  16.952  19.049 -21.700
  171    HB3  ALA  23           HB3      ALA  23  17.531  18.457 -23.271
  172    H    LEU  24           H        LEU  24  16.923  21.898 -21.531
  173    HA   LEU  24           HA       LEU  24  15.642  22.859 -23.926
  174    HB2  LEU  24           HB2      LEU  24  14.611  22.810 -21.680
  175    HB3  LEU  24           HB3      LEU  24  15.794  23.962 -21.098
  176    HG   LEU  24           HG       LEU  24  14.875  25.650 -22.768
  177   HD11  LEU  24          HD11      LEU  24  12.629  25.192 -23.712
  178   HD12  LEU  24          HD12      LEU  24  13.830  24.070 -24.362
  179   HD13  LEU  24          HD13      LEU  24  12.704  23.525 -23.104
  180   HD21  LEU  24          HD21      LEU  24  12.823  26.095 -21.464
  181   HD22  LEU  24          HD22      LEU  24  12.906  24.454 -20.781
  182   HD23  LEU  24          HD23      LEU  24  14.167  25.639 -20.400
  183    H    GLU  25           H        GLU  25  18.431  24.044 -22.000
  184    HA   GLU  25           HA       GLU  25  18.902  26.429 -23.536
  185    HB2  GLU  25           HB2      GLU  25  19.980  25.792 -21.312
  186    HB3  GLU  25           HB3      GLU  25  21.045  24.722 -22.221
  187    HG2  GLU  25           HG2      GLU  25  21.821  26.668 -23.575
  188    HG3  GLU  25           HG3      GLU  25  20.752  27.723 -22.649
  189    H    LEU  26           H        LEU  26  20.160  23.093 -23.934
  190    HA   LEU  26           HA       LEU  26  21.561  23.384 -26.383
  191    HB2  LEU  26           HB2      LEU  26  21.777  21.350 -25.212
  192    HB3  LEU  26           HB3      LEU  26  20.052  21.189 -24.998
  193    HG   LEU  26           HG       LEU  26  19.812  20.665 -27.458
  194   HD11  LEU  26          HD11      LEU  26  21.978  21.610 -28.224
  195   HD12  LEU  26          HD12      LEU  26  22.840  20.381 -27.273
  196   HD13  LEU  26          HD13      LEU  26  21.813  19.895 -28.641
  197   HD21  LEU  26          HD21      LEU  26  20.566  18.351 -27.150
  198   HD22  LEU  26          HD22      LEU  26  21.501  18.840 -25.717
  199   HD23  LEU  26          HD23      LEU  26  19.726  18.972 -25.719
  200    H    ALA  27           H        ALA  27  18.093  22.657 -25.894
  201    HA   ALA  27           HA       ALA  27  17.367  22.644 -28.624
  202    HB1  ALA  27           HB1      ALA  27  15.091  22.919 -27.804
  203    HB2  ALA  27           HB2      ALA  27  15.985  21.782 -26.774
  204    HB3  ALA  27           HB3      ALA  27  15.691  23.441 -26.214
  205    H    ILE  28           H        ILE  28  17.532  25.474 -26.400
  206    HA   ILE  28           HA       ILE  28  16.609  27.428 -28.324
  207    HB   ILE  28           HB       ILE  28  18.388  27.695 -25.870
  208   HG12  ILE  28          HG12      ILE  28  15.485  28.551 -26.190
  209   HG13  ILE  28          HG13      ILE  28  15.904  26.937 -25.653
  210   HG21  ILE  28          HG21      ILE  28  17.827  30.146 -25.982
  211   HG22  ILE  28          HG22      ILE  28  18.835  29.618 -27.318
  212   HG23  ILE  28          HG23      ILE  28  17.097  29.873 -27.579
  213   HD11  ILE  28          HD11      ILE  28  16.547  29.511 -24.206
  214   HD12  ILE  28          HD12      ILE  28  15.462  28.188 -23.721
  215   HD13  ILE  28          HD13      ILE  28  17.210  27.921 -23.756
  216    H    ASP  29           H        ASP  29  19.930  26.318 -27.467
  217    HA   ASP  29           HA       ASP  29  21.288  27.944 -29.363
  218    HB2  ASP  29           HB2      ASP  29  22.361  26.724 -27.495
  219    HB3  ASP  29           HB3      ASP  29  22.037  25.193 -28.306
  220    H    ARG  30           H        ARG  30  19.855  24.697 -29.750
  221    HA   ARG  30           HA       ARG  30  20.598  24.493 -32.554
  222    HB2  ARG  30           HB2      ARG  30  18.480  23.067 -30.846
  223    HB3  ARG  30           HB3      ARG  30  18.725  22.703 -32.557
  224    HG2  ARG  30           HG2      ARG  30  20.735  22.268 -30.320
  225    HG3  ARG  30           HG3      ARG  30  19.824  21.047 -31.214
  226    HD2  ARG  30           HD2      ARG  30  20.985  21.998 -33.330
  227    HD3  ARG  30           HD3      ARG  30  22.049  22.842 -32.199
  228    HE   ARG  30           HE       ARG  30  22.834  20.715 -31.341
  229   HH11  ARG  30          HH21      ARG  30  21.107  20.379 -34.429
  230   HH12  ARG  30          HH22      ARG  30  21.921  18.832 -34.706
  231   HH21  ARG  30          HH11      ARG  30  23.770  18.739 -31.959
  232   HH22  ARG  30          HH12      ARG  30  23.228  18.033 -33.487
  233    H    ALA  31           H        ALA  31  17.584  25.725 -31.004
  234    HA   ALA  31           HA       ALA  31  16.244  26.251 -33.470
  235    HB1  ALA  31           HB1      ALA  31  15.190  26.295 -31.179
  236    HB2  ALA  31           HB2      ALA  31  16.042  27.810 -30.849
  237    HB3  ALA  31           HB3      ALA  31  14.830  27.728 -32.146
  238    H    THR  32           H        THR  32  18.665  28.207 -31.722
  239    HA   THR  32           HA       THR  32  18.221  30.490 -33.491
  240    HB   THR  32           HB       THR  32  19.043  30.452 -31.004
  241    HG1  THR  32           HG1      THR  32  18.583  32.255 -32.016
  242   HG21  THR  32          HG21      THR  32  21.214  29.303 -31.364
  243   HG22  THR  32          HG22      THR  32  21.730  30.624 -32.435
  244   HG23  THR  32          HG23      THR  32  21.398  30.935 -30.719
  245    H    LEU  33           H        LEU  33  20.340  27.691 -33.582
  246    HA   LEU  33           HA       LEU  33  21.956  28.837 -35.707
  247    HB2  LEU  33           HB2      LEU  33  23.442  27.167 -35.340
  248    HB3  LEU  33           HB3      LEU  33  22.676  27.293 -33.766
  249    HG   LEU  33           HG       LEU  33  21.246  25.302 -34.410
  250   HD11  LEU  33          HD11      LEU  33  23.461  24.978 -36.504
  251   HD12  LEU  33          HD12      LEU  33  22.366  23.683 -35.977
  252   HD13  LEU  33          HD13      LEU  33  21.724  25.054 -36.846
  253   HD21  LEU  33          HD21      LEU  33  24.276  25.110 -34.097
  254   HD22  LEU  33          HD22      LEU  33  23.072  25.190 -32.795
  255   HD23  LEU  33          HD23      LEU  33  23.172  23.755 -33.833
  256    H    SER  34           H        SER  34  19.245  26.600 -35.469
  257    HA   SER  34           HA       SER  34  19.607  25.427 -38.075
  258    HB2  SER  34           HB2      SER  34  17.208  25.382 -36.210
  259    HB3  SER  34           HB3      SER  34  17.443  24.345 -37.638
  260    HG   SER  34           HG       SER  34  18.874  24.422 -35.219
  261    H    GLY  35           H        GLY  35  17.887  28.335 -37.141
  262    HA2  GLY  35           HA2      GLY  35  16.856  29.907 -38.518
  263    HA3  GLY  35           HA3      GLY  35  17.114  28.864 -39.918
  264    H    GLN  36           H        GLN  36  15.582  27.188 -37.412
  265    HA   GLN  36           HA       GLN  36  12.818  28.009 -37.904
  266    HB2  GLN  36           HB2      GLN  36  13.229  26.204 -39.601
  267    HB3  GLN  36           HB3      GLN  36  13.778  25.136 -38.316
  268    HG2  GLN  36           HG2      GLN  36  11.452  25.358 -37.277
  269    HG3  GLN  36           HG3      GLN  36  10.963  26.216 -38.738
  270   HE21  GLN  36          HE22      GLN  36  11.310  23.172 -37.198
  271   HE22  GLN  36          HE21      GLN  36  10.894  22.199 -38.601
  272    HA   PRO  37           HA       PRO  37  12.683  27.111 -33.444
  273    HB2  PRO  37           HB2      PRO  37  10.014  25.924 -34.284
  274    HB3  PRO  37           HB3      PRO  37  10.379  26.872 -32.813
  275    HG2  PRO  37           HG2      PRO  37   9.258  28.117 -34.910
  276    HG3  PRO  37           HG3      PRO  37  10.666  28.887 -34.105
  277    HD2  PRO  37           HD2      PRO  37  10.597  27.330 -36.672
  278    HD3  PRO  37           HD3      PRO  37  11.499  28.820 -36.275
  279    H    VAL  38           H        VAL  38  12.537  25.293 -31.985
  280    HA   VAL  38           HA       VAL  38  13.055  22.567 -33.143
  281    HB   VAL  38           HB       VAL  38  14.685  24.170 -31.159
  282   HG11  VAL  38          HG11      VAL  38  16.142  22.230 -30.791
  283   HG12  VAL  38          HG12      VAL  38  14.554  22.006 -30.074
  284   HG13  VAL  38          HG13      VAL  38  14.965  21.184 -31.597
  285   HG21  VAL  38          HG21      VAL  38  15.218  24.355 -33.596
  286   HG22  VAL  38          HG22      VAL  38  16.513  23.507 -32.742
  287   HG23  VAL  38          HG23      VAL  38  15.332  22.601 -33.704
  288    H    GLY  39           H        GLY  39  12.723  20.796 -31.483
  289    HA2  GLY  39           HA2      GLY  39  11.092  21.614 -29.166
  290    HA3  GLY  39           HA3      GLY  39  10.243  20.704 -30.405
  291    H    ILE  40           H        ILE  40  10.078  19.642 -28.129
  292    HA   ILE  40           HA       ILE  40  12.097  17.443 -27.913
  293    HB   ILE  40           HB       ILE  40  10.837  18.886 -25.560
  294   HG12  ILE  40          HG12      ILE  40  13.625  19.218 -26.753
  295   HG13  ILE  40          HG13      ILE  40  12.356  20.434 -26.725
  296   HG21  ILE  40          HG21      ILE  40  11.470  16.501 -25.172
  297   HG22  ILE  40          HG22      ILE  40  13.120  16.860 -25.735
  298   HG23  ILE  40          HG23      ILE  40  12.484  17.590 -24.246
  299   HD11  ILE  40          HD11      ILE  40  13.816  19.400 -24.282
  300   HD12  ILE  40          HD12      ILE  40  13.953  20.989 -25.046
  301   HD13  ILE  40          HD13      ILE  40  12.423  20.522 -24.281
  302    H    HIS  41           H        HIS  41  11.220  15.574 -28.194
  303    HA   HIS  41           HA       HIS  41   8.299  15.137 -28.172
  304    HB2  HIS  41           HB2      HIS  41   9.500  14.535 -30.125
  305    HB3  HIS  41           HB3      HIS  41  10.702  13.635 -29.223
  306    HD1  HIS  41           HD1      HIS  41  10.121  11.540 -30.865
  307    HD2  HIS  41           HD2      HIS  41   7.071  12.831 -28.282
  308    HE1  HIS  41           HE1      HIS  41   8.501   9.586 -30.637
  309    H    PHE  42           H        PHE  42   8.418  15.525 -25.764
  310    HA   PHE  42           HA       PHE  42   9.197  13.424 -23.959
  311    HB2  PHE  42           HB2      PHE  42   7.005  15.522 -23.856
  312    HB3  PHE  42           HB3      PHE  42   7.357  14.430 -22.530
  313    HD1  PHE  42           HD2      PHE  42   9.586  14.465 -21.388
  314    HD2  PHE  42           HD1      PHE  42   8.358  17.508 -24.192
  315    HE1  PHE  42           HE2      PHE  42  11.284  16.018 -20.451
  316    HE2  PHE  42           HE1      PHE  42  10.049  19.057 -23.246
  317    HZ   PHE  42           HZ       PHE  42  11.502  18.311 -21.368
  318    H    SER  43           H        SER  43   8.019  11.814 -22.995
  319    HA   SER  43           HA       SER  43   5.279  11.142 -23.873
  320    HB2  SER  43           HB2      SER  43   5.751   8.862 -24.243
  321    HB3  SER  43           HB3      SER  43   7.004   9.728 -25.146
  322    HG   SER  43           HG       SER  43   7.881   8.031 -23.902
  323    H    ASP  44           H        ASP  44   4.621   9.128 -22.245
  324    HA   ASP  44           HA       ASP  44   4.640  10.095 -19.587
  325    HB2  ASP  44           HB2      ASP  44   3.673   7.959 -18.991
  326    HB3  ASP  44           HB3      ASP  44   2.956   8.559 -20.477
  327    H    SER  45           H        SER  45   7.151   8.303 -21.196
  328    HA   SER  45           HA       SER  45   8.582   7.855 -18.598
  329    HB2  SER  45           HB2      SER  45   8.156   5.825 -20.825
  330    HB3  SER  45           HB3      SER  45   9.259   5.614 -19.456
  331    HG   SER  45           HG       SER  45   6.432   5.798 -19.443
  332    H    ALA  46           H        ALA  46   8.877   9.230 -21.690
  333    HA   ALA  46           HA       ALA  46  11.828   9.273 -21.451
  334    HB1  ALA  46           HB1      ALA  46  11.220   7.293 -22.851
  335    HB2  ALA  46           HB2      ALA  46  10.353   8.374 -23.965
  336    HB3  ALA  46           HB3      ALA  46  12.113   8.515 -23.764
  337    H    TRP  47           H        TRP  47  12.732  10.556 -23.362
  338    HA   TRP  47           HA       TRP  47  11.232  12.834 -24.375
  339    HB2  TRP  47           HB2      TRP  47  12.559  14.520 -23.298
  340    HB3  TRP  47           HB3      TRP  47  12.002  13.485 -21.992
  341    HD1  TRP  47           HD1      TRP  47  13.862  11.835 -20.884
  342    HE1  TRP  47           HE1      TRP  47  16.458  11.882 -20.850
  343    HE3  TRP  47           HE3      TRP  47  14.730  15.462 -24.409
  344    HZ2  TRP  47           HZ2      TRP  47  18.561  12.972 -22.417
  345    HZ3  TRP  47           HZ3      TRP  47  17.059  15.995 -25.085
  346    HH2  TRP  47           HH2      TRP  47  18.973  14.733 -24.148
  347    H    ARG  48           H        ARG  48  12.596  13.982 -25.950
  348    HA   ARG  48           HA       ARG  48  15.330  13.597 -26.396
  349    HB2  ARG  48           HB2      ARG  48  15.526  12.391 -28.436
  350    HB3  ARG  48           HB3      ARG  48  14.826  11.328 -27.256
  351    HG2  ARG  48           HG2      ARG  48  13.359  12.706 -29.531
  352    HG3  ARG  48           HG3      ARG  48  13.882  11.030 -29.498
  353    HD2  ARG  48           HD2      ARG  48  11.802  12.234 -27.630
  354    HD3  ARG  48           HD3      ARG  48  11.484  11.340 -29.104
  355    HE   ARG  48           HE       ARG  48  13.076   9.679 -27.433
  356   HH11  ARG  48          HH11      ARG  48   9.804  11.008 -27.338
  357   HH12  ARG  48          HH12      ARG  48   9.124   9.384 -27.137
  358   HH21  ARG  48          HH21      ARG  48  12.039   7.742 -26.854
  359   HH22  ARG  48          HH22      ARG  48  10.262   7.751 -26.786
  360    H    ILE  49           H        ILE  49  16.139  14.953 -27.997
  361    HA   ILE  49           HA       ILE  49  14.395  17.211 -28.633
  362    HB   ILE  49           HB       ILE  49  17.219  16.709 -29.622
  363   HG12  ILE  49          HG12      ILE  49  17.357  16.479 -27.236
  364   HG13  ILE  49          HG13      ILE  49  18.109  17.970 -27.764
  365   HG21  ILE  49          HG21      ILE  49  17.305  19.242 -29.615
  366   HG22  ILE  49          HG22      ILE  49  16.174  18.567 -30.786
  367   HG23  ILE  49          HG23      ILE  49  15.566  19.253 -29.269
  368   HD11  ILE  49          HD11      ILE  49  15.393  17.730 -26.407
  369   HD12  ILE  49          HD12      ILE  49  16.890  18.354 -25.697
  370   HD13  ILE  49          HD13      ILE  49  16.103  19.258 -26.994
  371    H    MET  50           H        MET  50  13.706  17.875 -30.665
  372    HA   MET  50           HA       MET  50  14.309  16.173 -33.031
  373    HB2  MET  50           HB2      MET  50  11.551  17.256 -32.313
  374    HB3  MET  50           HB3      MET  50  12.019  16.558 -33.874
  375    HG2  MET  50           HG2      MET  50  12.762  14.476 -32.572
  376    HG3  MET  50           HG3      MET  50  11.941  15.171 -31.180
  377    HE1  MET  50           HE1      MET  50  10.001  13.302 -34.930
  378    HE2  MET  50           HE2      MET  50  11.308  14.500 -35.049
  379    HE3  MET  50           HE3      MET  50  11.609  12.932 -34.273
  380    H    VAL  51           H        VAL  51  14.820  17.256 -34.793
  381    HA   VAL  51           HA       VAL  51  14.914  20.231 -34.699
  382    HB   VAL  51           HB       VAL  51  17.024  18.448 -34.053
  383   HG11  VAL  51          HG11      VAL  51  18.806  18.824 -35.554
  384   HG12  VAL  51          HG12      VAL  51  17.490  18.072 -36.456
  385   HG13  VAL  51          HG13      VAL  51  17.820  19.827 -36.621
  386   HG21  VAL  51          HG21      VAL  51  16.693  20.684 -33.161
  387   HG22  VAL  51          HG22      VAL  51  18.343  20.433 -33.742
  388   HG23  VAL  51          HG23      VAL  51  17.208  21.398 -34.708
  389    HA   PRO  52           HA       PRO  52  13.721  20.028 -38.896
  390    HB2  PRO  52           HB2      PRO  52  15.873  21.929 -39.754
  391    HB3  PRO  52           HB3      PRO  52  14.093  22.031 -39.941
  392    HG2  PRO  52           HG2      PRO  52  15.408  23.532 -38.081
  393    HG3  PRO  52           HG3      PRO  52  13.813  22.799 -37.723
  394    HD2  PRO  52           HD2      PRO  52  16.540  21.801 -36.929
  395    HD3  PRO  52           HD3      PRO  52  15.040  21.925 -35.959
  396    H    GLY  53           H        GLY  53  17.109  19.513 -38.351
  397    HA2  GLY  53           HA2      GLY  53  18.710  18.123 -39.143
  398    HA3  GLY  53           HA3      GLY  53  17.427  17.194 -39.898
  399    H    LYS  54           H        LYS  54  16.530  18.650 -41.872
  400    HA   LYS  54           HA       LYS  54  18.701  19.579 -43.708
  401    HB2  LYS  54           HB2      LYS  54  18.490  17.143 -43.968
  402    HB3  LYS  54           HB3      LYS  54  16.742  17.282 -44.172
  403    HG2  LYS  54           HG2      LYS  54  17.040  18.456 -46.303
  404    HG3  LYS  54           HG3      LYS  54  18.804  18.454 -46.089
  405    HD2  LYS  54           HD2      LYS  54  18.844  16.010 -46.231
  406    HD3  LYS  54           HD3      LYS  54  17.066  15.948 -46.261
  407    HE2  LYS  54           HE2      LYS  54  17.039  17.241 -48.367
  408    HE3  LYS  54           HE3      LYS  54  18.805  17.332 -48.352
  409    HZ1  LYS  54           HZ1      LYS  54  18.865  14.896 -48.538
  410    HZ2  LYS  54           HZ2      LYS  54  17.235  14.812 -48.553
  411    HZ3  LYS  54           HZ3      LYS  54  18.027  15.526 -49.782
  412    H    THR  55           H        THR  55  15.387  19.697 -42.652
  413    HA   THR  55           HA       THR  55  14.628  21.575 -44.857
  414    HB   THR  55           HB       THR  55  12.327  20.519 -44.575
  415    HG1  THR  55           HG1      THR  55  12.780  19.400 -42.641
  416   HG21  THR  55          HG21      THR  55  12.790  18.638 -46.001
  417   HG22  THR  55          HG22      THR  55  13.782  20.017 -46.510
  418   HG23  THR  55          HG23      THR  55  14.519  18.679 -45.593
  419    HA   PRO  56           HA       PRO  56  13.616  23.861 -40.911
  420    HB2  PRO  56           HB2      PRO  56  15.116  26.092 -41.280
  421    HB3  PRO  56           HB3      PRO  56  15.812  24.569 -40.666
  422    HG2  PRO  56           HG2      PRO  56  15.798  25.561 -43.537
  423    HG3  PRO  56           HG3      PRO  56  17.208  25.023 -42.565
  424    HD2  PRO  56           HD2      PRO  56  15.894  23.346 -44.266
  425    HD3  PRO  56           HD3      PRO  56  16.570  22.766 -42.714
  426    H    SER  57           H        SER  57  12.261  23.504 -43.536
  427    HA   SER  57           HA       SER  57  11.664  25.996 -44.781
  428    HB2  SER  57           HB2      SER  57  10.038  23.434 -44.919
  429    HB3  SER  57           HB3      SER  57  10.180  24.706 -46.147
  430    HG   SER  57           HG       SER  57  11.502  22.944 -46.673
  431    H    ALA  58           H        ALA  58  10.044  24.237 -42.179
  432    HA   ALA  58           HA       ALA  58   8.368  26.359 -41.358
  433    HB1  ALA  58           HB1      ALA  58   6.929  24.229 -43.026
  434    HB2  ALA  58           HB2      ALA  58   6.125  25.423 -41.986
  435    HB3  ALA  58           HB3      ALA  58   7.035  25.963 -43.398
  436    H    TRP  59           H        TRP  59   8.518  22.778 -41.591
  437    HA   TRP  59           HA       TRP  59   8.141  22.499 -38.655
  438    HB2  TRP  59           HB2      TRP  59   5.888  22.590 -39.522
  439    HB3  TRP  59           HB3      TRP  59   6.251  21.423 -40.774
  440    HD1  TRP  59           HD1      TRP  59   5.773  18.977 -40.266
  441    HE1  TRP  59           HE1      TRP  59   4.877  17.654 -38.264
  442    HE3  TRP  59           HE3      TRP  59   6.139  22.606 -36.659
  443    HZ2  TRP  59           HZ2      TRP  59   4.324  18.117 -35.473
  444    HZ3  TRP  59           HZ3      TRP  59   5.414  22.128 -34.330
  445    HH2  TRP  59           HH2      TRP  59   4.503  19.897 -33.726
  446    H    ARG  60           H        ARG  60   8.054  20.378 -41.499
  447    HA   ARG  60           HA       ARG  60   8.605  18.003 -40.988
  448    HB2  ARG  60           HB2      ARG  60   8.883  18.923 -43.227
  449    HB3  ARG  60           HB3      ARG  60  10.510  19.457 -42.844
  450    HG2  ARG  60           HG2      ARG  60  10.489  17.431 -44.202
  451    HG3  ARG  60           HG3      ARG  60  11.284  17.125 -42.670
  452    HD2  ARG  60           HD2      ARG  60   8.355  16.449 -43.060
  453    HD3  ARG  60           HD3      ARG  60   9.621  15.381 -43.671
  454    HE   ARG  60           HE       ARG  60  10.488  15.560 -41.161
  455   HH11  ARG  60          HH11      ARG  60   7.208  14.932 -42.249
  456   HH12  ARG  60          HH12      ARG  60   6.850  13.980 -40.838
  457   HH21  ARG  60          HH21      ARG  60   9.977  14.380 -39.454
  458   HH22  ARG  60          HH22      ARG  60   8.388  13.659 -39.283
  459    H    TRP  61           H        TRP  61   9.191  17.575 -38.917
  460    HA   TRP  61           HA       TRP  61  11.782  18.079 -37.815
  461    HB2  TRP  61           HB2      TRP  61   9.610  16.078 -37.028
  462    HB3  TRP  61           HB3      TRP  61  10.986  16.526 -36.029
  463    HD1  TRP  61           HD1      TRP  61   7.501  17.296 -36.285
  464    HE1  TRP  61           HE1      TRP  61   6.906  19.544 -35.213
  465    HE3  TRP  61           HE3      TRP  61  12.209  19.263 -35.909
  466    HZ2  TRP  61           HZ2      TRP  61   8.311  21.908 -34.284
  467    HZ3  TRP  61           HZ3      TRP  61  12.553  21.523 -34.964
  468    HH2  TRP  61           HH2      TRP  61  10.627  22.832 -34.108
  469    H    VAL  62           H        VAL  62  13.328  16.668 -37.084
  470    HA   VAL  62           HA       VAL  62  13.499  13.884 -38.096
  471    HB   VAL  62           HB       VAL  62  15.806  15.892 -37.994
  472   HG11  VAL  62          HG11      VAL  62  17.075  14.164 -39.187
  473   HG12  VAL  62          HG12      VAL  62  16.517  13.555 -37.631
  474   HG13  VAL  62          HG13      VAL  62  15.680  13.065 -39.125
  475   HG21  VAL  62          HG21      VAL  62  15.829  15.688 -40.497
  476   HG22  VAL  62          HG22      VAL  62  14.271  14.842 -40.406
  477   HG23  VAL  62          HG23      VAL  62  14.417  16.533 -39.872
  478    HA   PRO  63           HA       PRO  63  14.302  13.557 -33.612
  479    HB2  PRO  63           HB2      PRO  63  15.251  10.984 -33.459
  480    HB3  PRO  63           HB3      PRO  63  13.520  11.387 -33.664
  481    HG2  PRO  63           HG2      PRO  63  15.522  10.617 -35.804
  482    HG3  PRO  63           HG3      PRO  63  13.857   9.998 -35.568
  483    HD2  PRO  63           HD2      PRO  63  14.437  11.953 -37.373
  484    HD3  PRO  63           HD3      PRO  63  12.903  11.967 -36.454
  485    H    LEU  64           H        LEU  64  16.082  14.220 -32.441
  486    HA   LEU  64           HA       LEU  64  18.443  14.738 -33.992
  487    HB2  LEU  64           HB2      LEU  64  17.318  16.244 -32.264
  488    HB3  LEU  64           HB3      LEU  64  18.205  15.327 -31.045
  489    HG   LEU  64           HG       LEU  64  19.453  16.811 -33.414
  490   HD11  LEU  64          HD11      LEU  64  20.142  18.505 -31.781
  491   HD12  LEU  64          HD12      LEU  64  18.386  18.366 -31.843
  492   HD13  LEU  64          HD13      LEU  64  19.292  17.637 -30.490
  493   HD21  LEU  64          HD21      LEU  64  20.740  15.552 -30.955
  494   HD22  LEU  64          HD22      LEU  64  20.993  15.086 -32.655
  495   HD23  LEU  64          HD23      LEU  64  21.570  16.642 -32.083
  496    H    GLN  65           H        GLN  65  19.057  12.624 -34.490
  497    HA   GLN  65           HA       GLN  65  20.726  11.197 -32.451
  498    HB2  GLN  65           HB2      GLN  65  18.747  10.126 -34.503
  499    HB3  GLN  65           HB3      GLN  65  19.963   9.104 -33.733
  500    HG2  GLN  65           HG2      GLN  65  19.108   9.789 -31.495
  501    HG3  GLN  65           HG3      GLN  65  17.774  10.642 -32.279
  502   HE21  GLN  65          HE22      GLN  65  17.684   8.375 -30.404
  503   HE22  GLN  65          HE21      GLN  65  16.864   7.072 -31.271
  504    H    GLU  66           H        GLU  66  21.335  13.181 -34.770
  505    HA   GLU  66           HA       GLU  66  22.895  11.872 -36.739
  506    HB2  GLU  66           HB2      GLU  66  23.860  14.021 -37.172
  507    HB3  GLU  66           HB3      GLU  66  22.148  14.235 -36.804
  508    HG2  GLU  66           HG2      GLU  66  22.809  14.848 -34.432
  509    HG3  GLU  66           HG3      GLU  66  24.499  14.798 -34.937
  510    H    ASP  67           H        ASP  67  23.644  12.457 -33.412
  511    HA   ASP  67           HA       ASP  67  26.101  10.835 -33.639
  512    HB2  ASP  67           HB2      ASP  67  26.878  13.193 -33.801
  513    HB3  ASP  67           HB3      ASP  67  26.056  13.569 -32.288
  514    H    ALA  68           H        ALA  68  23.681  12.388 -31.514
  515    HA   ALA  68           HA       ALA  68  24.070  10.688 -29.241
  516    HB1  ALA  68           HB1      ALA  68  21.628  12.291 -30.144
  517    HB2  ALA  68           HB2      ALA  68  21.955  11.695 -28.506
  518    HB3  ALA  68           HB3      ALA  68  22.996  12.937 -29.210
  519    H    ALA  69           H        ALA  69  23.897   9.110 -31.723
  520    HA   ALA  69           HA       ALA  69  21.436   8.100 -32.440
  521    HB1  ALA  69           HB1      ALA  69  23.527   7.860 -33.703
  522    HB2  ALA  69           HB2      ALA  69  24.135   6.701 -32.496
  523    HB3  ALA  69           HB3      ALA  69  22.724   6.293 -33.496
  524    H    ASP  70           H        ASP  70  23.272   7.058 -29.638
  525    HA   ASP  70           HA       ASP  70  21.037   5.259 -28.843
  526    HB2  ASP  70           HB2      ASP  70  22.518   3.605 -28.042
  527    HB3  ASP  70           HB3      ASP  70  23.002   3.960 -29.690
  528    H    GLU  71           H        GLU  71  21.878   8.116 -28.202
  529    HA   GLU  71           HA       GLU  71  21.845   7.936 -25.210
  530    HB2  GLU  71           HB2      GLU  71  23.696   9.683 -26.886
  531    HB3  GLU  71           HB3      GLU  71  23.495   9.794 -25.135
  532    HG2  GLU  71           HG2      GLU  71  24.256   7.411 -24.929
  533    HG3  GLU  71           HG3      GLU  71  24.627   7.422 -26.657
  534    H    SER  72           H        SER  72  20.293   9.168 -27.924
  535    HA   SER  72           HA       SER  72  19.735  11.839 -27.248
  536    HB2  SER  72           HB2      SER  72  17.909  11.615 -28.898
  537    HB3  SER  72           HB3      SER  72  19.424  10.906 -29.464
  538    HG   SER  72           HG       SER  72  17.153   9.532 -28.417
  539    H    GLN  73           H        GLN  73  18.510   9.087 -25.600
  540    HA   GLN  73           HA       GLN  73  16.296  10.675 -24.431
  541    HB2  GLN  73           HB2      GLN  73  14.747   8.815 -24.638
  542    HB3  GLN  73           HB3      GLN  73  15.323   9.371 -26.205
  543    HG2  GLN  73           HG2      GLN  73  16.886   7.420 -26.302
  544    HG3  GLN  73           HG3      GLN  73  16.214   6.842 -24.772
  545   HE21  GLN  73          HE22      GLN  73  15.975   5.021 -26.682
  546   HE22  GLN  73          HE21      GLN  73  14.364   5.009 -27.375
  547    H    ASN  74           H        ASN  74  15.329   9.784 -22.543
  548    HA   ASN  74           HA       ASN  74  15.649   9.804 -20.341
  549    HB2  ASN  74           HB2      ASN  74  14.967   7.491 -20.732
  550    HB3  ASN  74           HB3      ASN  74  16.656   6.983 -20.741
  551   HD21  ASN  74          HD22      ASN  74  15.599   5.622 -18.843
  552   HD22  ASN  74          HD21      ASN  74  15.737   6.405 -17.261
  553    H    ASP  75           H        ASP  75  18.426   7.794 -19.902
  554    HA   ASP  75           HA       ASP  75  20.279   8.184 -18.707
  555    HB2  ASP  75           HB2      ASP  75  20.945   9.086 -20.948
  556    HB3  ASP  75           HB3      ASP  75  20.583  10.709 -20.365
  557    H    TRP  76           H        TRP  76  17.644   9.811 -17.881
  558    HA   TRP  76           HA       TRP  76  18.960  11.727 -15.986
  559    HB2  TRP  76           HB2      TRP  76  16.183  11.764 -17.203
  560    HB3  TRP  76           HB3      TRP  76  16.805  12.914 -16.034
  561    HD1  TRP  76           HD1      TRP  76  19.649  12.647 -18.159
  562    HE1  TRP  76           HE1      TRP  76  19.661  14.298 -20.111
  563    HE3  TRP  76           HE3      TRP  76  14.730  14.131 -18.057
  564    HZ2  TRP  76           HZ2      TRP  76  17.876  16.168 -21.314
  565    HZ3  TRP  76           HZ3      TRP  76  13.942  15.901 -19.599
  566    HH2  TRP  76           HH2      TRP  76  15.495  16.919 -21.242
  567    H    ASP  77           H        ASP  77  16.512   9.098 -16.156
  568    HA   ASP  77           HA       ASP  77  16.737   8.832 -13.231
  569    HB2  ASP  77           HB2      ASP  77  14.558   9.257 -12.661
  570    HB3  ASP  77           HB3      ASP  77  14.832  10.520 -13.839
  571    H    GLU  78           H        GLU  78  15.474   7.051 -12.343
  572    HA   GLU  78           HA       GLU  78  14.525   4.943 -14.155
  573    HB2  GLU  78           HB2      GLU  78  15.798   3.179 -13.041
  574    HB3  GLU  78           HB3      GLU  78  16.864   4.342 -13.814
  575    HG2  GLU  78           HG2      GLU  78  17.297   5.423 -11.602
  576    HG3  GLU  78           HG3      GLU  78  16.257   4.232 -10.825
  577    H    GLU  79           H        GLU  79  13.260   6.909 -12.413
  578    HA   GLU  79           HA       GLU  79  11.845   5.200 -10.416
  579    HB2  GLU  79           HB2      GLU  79  13.198   7.832  -9.708
  580    HB3  GLU  79           HB3      GLU  79  12.220   6.864  -8.620
  581    HG2  GLU  79           HG2      GLU  79  14.916   6.038  -9.762
  582    HG3  GLU  79           HG3      GLU  79  14.616   6.721  -8.176
  583    H    LEU  80           H        LEU  80  11.524   7.534 -12.847
  584    HA   LEU  80           HA       LEU  80   9.207   8.844 -11.520
  585    HB2  LEU  80           HB2      LEU  80  10.859   9.859 -13.841
  586    HB3  LEU  80           HB3      LEU  80   9.633  10.746 -12.956
  587    HG   LEU  80           HG       LEU  80  12.352   9.919 -11.879
  588   HD11  LEU  80          HD11      LEU  80  12.300  11.734 -13.567
  589   HD12  LEU  80          HD12      LEU  80  11.236  12.664 -12.488
  590   HD13  LEU  80          HD13      LEU  80  12.889  12.215 -11.984
  591   HD21  LEU  80          HD21      LEU  80  11.772  11.311  -9.923
  592   HD22  LEU  80          HD22      LEU  80  10.121  11.524 -10.551
  593   HD23  LEU  80          HD23      LEU  80  10.692   9.920 -10.042
  594    H    SER  81           H        SER  81   7.558   9.664 -12.791
  595    HA   SER  81           HA       SER  81   6.944   8.544 -15.485
  596    HB2  SER  81           HB2      SER  81   5.590   7.320 -13.833
  597    HB3  SER  81           HB3      SER  81   5.045   8.844 -13.109
  598    HG   SER  81           HG       SER  81   3.727   9.176 -14.741
  599    H    ILE  82           H        ILE  82   6.346  10.174 -16.883
  600    HA   ILE  82           HA       ILE  82   6.342  12.965 -15.815
  601    HB   ILE  82           HB       ILE  82   7.442  11.636 -18.265
  602   HG12  ILE  82          HG12      ILE  82   9.259  13.231 -17.968
  603   HG13  ILE  82          HG13      ILE  82   8.362  14.112 -16.740
  604   HG21  ILE  82          HG21      ILE  82   5.895  13.168 -19.347
  605   HG22  ILE  82          HG22      ILE  82   6.454  14.518 -18.331
  606   HG23  ILE  82          HG23      ILE  82   7.540  13.763 -19.519
  607   HD11  ILE  82          HD11      ILE  82   8.613  12.269 -15.157
  608   HD12  ILE  82          HD12      ILE  82   9.326  11.233 -16.422
  609   HD13  ILE  82          HD13      ILE  82  10.191  12.668 -15.836
  610    H    HIS  83           H        HIS  83   4.793  14.368 -16.317
  611    HA   HIS  83           HA       HIS  83   2.458  13.542 -17.962
  612    HB2  HIS  83           HB2      HIS  83   2.343  14.660 -15.137
  613    HB3  HIS  83           HB3      HIS  83   0.956  14.308 -16.164
  614    HD1  HIS  83           HD1      HIS  83   0.243  11.699 -16.330
  615    HD2  HIS  83           HD2      HIS  83   3.689  12.524 -14.062
  616    HE1  HIS  83           HE1      HIS  83   0.845   9.537 -15.127
  617    H    LEU  84           H        LEU  84   1.275  15.347 -18.817
  618    HA   LEU  84           HA       LEU  84   2.714  17.977 -18.749
  619    HB2  LEU  84           HB2      LEU  84   1.776  16.392 -21.173
  620    HB3  LEU  84           HB3      LEU  84   2.338  18.055 -21.231
  621    HG   LEU  84           HG       LEU  84   4.043  15.652 -20.460
  622   HD11  LEU  84          HD11      LEU  84   3.432  15.773 -22.857
  623   HD12  LEU  84          HD12      LEU  84   4.011  17.451 -22.921
  624   HD13  LEU  84          HD13      LEU  84   5.146  16.120 -22.608
  625   HD21  LEU  84          HD21      LEU  84   4.878  17.644 -19.308
  626   HD22  LEU  84          HD22      LEU  84   5.939  17.269 -20.664
  627   HD23  LEU  84          HD23      LEU  84   4.770  18.601 -20.804
  628    H    GLN  85           H        GLN  85   1.581  19.774 -19.522
  629    HA   GLN  85           HA       GLN  85  -1.204  19.623 -20.283
  630    HB2  GLN  85           HB2      GLN  85  -1.985  21.256 -18.584
  631    HB3  GLN  85           HB3      GLN  85  -1.665  19.660 -17.938
  632    HG2  GLN  85           HG2      GLN  85   0.572  21.649 -17.727
  633    HG3  GLN  85           HG3      GLN  85  -0.859  21.974 -16.767
  634   HE21  GLN  85          HE22      GLN  85   1.947  19.839 -17.085
  635   HE22  GLN  85          HE21      GLN  85   1.632  18.999 -15.565
  636    HA   PRO  86           HA       PRO  86  -2.764  21.048 -21.165
  637    HB2  PRO  86           HB2      PRO  86  -3.421  22.221 -23.516
  638    HB3  PRO  86           HB3      PRO  86  -3.360  23.145 -21.986
  639    HG2  PRO  86           HG2      PRO  86  -1.199  22.938 -24.113
  640    HG3  PRO  86           HG3      PRO  86  -1.879  24.423 -23.372
  641    HD2  PRO  86           HD2      PRO  86   0.430  23.260 -22.472
  642    HD3  PRO  86           HD3      PRO  86  -0.713  24.065 -21.361
  643    H    PHE  87           H        PHE  87   0.140  20.589 -22.919
  644    HA   PHE  87           HA       PHE  87  -0.645  18.808 -25.014
  645    HB2  PHE  87           HB2      PHE  87   1.959  19.151 -23.465
  646    HB3  PHE  87           HB3      PHE  87   1.792  18.192 -24.924
  647    HD1  PHE  87           HD2      PHE  87   1.172  19.266 -27.111
  648    HD2  PHE  87           HD1      PHE  87   2.213  21.565 -23.609
  649    HE1  PHE  87           HE2      PHE  87   1.643  21.244 -28.541
  650    HE2  PHE  87           HE1      PHE  87   2.659  23.545 -25.042
  651    HZ   PHE  87           HZ       PHE  87   2.401  23.374 -27.508
  652    H    LYS  88           H        LYS  88   0.348  16.531 -25.023
  653    HA   LYS  88           HA       LYS  88  -0.692  15.031 -22.663
  654    HB2  LYS  88           HB2      LYS  88  -1.502  13.328 -24.173
  655    HB3  LYS  88           HB3      LYS  88  -2.200  14.906 -24.532
  656    HG2  LYS  88           HG2      LYS  88  -0.503  15.154 -26.411
  657    HG3  LYS  88           HG3      LYS  88  -0.013  13.482 -26.119
  658    HD2  LYS  88           HD2      LYS  88  -2.816  14.402 -26.878
  659    HD3  LYS  88           HD3      LYS  88  -1.612  13.743 -27.994
  660    HE2  LYS  88           HE2      LYS  88  -1.579  11.611 -26.702
  661    HE3  LYS  88           HE3      LYS  88  -2.812  12.256 -25.611
  662    HZ1  LYS  88           HZ1      LYS  88  -3.810  10.890 -27.352
  663    HZ2  LYS  88           HZ2      LYS  88  -4.320  12.426 -27.523
  664    HZ3  LYS  88           HZ3      LYS  88  -3.185  11.824 -28.529
  665    HA   PRO  89           HA       PRO  89   3.396  13.188 -22.593
  666    HB2  PRO  89           HB2      PRO  89   3.141  11.510 -20.488
  667    HB3  PRO  89           HB3      PRO  89   3.027  13.280 -20.289
  668    HG2  PRO  89           HG2      PRO  89   0.737  11.296 -20.579
  669    HG3  PRO  89           HG3      PRO  89   0.943  12.549 -19.321
  670    HD2  PRO  89           HD2      PRO  89  -0.555  12.950 -21.579
  671    HD3  PRO  89           HD3      PRO  89   0.368  14.271 -20.803
  672    H    ASP  90           H        ASP  90   2.826  12.339 -24.800
  673    HA   ASP  90           HA       ASP  90   2.583   9.355 -24.815
  674    HB2  ASP  90           HB2      ASP  90   0.382  10.376 -25.299
  675    HB3  ASP  90           HB3      ASP  90   1.108  11.339 -26.588
  676    H    ASP  91           H        ASP  91   3.703   8.297 -26.438
  677    HA   ASP  91           HA       ASP  91   6.009   9.683 -27.534
  678    HB2  ASP  91           HB2      ASP  91   5.850   7.338 -26.454
  679    HB3  ASP  91           HB3      ASP  91   5.262   6.780 -28.009
  680    H    SER  92           H        SER  92   4.254  11.051 -28.676
  681    HA   SER  92           HA       SER  92   2.684  10.173 -30.838
  682    HB2  SER  92           HB2      SER  92   2.291  12.568 -31.177
  683    HB3  SER  92           HB3      SER  92   2.304  12.180 -29.445
  684    HG   SER  92           HG       SER  92   3.572  14.021 -29.898
  685    H    ASN  93           H        ASN  93   6.036  10.564 -31.000
  686    HA   ASN  93           HA       ASN  93   7.578  10.830 -32.605
  687    HB2  ASN  93           HB2      ASN  93   6.264   8.972 -33.689
  688    HB3  ASN  93           HB3      ASN  93   5.473  10.195 -34.684
  689   HD21  ASN  93          HD22      ASN  93   6.335   9.599 -36.691
  690   HD22  ASN  93          HD21      ASN  93   8.056   9.637 -37.024
  691    H    GLN  94           H        GLN  94   5.982  13.119 -31.683
  692    HA   GLN  94           HA       GLN  94   7.279  15.038 -33.482
  693    HB2  GLN  94           HB2      GLN  94   5.405  16.506 -33.699
  694    HB3  GLN  94           HB3      GLN  94   4.869  14.939 -34.246
  695    HG2  GLN  94           HG2      GLN  94   3.433  14.650 -32.418
  696    HG3  GLN  94           HG3      GLN  94   4.346  15.735 -31.370
  697   HE21  GLN  94          HE22      GLN  94   3.878  17.921 -31.271
  698   HE22  GLN  94          HE21      GLN  94   2.564  18.621 -32.214
  699    HA   PRO  95           HA       PRO  95   8.221  16.861 -29.513
  700    HB2  PRO  95           HB2      PRO  95   8.088  19.580 -29.893
  701    HB3  PRO  95           HB3      PRO  95   9.412  18.517 -30.481
  702    HG2  PRO  95           HG2      PRO  95   7.017  19.510 -32.033
  703    HG3  PRO  95           HG3      PRO  95   8.753  19.539 -32.496
  704    HD2  PRO  95           HD2      PRO  95   7.117  17.578 -33.358
  705    HD3  PRO  95           HD3      PRO  95   8.787  17.200 -32.868
  706    H    GLN  96           H        GLN  96   7.234  17.320 -27.683
  707    HA   GLN  96           HA       GLN  96   4.386  18.229 -27.563
  708    HB2  GLN  96           HB2      GLN  96   6.183  16.496 -25.875
  709    HB3  GLN  96           HB3      GLN  96   5.022  17.499 -25.028
  710    HG2  GLN  96           HG2      GLN  96   4.137  15.269 -25.412
  711    HG3  GLN  96           HG3      GLN  96   3.151  16.503 -26.197
  712   HE21  GLN  96          HE22      GLN  96   5.355  13.747 -26.756
  713   HE22  GLN  96          HE21      GLN  96   4.992  13.670 -28.478
  714    H    VAL  97           H        VAL  97   7.612  19.355 -27.077
  715    HA   VAL  97           HA       VAL  97   6.578  21.933 -25.962
  716    HB   VAL  97           HB       VAL  97   9.134  20.471 -25.157
  717   HG11  VAL  97          HG11      VAL  97   9.508  22.397 -23.617
  718   HG12  VAL  97          HG12      VAL  97   9.644  22.857 -25.309
  719   HG13  VAL  97          HG13      VAL  97   8.167  23.261 -24.399
  720   HG21  VAL  97          HG21      VAL  97   8.179  20.572 -22.875
  721   HG22  VAL  97          HG22      VAL  97   6.699  21.306 -23.528
  722   HG23  VAL  97          HG23      VAL  97   7.142  19.642 -23.954
  723    H    VAL  98           H        VAL  98   7.482  23.738 -26.971
  724    HA   VAL  98           HA       VAL  98   9.415  23.272 -29.189
  725    HB   VAL  98           HB       VAL  98   6.706  24.608 -29.423
  726   HG11  VAL  98          HG11      VAL  98   8.282  26.014 -30.673
  727   HG12  VAL  98          HG12      VAL  98   8.986  24.573 -31.453
  728   HG13  VAL  98          HG13      VAL  98   7.315  25.065 -31.794
  729   HG21  VAL  98          HG21      VAL  98   7.993  22.262 -30.883
  730   HG22  VAL  98          HG22      VAL  98   6.662  22.167 -29.710
  731   HG23  VAL  98          HG23      VAL  98   6.405  22.964 -31.260
  732    H    ILE  99           H        ILE  99  10.700  24.886 -29.722
  733    HA   ILE  99           HA       ILE  99  11.022  27.205 -27.866
  734    HB   ILE  99           HB       ILE  99  13.175  25.362 -29.020
  735   HG12  ILE  99          HG12      ILE  99  13.630  24.928 -26.498
  736   HG13  ILE  99          HG13      ILE  99  11.953  25.384 -26.239
  737   HG21  ILE  99          HG21      ILE  99  13.958  27.660 -28.706
  738   HG22  ILE  99          HG22      ILE  99  13.334  27.674 -27.043
  739   HG23  ILE  99          HG23      ILE  99  14.666  26.596 -27.514
  740   HD11  ILE  99          HD11      ILE  99  12.490  22.898 -26.443
  741   HD12  ILE  99          HD12      ILE  99  11.201  23.446 -27.507
  742   HD13  ILE  99          HD13      ILE  99  12.830  23.179 -28.165
  743    H    LEU 100           H        LEU 100  11.104  29.074 -28.940
  744    HA   LEU 100           HA       LEU 100  11.395  29.256 -31.850
  745    HB2  LEU 100           HB2      LEU 100  11.089  31.303 -29.619
  746    HB3  LEU 100           HB3      LEU 100  11.239  31.743 -31.298
  747    HG   LEU 100           HG       LEU 100   8.987  31.961 -30.645
  748   HD11  LEU 100          HD11      LEU 100   9.140  29.482 -32.395
  749   HD12  LEU 100          HD12      LEU 100   7.874  30.719 -32.382
  750   HD13  LEU 100          HD13      LEU 100   9.495  31.136 -32.959
  751   HD21  LEU 100          HD21      LEU 100   8.799  28.993 -30.014
  752   HD22  LEU 100          HD22      LEU 100   8.783  30.317 -28.824
  753   HD23  LEU 100          HD23      LEU 100   7.486  30.177 -30.009
  754    H    ALA 101           H        ALA 101  12.934  30.614 -32.847
  755    HA   ALA 101           HA       ALA 101  15.631  30.003 -32.251
  756    HB1  ALA 101           HB1      ALA 101  16.104  31.421 -34.208
  757    HB2  ALA 101           HB2      ALA 101  14.711  30.368 -34.507
  758    HB3  ALA 101           HB3      ALA 101  14.462  32.092 -34.130
  759    H    ASP 102           H        ASP 102  13.841  32.458 -30.767
  760    HA   ASP 102           HA       ASP 102  16.287  34.027 -30.040
  761    HB2  ASP 102           HB2      ASP 102  13.360  34.848 -30.150
  762    HB3  ASP 102           HB3      ASP 102  14.669  35.873 -29.570
  763    H    GLY 103           H        GLY 103  14.710  31.522 -28.758
  764    HA2  GLY 103           HA2      GLY 103  14.954  30.699 -26.594
  765    HA3  GLY 103           HA3      GLY 103  15.388  32.296 -25.995
  766    H    GLN 104           H        GLN 104  12.444  32.273 -27.785
  767    HA   GLN 104           HA       GLN 104  10.767  32.511 -25.370
  768    HB2  GLN 104           HB2      GLN 104  10.045  32.697 -28.321
  769    HB3  GLN 104           HB3      GLN 104   8.957  32.983 -26.969
  770    HG2  GLN 104           HG2      GLN 104  10.276  34.923 -26.254
  771    HG3  GLN 104           HG3      GLN 104  11.483  34.611 -27.511
  772   HE21  GLN 104          HE22      GLN 104  10.822  34.800 -29.793
  773   HE22  GLN 104          HE21      GLN 104   9.501  35.886 -30.188
  774    H    ILE 105           H        ILE 105   9.154  30.964 -24.938
  775    HA   ILE 105           HA       ILE 105   9.538  28.268 -26.207
  776    HB   ILE 105           HB       ILE 105   9.163  28.596 -23.237
  777   HG12  ILE 105          HG12      ILE 105  11.194  29.852 -23.550
  778   HG13  ILE 105          HG13      ILE 105  11.472  28.345 -22.709
  779   HG21  ILE 105          HG21      ILE 105   8.745  26.393 -24.183
  780   HG22  ILE 105          HG22      ILE 105  10.320  26.403 -24.993
  781   HG23  ILE 105          HG23      ILE 105  10.233  26.337 -23.221
  782   HD11  ILE 105          HD11      ILE 105  13.295  28.808 -24.196
  783   HD12  ILE 105          HD12      ILE 105  12.443  27.378 -24.799
  784   HD13  ILE 105          HD13      ILE 105  12.230  28.969 -25.579
  785    H    THR 106           H        THR 106   7.619  27.296 -26.752
  786    HA   THR 106           HA       THR 106   5.151  28.581 -26.624
  787    HB   THR 106           HB       THR 106   5.864  25.647 -26.975
  788    HG1  THR 106           HG1      THR 106   5.504  27.726 -28.873
  789   HG21  THR 106          HG21      THR 106   3.439  27.247 -27.866
  790   HG22  THR 106          HG22      THR 106   3.850  25.596 -28.405
  791   HG23  THR 106          HG23      THR 106   3.459  25.896 -26.701
  792    HA   PRO 107           HA       PRO 107   4.517  28.054 -22.215
  793    HB2  PRO 107           HB2      PRO 107   1.640  28.622 -22.968
  794    HB3  PRO 107           HB3      PRO 107   2.585  29.246 -21.577
  795    HG2  PRO 107           HG2      PRO 107   2.281  30.769 -23.788
  796    HG3  PRO 107           HG3      PRO 107   3.889  30.652 -23.004
  797    HD2  PRO 107           HD2      PRO 107   2.892  29.227 -25.474
  798    HD3  PRO 107           HD3      PRO 107   4.483  29.979 -25.154
  799    H    PHE 108           H        PHE 108   4.193  26.410 -20.881
  800    HA   PHE 108           HA       PHE 108   2.066  24.472 -20.970
  801    HB2  PHE 108           HB2      PHE 108   3.258  22.533 -21.573
  802    HB3  PHE 108           HB3      PHE 108   3.677  23.676 -22.823
  803    HD1  PHE 108           HD1      PHE 108   5.928  25.056 -22.397
  804    HD2  PHE 108           HD2      PHE 108   4.972  21.306 -20.504
  805    HE1  PHE 108           HE1      PHE 108   8.325  24.657 -22.009
  806    HE2  PHE 108           HE2      PHE 108   7.396  20.920 -20.096
  807    HZ   PHE 108           HZ       PHE 108   9.067  22.585 -20.837
  808    H    SER 109           H        SER 109   2.599  22.644 -19.373
  809    HA   SER 109           HA       SER 109   4.640  23.309 -17.380
  810    HB2  SER 109           HB2      SER 109   2.811  24.395 -16.325
  811    HB3  SER 109           HB3      SER 109   1.699  23.079 -16.678
  812    HG   SER 109           HG       SER 109   3.989  22.870 -14.996
  813    H    LEU 110           H        LEU 110   5.371  21.534 -16.246
  814    HA   LEU 110           HA       LEU 110   4.769  18.841 -17.397
  815    HB2  LEU 110           HB2      LEU 110   6.559  19.415 -18.690
  816    HB3  LEU 110           HB3      LEU 110   7.205  20.564 -17.530
  817    HG   LEU 110           HG       LEU 110   8.200  18.782 -16.206
  818   HD11  LEU 110          HD11      LEU 110   6.684  16.846 -16.780
  819   HD12  LEU 110          HD12      LEU 110   7.286  16.899 -18.444
  820   HD13  LEU 110          HD13      LEU 110   8.376  16.481 -17.106
  821   HD21  LEU 110          HD21      LEU 110   8.888  18.609 -19.171
  822   HD22  LEU 110          HD22      LEU 110   9.441  19.873 -18.056
  823   HD23  LEU 110          HD23      LEU 110   9.955  18.196 -17.813
  824    H    LEU 111           H        LEU 111   4.414  17.408 -15.870
  825    HA   LEU 111           HA       LEU 111   5.314  17.929 -13.070
  826    HB2  LEU 111           HB2      LEU 111   2.955  18.230 -13.379
  827    HB3  LEU 111           HB3      LEU 111   2.768  16.696 -14.207
  828    HG   LEU 111           HG       LEU 111   3.885  16.712 -11.404
  829   HD11  LEU 111          HD11      LEU 111   1.614  16.654 -10.470
  830   HD12  LEU 111          HD12      LEU 111   1.943  18.172 -11.323
  831   HD13  LEU 111          HD13      LEU 111   0.930  16.930 -12.092
  832   HD21  LEU 111          HD21      LEU 111   1.909  14.808 -12.761
  833   HD22  LEU 111          HD22      LEU 111   3.652  14.515 -12.690
  834   HD23  LEU 111          HD23      LEU 111   2.715  14.568 -11.203
  835    H    MET 112           H        MET 112   6.063  16.215 -11.859
  836    HA   MET 112           HA       MET 112   6.658  13.666 -13.284
  837    HB2  MET 112           HB2      MET 112   8.639  15.279 -11.621
  838    HB3  MET 112           HB3      MET 112   8.908  13.672 -12.321
  839    HG2  MET 112           HG2      MET 112   8.370  14.707 -14.587
  840    HG3  MET 112           HG3      MET 112   8.473  16.284 -13.818
  841    HE1  MET 112           HE1      MET 112  10.642  17.371 -12.907
  842    HE2  MET 112           HE2      MET 112  11.034  16.006 -11.828
  843    HE3  MET 112           HE3      MET 112  12.251  16.620 -12.964
  844    H    ALA 113           H        ALA 113   6.404  11.906 -12.109
  845    HA   ALA 113           HA       ALA 113   5.668  12.074  -9.216
  846    HB1  ALA 113           HB1      ALA 113   3.775  10.540  -9.826
  847    HB2  ALA 113           HB2      ALA 113   3.637  12.102 -10.658
  848    HB3  ALA 113           HB3      ALA 113   4.227  10.675 -11.531
  849    H    ASN 114           H        ASN 114   5.880   9.980  -8.078
  850    HA   ASN 114           HA       ASN 114   8.204   8.448  -8.885
  851    HB2  ASN 114           HB2      ASN 114   7.807   8.548  -6.560
  852    HB3  ASN 114           HB3      ASN 114   6.093   8.157  -6.737
  853   HD21  ASN 114          HD22      ASN 114   9.275   6.664  -7.643
  854   HD22  ASN 114          HD21      ASN 114   8.722   5.034  -7.278
  855    H    ALA 115           H        ALA 115   8.323   6.652 -10.144
  856    HA   ALA 115           HA       ALA 115   6.365   5.968 -11.992
  857    HB1  ALA 115           HB1      ALA 115   8.758   5.575 -12.282
  858    HB2  ALA 115           HB2      ALA 115   8.752   4.358 -10.990
  859    HB3  ALA 115           HB3      ALA 115   7.876   4.059 -12.508
  860    H    GLY 116           H        GLY 116   6.831   4.387  -8.804
  861    HA2  GLY 116           HA2      GLY 116   5.100   2.127  -9.525
  862    HA3  GLY 116           HA3      GLY 116   5.921   2.413  -7.996
  863    H    THR 117           H        THR 117   4.896   4.810  -7.097
  864    HA   THR 117           HA       THR 117   2.180   4.092  -6.287
  865    HB   THR 117           HB       THR 117   2.316   6.234  -5.025
  866    HG1  THR 117           HG1      THR 117   4.981   6.394  -5.870
  867   HG21  THR 117          HG21      THR 117   3.174   4.194  -3.949
  868   HG22  THR 117          HG22      THR 117   4.772   4.491  -4.660
  869   HG23  THR 117          HG23      THR 117   4.103   5.630  -3.473
  870    H    GLY 118           H        GLY 118   3.590   6.345  -8.636
  871    HA2  GLY 118           HA2      GLY 118   2.596   7.747 -10.175
  872    HA3  GLY 118           HA3      GLY 118   0.988   7.214  -9.660
  873    H    GLU 119           H        GLU 119   2.908   8.176  -6.954
  874    HA   GLU 119           HA       GLU 119   1.258  10.458  -6.379
  875    HB2  GLU 119           HB2      GLU 119   2.289   8.773  -4.758
  876    HB3  GLU 119           HB3      GLU 119   3.852   9.511  -5.094
  877    HG2  GLU 119           HG2      GLU 119   3.246  10.561  -3.159
  878    HG3  GLU 119           HG3      GLU 119   2.710  11.741  -4.348
  879    HA   PRO 120           HA       PRO 120   3.911  13.302  -8.687
  880    HB2  PRO 120           HB2      PRO 120   2.958  15.723  -7.848
  881    HB3  PRO 120           HB3      PRO 120   2.105  14.661  -9.000
  882    HG2  PRO 120           HG2      PRO 120   1.647  14.884  -6.012
  883    HG3  PRO 120           HG3      PRO 120   0.425  14.895  -7.325
  884    HD2  PRO 120           HD2      PRO 120   1.007  12.646  -5.916
  885    HD3  PRO 120           HD3      PRO 120   0.645  12.563  -7.667
  886    H    LEU 121           H        LEU 121   5.721  14.468  -8.392
  887    HA   LEU 121           HA       LEU 121   6.882  14.637  -5.648
  888    HB2  LEU 121           HB2      LEU 121   7.653  13.292  -8.178
  889    HB3  LEU 121           HB3      LEU 121   8.897  14.391  -7.661
  890    HG   LEU 121           HG       LEU 121   9.367  12.209  -6.914
  891   HD11  LEU 121          HD11      LEU 121   8.520  13.816  -4.462
  892   HD12  LEU 121          HD12      LEU 121   9.840  12.647  -4.603
  893   HD13  LEU 121          HD13      LEU 121   9.923  14.210  -5.475
  894   HD21  LEU 121          HD21      LEU 121   7.070  11.289  -6.721
  895   HD22  LEU 121          HD22      LEU 121   8.030  10.981  -5.263
  896   HD23  LEU 121          HD23      LEU 121   6.797  12.258  -5.266
  897    H    LEU 122           H        LEU 122   7.002  16.039  -8.910
  898    HA   LEU 122           HA       LEU 122   7.846  18.716  -7.913
  899    HB2  LEU 122           HB2      LEU 122   9.787  17.018  -8.155
  900    HB3  LEU 122           HB3      LEU 122   9.513  17.084  -9.885
  901    HG   LEU 122           HG       LEU 122  10.212  19.505  -8.151
  902   HD11  LEU 122          HD11      LEU 122  12.060  17.807  -9.858
  903   HD12  LEU 122          HD12      LEU 122  12.504  19.188  -8.823
  904   HD13  LEU 122          HD13      LEU 122  11.936  17.695  -8.085
  905   HD21  LEU 122          HD21      LEU 122   9.968  19.064 -11.142
  906   HD22  LEU 122          HD22      LEU 122   9.519  20.485 -10.161
  907   HD23  LEU 122          HD23      LEU 122  11.198  20.175 -10.542
  908    H    THR 123           H        THR 123   7.482  20.339  -9.429
  909    HA   THR 123           HA       THR 123   6.282  19.601 -12.040
  910    HB   THR 123           HB       THR 123   4.891  21.585 -10.198
  911    HG1  THR 123           HG1      THR 123   4.596  18.826 -10.489
  912   HG21  THR 123          HG21      THR 123   4.385  21.919 -12.563
  913   HG22  THR 123          HG22      THR 123   4.029  20.183 -12.746
  914   HG23  THR 123          HG23      THR 123   3.005  21.211 -11.722
  915    H    LEU 124           H        LEU 124   6.570  21.043 -13.615
  916    HA   LEU 124           HA       LEU 124   8.268  23.429 -13.117
  917    HB2  LEU 124           HB2      LEU 124   8.333  21.503 -15.479
  918    HB3  LEU 124           HB3      LEU 124   9.362  22.917 -15.264
  919    HG   LEU 124           HG       LEU 124   9.417  20.391 -13.551
  920   HD11  LEU 124          HD11      LEU 124  11.607  20.032 -14.592
  921   HD12  LEU 124          HD12      LEU 124  10.347  20.120 -15.828
  922   HD13  LEU 124          HD13      LEU 124  11.409  21.519 -15.550
  923   HD21  LEU 124          HD21      LEU 124  11.534  21.384 -12.638
  924   HD22  LEU 124          HD22      LEU 124  11.105  22.921 -13.425
  925   HD23  LEU 124          HD23      LEU 124  10.067  22.228 -12.156
  926    H    VAL 125           H        VAL 125   7.897  25.177 -14.491
  927    HA   VAL 125           HA       VAL 125   5.292  25.203 -15.967
  928    HB   VAL 125           HB       VAL 125   5.935  27.150 -13.722
  929   HG11  VAL 125          HG11      VAL 125   4.485  28.139 -15.463
  930   HG12  VAL 125          HG12      VAL 125   3.390  26.739 -15.358
  931   HG13  VAL 125          HG13      VAL 125   3.580  27.853 -13.986
  932   HG21  VAL 125          HG21      VAL 125   5.389  24.977 -12.706
  933   HG22  VAL 125          HG22      VAL 125   4.066  26.109 -12.484
  934   HG23  VAL 125          HG23      VAL 125   3.943  24.843 -13.729
  935    H    CYS 126           H        CYS 126   5.206  26.515 -17.706
  936    HA   CYS 126           HA       CYS 126   7.444  28.454 -18.154
  937    HB2  CYS 126           HB2      CYS 126   7.264  26.421 -19.673
  938    HB3  CYS 126           HB3      CYS 126   5.692  27.024 -20.188
  939    HG   CYS 126           HG       CYS 126   7.472  27.567 -22.034
  940    H    SER 127           H        SER 127   6.982  30.461 -19.006
  941    HA   SER 127           HA       SER 127   4.144  31.406 -19.060
  942    HB2  SER 127           HB2      SER 127   4.977  33.499 -18.057
  943    HB3  SER 127           HB3      SER 127   5.285  32.099 -17.015
  944    HG   SER 127           HG       SER 127   7.126  33.463 -17.216
  945    H    GLY 128           H        GLY 128   6.700  30.865 -21.080
  946    HA2  GLY 128           HA2      GLY 128   6.106  31.596 -23.408
  947    HA3  GLY 128           HA3      GLY 128   6.147  33.252 -22.814
  948    H    SER 129           H        SER 129   8.694  32.125 -21.144
  949    HA   SER 129           HA       SER 129  10.686  32.137 -23.325
  950    HB2  SER 129           HB2      SER 129  10.001  34.534 -22.868
  951    HB3  SER 129           HB3      SER 129  10.677  34.341 -21.238
  952    HG   SER 129           HG       SER 129  12.187  35.207 -22.751
  953    H    TRP 130           H        TRP 130  12.808  31.775 -22.697
  954    HA   TRP 130           HA       TRP 130  13.304  29.736 -20.887
  955    HB2  TRP 130           HB2      TRP 130  14.724  30.113 -22.721
  956    HB3  TRP 130           HB3      TRP 130  14.968  31.801 -22.327
  957    HD1  TRP 130           HD1      TRP 130  16.986  32.482 -20.966
  958    HE1  TRP 130           HE1      TRP 130  18.917  31.286 -19.775
  959    HE3  TRP 130           HE3      TRP 130  15.314  27.662 -21.369
  960    HZ2  TRP 130           HZ2      TRP 130  19.674  28.564 -19.123
  961    HZ3  TRP 130           HZ3      TRP 130  16.647  25.804 -20.393
  962    HH2  TRP 130           HH2      TRP 130  18.811  26.246 -19.288
  963    HA   PRO 131           HA       PRO 131  13.936  28.596 -19.365
  964    HB2  PRO 131           HB2      PRO 131  14.787  27.691 -17.003
  965    HB3  PRO 131           HB3      PRO 131  15.936  28.455 -18.133
  966    HG2  PRO 131           HG2      PRO 131  14.596  29.695 -15.728
  967    HG3  PRO 131           HG3      PRO 131  16.320  29.759 -16.224
  968    HD2  PRO 131           HD2      PRO 131  14.416  31.737 -16.813
  969    HD3  PRO 131           HD3      PRO 131  15.901  31.452 -17.762
  970    H    LEU 132           H        LEU 132  12.716  26.872 -17.879
  971    HA   LEU 132           HA       LEU 132  10.123  27.900 -17.053
  972    HB2  LEU 132           HB2      LEU 132  11.435  25.163 -17.165
  973    HB3  LEU 132           HB3      LEU 132  10.056  25.419 -16.110
  974    HG   LEU 132           HG       LEU 132   8.855  26.457 -18.120
  975   HD11  LEU 132          HD11      LEU 132  10.767  26.644 -19.664
  976   HD12  LEU 132          HD12      LEU 132  10.950  24.871 -19.636
  977   HD13  LEU 132          HD13      LEU 132   9.497  25.622 -20.323
  978   HD21  LEU 132          HD21      LEU 132   7.985  24.330 -18.828
  979   HD22  LEU 132          HD22      LEU 132   9.424  23.477 -18.225
  980   HD23  LEU 132          HD23      LEU 132   8.299  24.260 -17.103
  981    H    ASP 133           H        ASP 133   9.209  27.454 -15.022
  982    HA   ASP 133           HA       ASP 133  10.944  28.088 -12.678
  983    HB2  ASP 133           HB2      ASP 133   8.953  29.534 -13.189
  984    HB3  ASP 133           HB3      ASP 133   7.916  28.120 -12.996
  985    H    GLN 134           H        GLN 134  10.179  26.893 -10.645
  986    HA   GLN 134           HA       GLN 134   9.634  24.011 -11.097
  987    HB2  GLN 134           HB2      GLN 134  12.044  24.371 -11.378
  988    HB3  GLN 134           HB3      GLN 134  12.121  25.284  -9.868
  989    HG2  GLN 134           HG2      GLN 134  11.640  23.255  -8.567
  990    HG3  GLN 134           HG3      GLN 134  11.367  22.351 -10.054
  991   HE21  GLN 134          HE22      GLN 134  13.083  20.823  -9.868
  992   HE22  GLN 134          HE21      GLN 134  14.763  21.331  -9.821
  993    H    THR 135           H        THR 135   8.675  22.957  -9.399
  994    HA   THR 135           HA       THR 135   8.679  24.057  -6.668
  995    HB   THR 135           HB       THR 135   6.808  25.200  -7.856
  996    HG1  THR 135           HG1      THR 135   5.983  25.192  -6.006
  997   HG21  THR 135          HG21      THR 135   5.488  22.457  -7.977
  998   HG22  THR 135          HG22      THR 135   4.749  24.022  -8.379
  999   HG23  THR 135          HG23      THR 135   6.057  23.402  -9.379
 1000    H    LEU 136           H        LEU 136   7.556  22.518  -5.162
 1001    HA   LEU 136           HA       LEU 136   7.987  19.673  -5.963
 1002    HB2  LEU 136           HB2      LEU 136   7.417  20.983  -3.272
 1003    HB3  LEU 136           HB3      LEU 136   7.401  19.253  -3.544
 1004    HG   LEU 136           HG       LEU 136   9.434  19.785  -2.516
 1005   HD11  LEU 136          HD11      LEU 136  11.104  18.910  -4.028
 1006   HD12  LEU 136          HD12      LEU 136   9.566  18.071  -4.302
 1007   HD13  LEU 136          HD13      LEU 136  10.119  19.319  -5.442
 1008   HD21  LEU 136          HD21      LEU 136   9.592  22.193  -3.160
 1009   HD22  LEU 136          HD22      LEU 136  11.117  21.301  -3.292
 1010   HD23  LEU 136          HD23      LEU 136  10.201  21.688  -4.756
 1011    H    ALA 137           H        ALA 137   6.341  18.301  -6.199
 1012    HA   ALA 137           HA       ALA 137   4.251  17.912  -7.206
 1013    HB1  ALA 137           HB1      ALA 137   3.911  17.906  -4.182
 1014    HB2  ALA 137           HB2      ALA 137   2.976  16.934  -5.339
 1015    HB3  ALA 137           HB3      ALA 137   4.717  16.653  -5.146
 1016    H    ARG 138           H        ARG 138   3.871  20.078  -8.175
 1017    HA   ARG 138           HA       ARG 138   2.678  21.883  -8.732
 1018    HB2  ARG 138           HB2      ARG 138   0.364  20.385  -7.448
 1019    HB3  ARG 138           HB3      ARG 138   0.239  21.687  -8.630
 1020    HG2  ARG 138           HG2      ARG 138   1.653  20.249 -10.193
 1021    HG3  ARG 138           HG3      ARG 138   1.345  18.903  -9.084
 1022    HD2  ARG 138           HD2      ARG 138  -0.755  20.623 -10.467
 1023    HD3  ARG 138           HD3      ARG 138  -0.232  19.030 -11.027
 1024    HE   ARG 138           HE       ARG 138  -1.032  18.550  -8.427
 1025   HH11  ARG 138          HH11      ARG 138  -2.691  19.907 -11.197
 1026   HH12  ARG 138          HH12      ARG 138  -4.251  19.385 -10.624
 1027   HH21  ARG 138          HH21      ARG 138  -3.057  17.925  -7.763
 1028   HH22  ARG 138          HH22      ARG 138  -4.441  18.291  -8.742
 1029    H    ASP 139           H        ASP 139   3.556  21.953  -5.652
 1030    HA   ASP 139           HA       ASP 139   1.708  23.522  -4.273
 1031    HB2  ASP 139           HB2      ASP 139   3.693  22.383  -3.347
 1032    HB3  ASP 139           HB3      ASP 139   4.734  23.596  -4.087
 1033    H    THR 140           H        THR 140   3.816  24.634  -6.816
 1034    HA   THR 140           HA       THR 140   2.652  27.382  -6.569
 1035    HB   THR 140           HB       THR 140   5.311  27.039  -7.904
 1036    HG1  THR 140           HG1      THR 140   5.013  27.193  -5.100
 1037   HG21  THR 140          HG21      THR 140   5.758  29.225  -6.838
 1038   HG22  THR 140          HG22      THR 140   4.275  29.290  -7.798
 1039   HG23  THR 140          HG23      THR 140   4.175  29.167  -6.029
 1040    H    ARG 141           H        ARG 141   1.946  24.848  -8.317
 1041    HA   ARG 141           HA       ARG 141   2.352  25.867 -11.050
 1042    HB2  ARG 141           HB2      ARG 141   2.120  23.358 -10.314
 1043    HB3  ARG 141           HB3      ARG 141   0.388  23.684 -10.286
 1044    HG2  ARG 141           HG2      ARG 141   1.009  24.650 -12.779
 1045    HG3  ARG 141           HG3      ARG 141   2.325  23.506 -12.580
 1046    HD2  ARG 141           HD2      ARG 141   0.613  22.362 -13.738
 1047    HD3  ARG 141           HD3      ARG 141   0.506  21.749 -12.077
 1048    HE   ARG 141           HE       ARG 141  -1.177  24.082 -12.421
 1049   HH11  ARG 141          HH11      ARG 141  -1.359  20.794 -13.696
 1050   HH12  ARG 141          HH12      ARG 141  -3.085  20.852 -13.626
 1051   HH21  ARG 141          HH21      ARG 141  -3.168  24.109 -12.545
 1052   HH22  ARG 141          HH22      ARG 141  -4.145  22.704 -12.979
 1053    HA   PRO 142           HA       PRO 142  -1.427  28.410 -10.865
 1054    HB2  PRO 142           HB2      PRO 142  -1.887  28.716 -13.585
 1055    HB3  PRO 142           HB3      PRO 142  -0.727  29.676 -12.620
 1056    HG2  PRO 142           HG2      PRO 142  -0.171  27.220 -14.306
 1057    HG3  PRO 142           HG3      PRO 142   0.730  28.772 -14.275
 1058    HD2  PRO 142           HD2      PRO 142   1.627  26.655 -12.899
 1059    HD3  PRO 142           HD3      PRO 142   1.682  28.271 -12.154
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1  10.873  -5.774   1.997
    2    H2   MET   1           H2       MET   1  12.305  -5.953   1.222
    3    H3   MET   1           H3       MET   1  11.793  -4.467   1.663
    4    HA   MET   1           HA       MET   1  11.482  -4.752  -0.706
    5    HB2  MET   1           HB2      MET   1   9.712  -7.091   0.148
    6    HB3  MET   1           HB3      MET   1   9.701  -6.359  -1.458
    7    HG2  MET   1           HG2      MET   1  12.093  -6.923  -1.751
    8    HG3  MET   1           HG3      MET   1  12.096  -7.717  -0.170
    9    HE1  MET   1           HE1      MET   1  12.408 -10.719  -2.664
   10    HE2  MET   1           HE2      MET   1  13.109  -9.096  -2.848
   11    HE3  MET   1           HE3      MET   1  13.115  -9.894  -1.258
   12    H    ALA   2           H        ALA   2  10.067  -3.318  -1.584
   13    HA   ALA   2           HA       ALA   2   7.427  -2.815  -0.396
   14    HB1  ALA   2           HB1      ALA   2   7.905  -0.412  -0.020
   15    HB2  ALA   2           HB2      ALA   2   8.951  -1.421   0.989
   16    HB3  ALA   2           HB3      ALA   2   9.601  -0.666  -0.483
   17    H    TYR   3           H        TYR   3   6.217  -1.166  -1.666
   18    HA   TYR   3           HA       TYR   3   6.284  -1.631  -4.486
   19    HB2  TYR   3           HB2      TYR   3   4.571   0.250  -4.485
   20    HB3  TYR   3           HB3      TYR   3   4.211  -1.158  -3.507
   21    HD1  TYR   3           HD2      TYR   3   5.507   2.370  -3.277
   22    HD2  TYR   3           HD1      TYR   3   3.742  -0.974  -1.188
   23    HE1  TYR   3           HE2      TYR   3   5.252   3.769  -1.243
   24    HE2  TYR   3           HE1      TYR   3   3.467   0.440   0.837
   25    HH   TYR   3           HH       TYR   3   3.795   2.504   1.777
   26    H    GLY   4           H        GLY   4   7.809   0.904  -2.551
   27    HA2  GLY   4           HA2      GLY   4   9.636   1.831  -4.462
   28    HA3  GLY   4           HA3      GLY   4   8.185   2.825  -4.641
   29    H    ARG   5           H        ARG   5  10.165   4.297  -4.007
   30    HA   ARG   5           HA       ARG   5   9.676   5.155  -1.226
   31    HB2  ARG   5           HB2      ARG   5  12.043   5.426  -0.697
   32    HB3  ARG   5           HB3      ARG   5  11.611   3.741  -0.958
   33    HG2  ARG   5           HG2      ARG   5  12.565   3.903  -3.295
   34    HG3  ARG   5           HG3      ARG   5  13.129   5.534  -2.906
   35    HD2  ARG   5           HD2      ARG   5  13.874   3.011  -1.364
   36    HD3  ARG   5           HD3      ARG   5  14.852   3.724  -2.657
   37    HE   ARG   5           HE       ARG   5  14.412   5.812  -0.837
   38   HH11  ARG   5          HH21      ARG   5  16.006   2.685  -0.639
   39   HH12  ARG   5          HH22      ARG   5  17.172   3.266   0.514
   40   HH21  ARG   5          HH11      ARG   5  15.958   6.492   0.542
   41   HH22  ARG   5          HH12      ARG   5  17.126   5.358   1.191
   42    H    GLU   6           H        GLU   6   9.616   7.289  -0.963
   43    HA   GLU   6           HA       GLU   6   9.361   8.844  -3.404
   44    HB2  GLU   6           HB2      GLU   6   8.398  10.547  -1.989
   45    HB3  GLU   6           HB3      GLU   6   7.717   8.968  -1.606
   46    HG2  GLU   6           HG2      GLU   6   9.241   8.819   0.382
   47    HG3  GLU   6           HG3      GLU   6   9.854  10.430   0.012
   48    H    ASP   7           H        ASP   7  11.890   8.653  -0.978
   49    HA   ASP   7           HA       ASP   7  12.937  11.302  -1.356
   50    HB2  ASP   7           HB2      ASP   7  14.793  10.559  -0.035
   51    HB3  ASP   7           HB3      ASP   7  13.292   9.989   0.686
   52    H    VAL   8           H        VAL   8  13.932   8.148  -2.672
   53    HA   VAL   8           HA       VAL   8  15.976   9.170  -4.431
   54    HB   VAL   8           HB       VAL   8  14.265   6.666  -4.728
   55   HG11  VAL   8          HG11      VAL   8  16.846   7.460  -6.160
   56   HG12  VAL   8          HG12      VAL   8  16.109   5.844  -6.198
   57   HG13  VAL   8          HG13      VAL   8  15.256   7.209  -6.914
   58   HG21  VAL   8          HG21      VAL   8  15.665   6.720  -2.669
   59   HG22  VAL   8          HG22      VAL   8  16.240   5.506  -3.817
   60   HG23  VAL   8          HG23      VAL   8  17.099   7.054  -3.656
   61    H    ALA   9           H        ALA   9  12.463   8.570  -5.019
   62    HA   ALA   9           HA       ALA   9  12.515   9.362  -7.747
   63    HB1  ALA   9           HB1      ALA   9  10.093   9.551  -7.524
   64    HB2  ALA   9           HB2      ALA   9  10.680   8.109  -6.683
   65    HB3  ALA   9           HB3      ALA   9  10.223   9.555  -5.749
   66    H    ASN  10           H        ASN  10  11.748  11.420  -4.835
   67    HA   ASN  10           HA       ASN  10  11.505  13.836  -6.385
   68    HB2  ASN  10           HB2      ASN  10  10.586  13.597  -4.111
   69    HB3  ASN  10           HB3      ASN  10  12.214  13.418  -3.453
   70   HD21  ASN  10          HD22      ASN  10  10.023  15.796  -5.149
   71   HD22  ASN  10          HD21      ASN  10  10.932  17.158  -4.547
   72    H    THR  11           H        THR  11  14.405  12.404  -4.727
   73    HA   THR  11           HA       THR  11  16.158  14.564  -5.375
   74    HB   THR  11           HB       THR  11  16.876  11.605  -5.133
   75    HG1  THR  11           HG1      THR  11  15.913  12.215  -3.297
   76   HG21  THR  11          HG21      THR  11  18.760  12.895  -6.050
   77   HG22  THR  11          HG22      THR  11  18.559  14.129  -4.784
   78   HG23  THR  11          HG23      THR  11  19.078  12.482  -4.361
   79    H    ARG  12           H        ARG  12  15.477  11.554  -7.240
   80    HA   ARG  12           HA       ARG  12  17.038  12.292  -9.556
   81    HB2  ARG  12           HB2      ARG  12  14.631  10.443  -9.172
   82    HB3  ARG  12           HB3      ARG  12  15.415  10.676 -10.727
   83    HG2  ARG  12           HG2      ARG  12  16.764   9.530  -8.243
   84    HG3  ARG  12           HG3      ARG  12  16.200   8.647  -9.665
   85    HD2  ARG  12           HD2      ARG  12  17.778  10.280 -10.991
   86    HD3  ARG  12           HD3      ARG  12  18.528  10.569  -9.422
   87    HE   ARG  12           HE       ARG  12  18.648   7.885  -9.440
   88   HH11  ARG  12          HH11      ARG  12  19.388   9.972 -12.204
   89   HH12  ARG  12          HH12      ARG  12  20.693   8.918 -12.679
   90   HH21  ARG  12          HH21      ARG  12  20.115   6.628 -10.184
   91   HH22  ARG  12          HH22      ARG  12  21.086   7.025 -11.604
   92    H    ALA  13           H        ALA  13  13.651  13.081  -8.692
   93    HA   ALA  13           HA       ALA  13  12.966  14.318 -11.136
   94    HB1  ALA  13           HB1      ALA  13  12.028  15.212  -8.410
   95    HB2  ALA  13           HB2      ALA  13  11.194  15.312  -9.971
   96    HB3  ALA  13           HB3      ALA  13  11.488  13.729  -9.228
   97    H    ARG  14           H        ARG  14  14.492  15.767  -8.209
   98    HA   ARG  14           HA       ARG  14  14.658  18.463  -9.242
   99    HB2  ARG  14           HB2      ARG  14  16.414  17.039  -7.178
  100    HB3  ARG  14           HB3      ARG  14  16.402  18.772  -7.460
  101    HG2  ARG  14           HG2      ARG  14  14.072  17.126  -6.399
  102    HG3  ARG  14           HG3      ARG  14  15.132  18.141  -5.441
  103    HD2  ARG  14           HD2      ARG  14  13.245  19.097  -7.626
  104    HD3  ARG  14           HD3      ARG  14  12.935  19.130  -5.886
  105    HE   ARG  14           HE       ARG  14  15.398  20.515  -6.590
  106   HH11  ARG  14          HH21      ARG  14  11.946  21.017  -6.236
  107   HH12  ARG  14          HH22      ARG  14  12.139  22.730  -6.010
  108   HH21  ARG  14          HH11      ARG  14  15.548  22.709  -6.331
  109   HH22  ARG  14          HH12      ARG  14  14.117  23.653  -6.080
  110    H    GLU  15           H        GLU  15  16.941  15.753  -9.379
  111    HA   GLU  15           HA       GLU  15  18.960  17.170 -10.910
  112    HB2  GLU  15           HB2      GLU  15  18.258  14.248 -10.475
  113    HB3  GLU  15           HB3      GLU  15  19.530  14.711 -11.607
  114    HG2  GLU  15           HG2      GLU  15  19.440  15.476  -8.660
  115    HG3  GLU  15           HG3      GLU  15  20.384  14.146  -9.336
  116    H    THR  16           H        THR  16  16.374  14.931 -12.012
  117    HA   THR  16           HA       THR  16  16.748  15.151 -14.784
  118    HB   THR  16           HB       THR  16  14.160  14.813 -13.220
  119    HG1  THR  16           HG1      THR  16  15.572  13.237 -12.720
  120   HG21  THR  16          HG21      THR  16  13.219  13.655 -15.071
  121   HG22  THR  16          HG22      THR  16  13.740  15.233 -15.697
  122   HG23  THR  16          HG23      THR  16  14.706  13.768 -16.016
  123    H    ALA  17           H        ALA  17  14.862  17.306 -12.666
  124    HA   ALA  17           HA       ALA  17  14.033  19.135 -14.704
  125    HB1  ALA  17           HB1      ALA  17  13.546  20.607 -12.776
  126    HB2  ALA  17           HB2      ALA  17  12.941  18.949 -12.525
  127    HB3  ALA  17           HB3      ALA  17  14.422  19.492 -11.707
  128    H    ALA  18           H        ALA  18  16.854  19.303 -12.425
  129    HA   ALA  18           HA       ALA  18  17.883  21.769 -13.389
  130    HB1  ALA  18           HB1      ALA  18  18.557  20.711 -11.270
  131    HB2  ALA  18           HB2      ALA  18  19.332  19.379 -12.153
  132    HB3  ALA  18           HB3      ALA  18  19.969  21.033 -12.294
  133    H    ARG  19           H        ARG  19  18.511  18.428 -14.490
  134    HA   ARG  19           HA       ARG  19  20.430  19.206 -16.559
  135    HB2  ARG  19           HB2      ARG  19  18.742  16.685 -16.514
  136    HB3  ARG  19           HB3      ARG  19  20.216  16.995 -17.429
  137    HG2  ARG  19           HG2      ARG  19  19.893  16.225 -14.565
  138    HG3  ARG  19           HG3      ARG  19  20.935  15.565 -15.791
  139    HD2  ARG  19           HD2      ARG  19  22.438  17.518 -15.614
  140    HD3  ARG  19           HD3      ARG  19  21.348  18.267 -14.443
  141    HE   ARG  19           HE       ARG  19  21.896  16.638 -12.791
  142   HH11  ARG  19          HH11      ARG  19  23.865  16.052 -15.654
  143   HH12  ARG  19          HH12      ARG  19  24.928  15.004 -14.759
  144   HH21  ARG  19          HH21      ARG  19  23.163  15.395 -11.812
  145   HH22  ARG  19          HH22      ARG  19  24.559  14.622 -12.577
  146    H    PHE  20           H        PHE  20  16.878  18.637 -16.587
  147    HA   PHE  20           HA       PHE  20  16.492  19.141 -19.341
  148    HB2  PHE  20           HB2      PHE  20  14.667  18.277 -18.075
  149    HB3  PHE  20           HB3      PHE  20  14.709  19.619 -16.952
  150    HD1  PHE  20           HD1      PHE  20  14.423  19.144 -20.710
  151    HD2  PHE  20           HD2      PHE  20  13.121  21.280 -17.190
  152    HE1  PHE  20           HE1      PHE  20  12.773  20.407 -22.066
  153    HE2  PHE  20           HE2      PHE  20  11.516  22.564 -18.563
  154    HZ   PHE  20           HZ       PHE  20  11.322  22.121 -21.008
  155    H    THR  21           H        THR  21  16.634  21.657 -16.660
  156    HA   THR  21           HA       THR  21  16.282  23.837 -18.442
  157    HB   THR  21           HB       THR  21  18.063  24.905 -16.658
  158    HG1  THR  21           HG1      THR  21  18.233  22.908 -15.531
  159   HG21  THR  21          HG21      THR  21  15.096  24.411 -16.191
  160   HG22  THR  21          HG22      THR  21  16.091  25.651 -15.389
  161   HG23  THR  21          HG23      THR  21  15.801  25.752 -17.127
  162    H    ALA  22           H        ALA  22  19.378  22.134 -17.636
  163    HA   ALA  22           HA       ALA  22  20.938  23.845 -19.317
  164    HB1  ALA  22           HB1      ALA  22  21.425  20.939 -18.507
  165    HB2  ALA  22           HB2      ALA  22  22.638  22.064 -19.147
  166    HB3  ALA  22           HB3      ALA  22  21.892  22.375 -17.567
  167    H    ALA  23           H        ALA  23  19.208  20.810 -20.074
  168    HA   ALA  23           HA       ALA  23  20.054  20.619 -22.809
  169    HB1  ALA  23           HB1      ALA  23  18.210  19.020 -23.022
  170    HB2  ALA  23           HB2      ALA  23  19.125  18.745 -21.526
  171    HB3  ALA  23           HB3      ALA  23  17.539  19.558 -21.469
  172    H    LEU  24           H        LEU  24  17.291  22.304 -21.306
  173    HA   LEU  24           HA       LEU  24  16.105  23.199 -23.772
  174    HB2  LEU  24           HB2      LEU  24  14.965  22.924 -21.552
  175    HB3  LEU  24           HB3      LEU  24  15.908  24.262 -20.932
  176    HG   LEU  24           HG       LEU  24  14.802  25.730 -22.730
  177   HD11  LEU  24          HD11      LEU  24  14.048  23.847 -24.206
  178   HD12  LEU  24          HD12      LEU  24  12.954  23.300 -22.927
  179   HD13  LEU  24          HD13      LEU  24  12.701  24.878 -23.698
  180   HD21  LEU  24          HD21      LEU  24  14.050  25.719 -20.362
  181   HD22  LEU  24          HD22      LEU  24  12.683  25.917 -21.474
  182   HD23  LEU  24          HD23      LEU  24  12.994  24.342 -20.707
  183    H    GLU  25           H        GLU  25  18.522  24.654 -21.547
  184    HA   GLU  25           HA       GLU  25  18.900  27.102 -22.999
  185    HB2  GLU  25           HB2      GLU  25  19.763  26.617 -20.697
  186    HB3  GLU  25           HB3      GLU  25  20.968  25.539 -21.403
  187    HG2  GLU  25           HG2      GLU  25  21.904  27.445 -22.697
  188    HG3  GLU  25           HG3      GLU  25  20.663  28.507 -22.027
  189    H    LEU  26           H        LEU  26  20.538  23.925 -23.300
  190    HA   LEU  26           HA       LEU  26  22.159  24.400 -25.565
  191    HB2  LEU  26           HB2      LEU  26  22.505  22.377 -24.476
  192    HB3  LEU  26           HB3      LEU  26  20.808  22.087 -24.252
  193    HG   LEU  26           HG       LEU  26  20.626  21.523 -26.740
  194   HD11  LEU  26          HD11      LEU  26  23.655  21.377 -26.443
  195   HD12  LEU  26          HD12      LEU  26  22.701  20.809 -27.832
  196   HD13  LEU  26          HD13      LEU  26  22.773  22.539 -27.459
  197   HD21  LEU  26          HD21      LEU  26  22.311  19.806 -24.891
  198   HD22  LEU  26          HD22      LEU  26  20.534  19.850 -24.996
  199   HD23  LEU  26          HD23      LEU  26  21.479  19.250 -26.364
  200    H    ALA  27           H        ALA  27  18.719  23.423 -25.482
  201    HA   ALA  27           HA       ALA  27  18.320  23.428 -28.295
  202    HB1  ALA  27           HB1      ALA  27  16.322  23.968 -26.060
  203    HB2  ALA  27           HB2      ALA  27  15.931  23.536 -27.734
  204    HB3  ALA  27           HB3      ALA  27  16.786  22.378 -26.692
  205    H    ILE  28           H        ILE  28  17.915  26.157 -25.961
  206    HA   ILE  28           HA       ILE  28  17.069  28.110 -27.893
  207    HB   ILE  28           HB       ILE  28  18.576  28.445 -25.267
  208   HG12  ILE  28          HG12      ILE  28  15.635  28.978 -25.846
  209   HG13  ILE  28          HG13      ILE  28  16.202  27.424 -25.267
  210   HG21  ILE  28          HG21      ILE  28  17.197  30.543 -27.007
  211   HG22  ILE  28          HG22      ILE  28  17.776  30.823 -25.350
  212   HG23  ILE  28          HG23      ILE  28  18.930  30.461 -26.623
  213   HD11  ILE  28          HD11      ILE  28  16.335  30.030 -23.761
  214   HD12  ILE  28          HD12      ILE  28  15.409  28.553 -23.395
  215   HD13  ILE  28          HD13      ILE  28  17.173  28.543 -23.250
  216    H    ASP  29           H        ASP  29  20.357  27.270 -26.705
  217    HA   ASP  29           HA       ASP  29  21.783  29.089 -28.354
  218    HB2  ASP  29           HB2      ASP  29  22.684  27.891 -26.366
  219    HB3  ASP  29           HB3      ASP  29  22.661  26.382 -27.282
  220    H    ARG  30           H        ARG  30  20.611  25.809 -29.072
  221    HA   ARG  30           HA       ARG  30  21.910  25.735 -31.695
  222    HB2  ARG  30           HB2      ARG  30  21.409  23.734 -30.249
  223    HB3  ARG  30           HB3      ARG  30  19.694  23.929 -30.632
  224    HG2  ARG  30           HG2      ARG  30  20.209  23.616 -33.052
  225    HG3  ARG  30           HG3      ARG  30  21.940  23.558 -32.675
  226    HD2  ARG  30           HD2      ARG  30  21.456  21.537 -31.218
  227    HD3  ARG  30           HD3      ARG  30  19.813  21.539 -31.866
  228    HE   ARG  30           HE       ARG  30  20.822  21.285 -34.147
  229   HH11  ARG  30          HH21      ARG  30  22.882  20.220 -31.457
  230   HH12  ARG  30          HH22      ARG  30  23.791  19.186 -32.566
  231   HH21  ARG  30          HH11      ARG  30  22.181  19.945 -35.371
  232   HH22  ARG  30          HH12      ARG  30  23.446  19.073 -34.503
  233    H    ALA  31           H        ALA  31  18.630  26.621 -30.599
  234    HA   ALA  31           HA       ALA  31  17.389  26.578 -33.117
  235    HB1  ALA  31           HB1      ALA  31  16.756  28.299 -30.692
  236    HB2  ALA  31           HB2      ALA  31  15.659  27.971 -32.055
  237    HB3  ALA  31           HB3      ALA  31  16.176  26.647 -31.005
  238    H    THR  32           H        THR  32  19.519  29.109 -31.912
  239    HA   THR  32           HA       THR  32  18.804  30.955 -34.088
  240    HB   THR  32           HB       THR  32  19.732  31.612 -31.813
  241    HG1  THR  32           HG1      THR  32  20.731  33.380 -32.738
  242   HG21  THR  32          HG21      THR  32  22.144  31.854 -31.604
  243   HG22  THR  32          HG22      THR  32  21.740  30.144 -31.796
  244   HG23  THR  32          HG23      THR  32  22.408  31.055 -33.169
  245    H    LEU  33           H        LEU  33  20.692  28.106 -33.981
  246    HA   LEU  33           HA       LEU  33  22.422  28.906 -36.223
  247    HB2  LEU  33           HB2      LEU  33  22.592  26.545 -34.319
  248    HB3  LEU  33           HB3      LEU  33  23.782  26.960 -35.545
  249    HG   LEU  33           HG       LEU  33  23.101  28.657 -33.107
  250   HD11  LEU  33          HD11      LEU  33  25.525  26.918 -33.700
  251   HD12  LEU  33          HD12      LEU  33  25.299  27.963 -32.277
  252   HD13  LEU  33          HD13      LEU  33  24.242  26.569 -32.516
  253   HD21  LEU  33          HD21      LEU  33  23.919  30.059 -34.967
  254   HD22  LEU  33          HD22      LEU  33  25.143  29.928 -33.701
  255   HD23  LEU  33          HD23      LEU  33  25.307  28.971 -35.191
  256    H    SER  34           H        SER  34  19.934  26.589 -35.289
  257    HA   SER  34           HA       SER  34  20.239  24.650 -37.340
  258    HB2  SER  34           HB2      SER  34  17.888  24.033 -36.598
  259    HB3  SER  34           HB3      SER  34  19.082  24.149 -35.288
  260    HG   SER  34           HG       SER  34  16.818  25.471 -35.404
  261    H    GLY  35           H        GLY  35  18.445  27.686 -37.356
  262    HA2  GLY  35           HA2      GLY  35  17.633  28.823 -39.274
  263    HA3  GLY  35           HA3      GLY  35  17.719  27.338 -40.217
  264    H    GLN  36           H        GLN  36  16.219  26.351 -37.500
  265    HA   GLN  36           HA       GLN  36  13.512  27.443 -37.870
  266    HB2  GLN  36           HB2      GLN  36  13.597  25.366 -39.333
  267    HB3  GLN  36           HB3      GLN  36  14.134  24.462 -37.917
  268    HG2  GLN  36           HG2      GLN  36  11.898  25.157 -36.803
  269    HG3  GLN  36           HG3      GLN  36  11.394  25.650 -38.416
  270   HE21  GLN  36          HE22      GLN  36  12.116  22.943 -36.229
  271   HE22  GLN  36          HE21      GLN  36  11.527  21.704 -37.356
  272    HA   PRO  37           HA       PRO  37  13.654  27.123 -33.320
  273    HB2  PRO  37           HB2      PRO  37  10.856  26.091 -33.923
  274    HB3  PRO  37           HB3      PRO  37  11.378  27.099 -32.540
  275    HG2  PRO  37           HG2      PRO  37  10.272  28.303 -34.666
  276    HG3  PRO  37           HG3      PRO  37  11.787  28.984 -33.983
  277    HD2  PRO  37           HD2      PRO  37  11.428  27.295 -36.444
  278    HD3  PRO  37           HD3      PRO  37  12.523  28.678 -36.170
  279    H    VAL  38           H        VAL  38  14.108  25.553 -31.881
  280    HA   VAL  38           HA       VAL  38  14.418  22.731 -32.847
  281    HB   VAL  38           HB       VAL  38  15.685  24.321 -30.582
  282   HG11  VAL  38          HG11      VAL  38  16.156  21.383 -31.245
  283   HG12  VAL  38          HG12      VAL  38  17.194  22.377 -30.210
  284   HG13  VAL  38          HG13      VAL  38  15.542  22.045 -29.709
  285   HG21  VAL  38          HG21      VAL  38  16.910  22.951 -33.029
  286   HG22  VAL  38          HG22      VAL  38  16.503  24.662 -32.966
  287   HG23  VAL  38          HG23      VAL  38  17.734  24.019 -31.875
  288    H    GLY  39           H        GLY  39  13.867  20.967 -31.190
  289    HA2  GLY  39           HA2      GLY  39  11.778  21.802 -29.256
  290    HA3  GLY  39           HA3      GLY  39  11.289  20.734 -30.560
  291    H    ILE  40           H        ILE  40  10.844  20.003 -28.092
  292    HA   ILE  40           HA       ILE  40  12.680  17.705 -27.638
  293    HB   ILE  40           HB       ILE  40  11.587  19.436 -25.392
  294   HG12  ILE  40          HG12      ILE  40  14.483  19.170 -26.334
  295   HG13  ILE  40          HG13      ILE  40  13.459  20.572 -26.631
  296   HG21  ILE  40          HG21      ILE  40  11.790  17.002 -24.868
  297   HG22  ILE  40          HG22      ILE  40  13.483  17.029 -25.387
  298   HG23  ILE  40          HG23      ILE  40  12.954  17.936 -23.954
  299   HD11  ILE  40          HD11      ILE  40  13.208  20.949 -24.210
  300   HD12  ILE  40          HD12      ILE  40  14.390  19.647 -23.902
  301   HD13  ILE  40          HD13      ILE  40  14.878  21.096 -24.794
  302    H    HIS  41           H        HIS  41  11.568  15.978 -27.889
  303    HA   HIS  41           HA       HIS  41   8.664  15.831 -27.644
  304    HB2  HIS  41           HB2      HIS  41   9.805  14.724 -29.501
  305    HB3  HIS  41           HB3      HIS  41  10.818  13.815 -28.386
  306    HD1  HIS  41           HD1      HIS  41   9.620  11.696 -27.162
  307    HD2  HIS  41           HD2      HIS  41   7.207  14.018 -29.694
  308    HE1  HIS  41           HE1      HIS  41   7.383  10.485 -27.351
  309    H    PHE  42           H        PHE  42   7.662  14.356 -26.210
  310    HA   PHE  42           HA       PHE  42   9.160  13.376 -23.828
  311    HB2  PHE  42           HB2      PHE  42   6.826  15.303 -23.865
  312    HB3  PHE  42           HB3      PHE  42   7.224  14.317 -22.465
  313    HD1  PHE  42           HD1      PHE  42   9.206  14.692 -21.124
  314    HD2  PHE  42           HD2      PHE  42   8.342  17.215 -24.525
  315    HE1  PHE  42           HE1      PHE  42  10.850  16.361 -20.307
  316    HE2  PHE  42           HE2      PHE  42  10.014  18.862 -23.704
  317    HZ   PHE  42           HZ       PHE  42  11.245  18.446 -21.591
  318    H    SER  43           H        SER  43   8.313  11.611 -22.863
  319    HA   SER  43           HA       SER  43   5.808  10.373 -23.809
  320    HB2  SER  43           HB2      SER  43   7.766   9.679 -25.302
  321    HB3  SER  43           HB3      SER  43   8.392   8.810 -23.886
  322    HG   SER  43           HG       SER  43   7.031   7.493 -25.200
  323    H    ASP  44           H        ASP  44   5.623   8.167 -22.612
  324    HA   ASP  44           HA       ASP  44   4.888   8.713 -20.044
  325    HB2  ASP  44           HB2      ASP  44   4.167   6.820 -21.464
  326    HB3  ASP  44           HB3      ASP  44   5.703   6.010 -21.165
  327    H    SER  45           H        SER  45   8.144   7.552 -20.866
  328    HA   SER  45           HA       SER  45   9.012   8.111 -18.070
  329    HB2  SER  45           HB2      SER  45  10.346   6.044 -18.039
  330    HB3  SER  45           HB3      SER  45   8.617   5.706 -18.198
  331    HG   SER  45           HG       SER  45   9.877   4.464 -19.658
  332    H    ALA  46           H        ALA  46   9.356   9.406 -20.897
  333    HA   ALA  46           HA       ALA  46  12.257   9.817 -20.729
  334    HB1  ALA  46           HB1      ALA  46  12.050   7.690 -22.015
  335    HB2  ALA  46           HB2      ALA  46  11.000   8.508 -23.190
  336    HB3  ALA  46           HB3      ALA  46  12.703   8.978 -23.028
  337    H    TRP  47           H        TRP  47  13.075  11.136 -22.528
  338    HA   TRP  47           HA       TRP  47  11.254  12.990 -23.859
  339    HB2  TRP  47           HB2      TRP  47  12.700  14.921 -23.255
  340    HB3  TRP  47           HB3      TRP  47  11.869  14.238 -21.866
  341    HD1  TRP  47           HD1      TRP  47  13.259  13.420 -19.891
  342    HE1  TRP  47           HE1      TRP  47  15.752  13.171 -19.342
  343    HE3  TRP  47           HE3      TRP  47  15.255  14.606 -24.478
  344    HZ2  TRP  47           HZ2      TRP  47  18.258  13.260 -20.750
  345    HZ3  TRP  47           HZ3      TRP  47  17.705  14.440 -24.837
  346    HH2  TRP  47           HH2      TRP  47  19.212  13.775 -22.993
  347    H    ARG  48           H        ARG  48  12.402  14.009 -25.696
  348    HA   ARG  48           HA       ARG  48  14.969  12.820 -26.590
  349    HB2  ARG  48           HB2      ARG  48  13.353  11.083 -27.151
  350    HB3  ARG  48           HB3      ARG  48  12.251  12.253 -27.851
  351    HG2  ARG  48           HG2      ARG  48  13.924  12.672 -29.701
  352    HG3  ARG  48           HG3      ARG  48  14.955  11.425 -28.975
  353    HD2  ARG  48           HD2      ARG  48  13.701  10.371 -30.738
  354    HD3  ARG  48           HD3      ARG  48  13.045   9.799 -29.206
  355    HE   ARG  48           HE       ARG  48  11.695  12.118 -30.500
  356   HH11  ARG  48          HH11      ARG  48  11.500   8.624 -29.942
  357   HH12  ARG  48          HH12      ARG  48   9.786   8.649 -30.381
  358   HH21  ARG  48          HH21      ARG  48   9.470  11.882 -31.009
  359   HH22  ARG  48          HH22      ARG  48   8.792  10.262 -30.904
  360    H    ILE  49           H        ILE  49  16.105  14.293 -27.686
  361    HA   ILE  49           HA       ILE  49  14.924  16.919 -28.213
  362    HB   ILE  49           HB       ILE  49  17.653  15.950 -29.114
  363   HG12  ILE  49          HG12      ILE  49  17.521  15.407 -26.764
  364   HG13  ILE  49          HG13      ILE  49  18.625  16.741 -27.039
  365   HG21  ILE  49          HG21      ILE  49  18.218  18.397 -28.757
  366   HG22  ILE  49          HG22      ILE  49  17.072  18.100 -30.066
  367   HG23  ILE  49          HG23      ILE  49  16.491  18.708 -28.505
  368   HD11  ILE  49          HD11      ILE  49  17.294  17.100 -25.008
  369   HD12  ILE  49          HD12      ILE  49  16.923  18.351 -26.203
  370   HD13  ILE  49          HD13      ILE  49  15.791  17.002 -25.938
  371    H    MET  50           H        MET  50  14.452  17.895 -30.195
  372    HA   MET  50           HA       MET  50  14.750  16.299 -32.681
  373    HB2  MET  50           HB2      MET  50  12.151  17.539 -31.686
  374    HB3  MET  50           HB3      MET  50  12.417  16.952 -33.331
  375    HG2  MET  50           HG2      MET  50  12.939  14.688 -32.406
  376    HG3  MET  50           HG3      MET  50  12.531  15.283 -30.798
  377    HE1  MET  50           HE1      MET  50  11.267  15.244 -34.432
  378    HE2  MET  50           HE2      MET  50  10.910  13.548 -34.057
  379    HE3  MET  50           HE3      MET  50   9.578  14.703 -34.318
  380    H    VAL  51           H        VAL  51  14.724  17.441 -34.586
  381    HA   VAL  51           HA       VAL  51  15.171  20.399 -34.531
  382    HB   VAL  51           HB       VAL  51  17.321  19.889 -35.845
  383   HG11  VAL  51          HG11      VAL  51  17.352  18.988 -32.949
  384   HG12  VAL  51          HG12      VAL  51  18.668  19.733 -33.885
  385   HG13  VAL  51          HG13      VAL  51  17.229  20.677 -33.475
  386   HG21  VAL  51          HG21      VAL  51  16.859  17.482 -36.317
  387   HG22  VAL  51          HG22      VAL  51  18.439  17.797 -35.588
  388   HG23  VAL  51          HG23      VAL  51  17.127  17.128 -34.600
  389    HA   PRO  52           HA       PRO  52  13.436  20.391 -38.637
  390    HB2  PRO  52           HB2      PRO  52  15.268  21.808 -40.207
  391    HB3  PRO  52           HB3      PRO  52  14.044  22.522 -39.130
  392    HG2  PRO  52           HG2      PRO  52  16.956  21.908 -38.520
  393    HG3  PRO  52           HG3      PRO  52  16.077  23.433 -38.204
  394    HD2  PRO  52           HD2      PRO  52  16.397  21.716 -36.211
  395    HD3  PRO  52           HD3      PRO  52  14.773  22.396 -36.464
  396    H    GLY  53           H        GLY  53  16.721  19.134 -38.379
  397    HA2  GLY  53           HA2      GLY  53  17.843  17.512 -39.625
  398    HA3  GLY  53           HA3      GLY  53  16.318  17.110 -40.420
  399    H    LYS  54           H        LYS  54  17.134  17.021 -42.499
  400    HA   LYS  54           HA       LYS  54  18.939  18.962 -43.608
  401    HB2  LYS  54           HB2      LYS  54  18.890  17.611 -45.584
  402    HB3  LYS  54           HB3      LYS  54  18.907  16.555 -44.177
  403    HG2  LYS  54           HG2      LYS  54  16.413  16.247 -44.428
  404    HG3  LYS  54           HG3      LYS  54  16.480  17.244 -45.894
  405    HD2  LYS  54           HD2      LYS  54  18.051  15.622 -46.927
  406    HD3  LYS  54           HD3      LYS  54  17.946  14.607 -45.469
  407    HE2  LYS  54           HE2      LYS  54  15.488  14.407 -45.800
  408    HE3  LYS  54           HE3      LYS  54  15.598  15.413 -47.248
  409    HZ1  LYS  54           HZ1      LYS  54  16.911  12.763 -46.915
  410    HZ2  LYS  54           HZ2      LYS  54  15.585  13.047 -47.814
  411    HZ3  LYS  54           HZ3      LYS  54  17.013  13.692 -48.253
  412    H    THR  55           H        THR  55  15.736  19.613 -43.111
  413    HA   THR  55           HA       THR  55  15.472  21.195 -45.648
  414    HB   THR  55           HB       THR  55  13.150  20.720 -45.731
  415    HG1  THR  55           HG1      THR  55  12.672  20.734 -43.597
  416   HG21  THR  55          HG21      THR  55  14.380  18.053 -44.966
  417   HG22  THR  55          HG22      THR  55  12.965  18.352 -45.981
  418   HG23  THR  55          HG23      THR  55  14.578  18.827 -46.568
  419    HA   PRO  56           HA       PRO  56  14.609  23.670 -41.612
  420    HB2  PRO  56           HB2      PRO  56  16.653  25.506 -41.520
  421    HB3  PRO  56           HB3      PRO  56  16.748  23.862 -40.821
  422    HG2  PRO  56           HG2      PRO  56  17.733  24.781 -43.540
  423    HG3  PRO  56           HG3      PRO  56  18.628  23.843 -42.299
  424    HD2  PRO  56           HD2      PRO  56  17.405  22.601 -44.375
  425    HD3  PRO  56           HD3      PRO  56  17.366  21.896 -42.732
  426    H    SER  57           H        SER  57  15.186  24.637 -44.910
  427    HA   SER  57           HA       SER  57  14.092  27.256 -44.933
  428    HB2  SER  57           HB2      SER  57  13.845  25.083 -47.047
  429    HB3  SER  57           HB3      SER  57  13.689  26.833 -47.297
  430    HG   SER  57           HG       SER  57  15.774  26.068 -47.853
  431    H    ALA  58           H        ALA  58  12.465  24.279 -44.195
  432    HA   ALA  58           HA       ALA  58   9.835  25.635 -44.182
  433    HB1  ALA  58           HB1      ALA  58  10.384  22.968 -45.570
  434    HB2  ALA  58           HB2      ALA  58   8.788  23.717 -45.349
  435    HB3  ALA  58           HB3      ALA  58   9.993  24.499 -46.385
  436    H    TRP  59           H        TRP  59   8.188  24.249 -43.020
  437    HA   TRP  59           HA       TRP  59   9.142  23.435 -40.441
  438    HB2  TRP  59           HB2      TRP  59   6.949  24.392 -40.748
  439    HB3  TRP  59           HB3      TRP  59   6.471  23.085 -41.822
  440    HD1  TRP  59           HD1      TRP  59   5.702  20.827 -40.770
  441    HE1  TRP  59           HE1      TRP  59   4.910  20.153 -38.426
  442    HE3  TRP  59           HE3      TRP  59   7.612  24.767 -38.100
  443    HZ2  TRP  59           HZ2      TRP  59   4.978  21.242 -35.750
  444    HZ3  TRP  59           HZ3      TRP  59   7.257  24.901 -35.644
  445    HH2  TRP  59           HH2      TRP  59   5.930  23.164 -34.465
  446    H    ARG  60           H        ARG  60  10.212  21.647 -39.969
  447    HA   ARG  60           HA       ARG  60   9.102  19.011 -40.644
  448    HB2  ARG  60           HB2      ARG  60  10.671  19.554 -42.546
  449    HB3  ARG  60           HB3      ARG  60  11.969  19.777 -41.389
  450    HG2  ARG  60           HG2      ARG  60  12.136  17.661 -42.572
  451    HG3  ARG  60           HG3      ARG  60  11.959  17.381 -40.858
  452    HD2  ARG  60           HD2      ARG  60   9.352  17.421 -42.264
  453    HD3  ARG  60           HD3      ARG  60  10.470  16.259 -42.979
  454    HE   ARG  60           HE       ARG  60  10.743  15.601 -40.370
  455   HH11  ARG  60          HH11      ARG  60   7.862  15.835 -42.360
  456   HH12  ARG  60          HH12      ARG  60   7.000  14.707 -41.355
  457   HH21  ARG  60          HH21      ARG  60   9.590  14.332 -39.110
  458   HH22  ARG  60          HH22      ARG  60   7.972  13.835 -39.558
  459    H    TRP  61           H        TRP  61  10.012  17.323 -39.344
  460    HA   TRP  61           HA       TRP  61  11.769  18.104 -37.085
  461    HB2  TRP  61           HB2      TRP  61   9.071  16.721 -36.844
  462    HB3  TRP  61           HB3      TRP  61  10.282  16.764 -35.570
  463    HD1  TRP  61           HD1      TRP  61   7.336  18.544 -36.570
  464    HE1  TRP  61           HE1      TRP  61   7.208  20.903 -35.523
  465    HE3  TRP  61           HE3      TRP  61  12.139  18.934 -34.879
  466    HZ2  TRP  61           HZ2      TRP  61   8.918  22.620 -33.950
  467    HZ3  TRP  61           HZ3      TRP  61  12.857  20.916 -33.569
  468    HH2  TRP  61           HH2      TRP  61  11.257  22.736 -33.074
  469    H    VAL  62           H        VAL  62  13.196  16.618 -36.475
  470    HA   VAL  62           HA       VAL  62  12.725  13.741 -36.878
  471    HB   VAL  62           HB       VAL  62  13.955  14.509 -38.901
  472   HG11  VAL  62          HG11      VAL  62  15.285  16.356 -37.926
  473   HG12  VAL  62          HG12      VAL  62  16.283  15.163 -37.058
  474   HG13  VAL  62          HG13      VAL  62  16.271  15.196 -38.827
  475   HG21  VAL  62          HG21      VAL  62  14.253  12.201 -38.070
  476   HG22  VAL  62          HG22      VAL  62  15.684  12.819 -38.902
  477   HG23  VAL  62          HG23      VAL  62  15.679  12.729 -37.134
  478    HA   PRO  63           HA       PRO  63  14.696  13.758 -32.766
  479    HB2  PRO  63           HB2      PRO  63  15.784  11.118 -33.743
  480    HB3  PRO  63           HB3      PRO  63  15.104  11.530 -32.138
  481    HG2  PRO  63           HG2      PRO  63  13.585  10.198 -33.935
  482    HG3  PRO  63           HG3      PRO  63  12.867  11.581 -33.042
  483    HD2  PRO  63           HD2      PRO  63  14.012  11.541 -35.842
  484    HD3  PRO  63           HD3      PRO  63  12.481  12.266 -35.265
  485    H    LEU  64           H        LEU  64  16.749  14.296 -31.974
  486    HA   LEU  64           HA       LEU  64  18.631  15.213 -33.882
  487    HB2  LEU  64           HB2      LEU  64  18.108  16.251 -31.698
  488    HB3  LEU  64           HB3      LEU  64  18.937  14.934 -30.867
  489    HG   LEU  64           HG       LEU  64  21.090  15.673 -31.666
  490   HD11  LEU  64          HD11      LEU  64  20.571  16.283 -33.983
  491   HD12  LEU  64          HD12      LEU  64  19.608  17.666 -33.414
  492   HD13  LEU  64          HD13      LEU  64  21.365  17.617 -33.154
  493   HD21  LEU  64          HD21      LEU  64  20.115  16.936 -29.783
  494   HD22  LEU  64          HD22      LEU  64  21.241  17.898 -30.751
  495   HD23  LEU  64          HD23      LEU  64  19.492  18.143 -30.937
  496    H    GLN  65           H        GLN  65  18.256  12.174 -33.720
  497    HA   GLN  65           HA       GLN  65  20.643  10.955 -32.683
  498    HB2  GLN  65           HB2      GLN  65  18.535   9.973 -34.644
  499    HB3  GLN  65           HB3      GLN  65  19.856   8.966 -34.037
  500    HG2  GLN  65           HG2      GLN  65  19.078   9.243 -31.723
  501    HG3  GLN  65           HG3      GLN  65  17.788  10.324 -32.247
  502   HE21  GLN  65          HE22      GLN  65  19.024   6.949 -32.816
  503   HE22  GLN  65          HE21      GLN  65  17.416   6.283 -33.005
  504    H    GLU  66           H        GLU  66  20.102  12.630 -35.664
  505    HA   GLU  66           HA       GLU  66  22.309  11.553 -37.174
  506    HB2  GLU  66           HB2      GLU  66  22.090  13.592 -38.511
  507    HB3  GLU  66           HB3      GLU  66  20.543  12.792 -38.251
  508    HG2  GLU  66           HG2      GLU  66  19.890  14.460 -36.584
  509    HG3  GLU  66           HG3      GLU  66  21.491  15.198 -36.638
  510    H    ASP  67           H        ASP  67  22.305  13.645 -34.382
  511    HA   ASP  67           HA       ASP  67  25.203  14.216 -34.770
  512    HB2  ASP  67           HB2      ASP  67  23.836  16.033 -35.795
  513    HB3  ASP  67           HB3      ASP  67  23.018  16.271 -34.256
  514    H    ALA  68           H        ALA  68  22.632  13.650 -32.471
  515    HA   ALA  68           HA       ALA  68  24.718  13.615 -30.324
  516    HB1  ALA  68           HB1      ALA  68  23.033  15.358 -29.933
  517    HB2  ALA  68           HB2      ALA  68  21.740  14.145 -30.037
  518    HB3  ALA  68           HB3      ALA  68  22.925  14.069 -28.720
  519    H    ALA  69           H        ALA  69  23.590  11.610 -32.404
  520    HA   ALA  69           HA       ALA  69  23.167   9.446 -32.658
  521    HB1  ALA  69           HB1      ALA  69  25.430   9.426 -31.669
  522    HB2  ALA  69           HB2      ALA  69  24.721   9.148 -30.064
  523    HB3  ALA  69           HB3      ALA  69  24.545   7.931 -31.347
  524    H    ASP  70           H        ASP  70  22.599   7.234 -31.081
  525    HA   ASP  70           HA       ASP  70  19.845   7.413 -30.423
  526    HB2  ASP  70           HB2      ASP  70  21.097   5.354 -30.993
  527    HB3  ASP  70           HB3      ASP  70  21.964   5.458 -29.461
  528    H    GLU  71           H        GLU  71  22.494   8.526 -28.610
  529    HA   GLU  71           HA       GLU  71  21.326   8.439 -25.931
  530    HB2  GLU  71           HB2      GLU  71  23.749   9.912 -27.048
  531    HB3  GLU  71           HB3      GLU  71  23.301   9.822 -25.341
  532    HG2  GLU  71           HG2      GLU  71  23.510   7.339 -25.428
  533    HG3  GLU  71           HG3      GLU  71  24.058   7.453 -27.102
  534    H    SER  72           H        SER  72  20.438  10.242 -28.561
  535    HA   SER  72           HA       SER  72  20.017  12.879 -27.599
  536    HB2  SER  72           HB2      SER  72  18.350  11.249 -29.563
  537    HB3  SER  72           HB3      SER  72  18.292  13.009 -29.372
  538    HG   SER  72           HG       SER  72  20.449  11.424 -30.293
  539    H    GLN  73           H        GLN  73  19.054  10.699 -25.615
  540    HA   GLN  73           HA       GLN  73  16.373  11.735 -25.020
  541    HB2  GLN  73           HB2      GLN  73  15.298   9.550 -25.119
  542    HB3  GLN  73           HB3      GLN  73  16.041   9.899 -26.676
  543    HG2  GLN  73           HG2      GLN  73  18.020   8.478 -25.959
  544    HG3  GLN  73           HG3      GLN  73  17.132   8.046 -24.499
  545   HE21  GLN  73          HE22      GLN  73  17.891   6.908 -27.498
  546   HE22  GLN  73          HE21      GLN  73  16.470   5.889 -27.757
  547    H    ASN  74           H        ASN  74  15.414  10.523 -23.091
  548    HA   ASN  74           HA       ASN  74  16.814  11.205 -20.851
  549    HB2  ASN  74           HB2      ASN  74  14.368  10.814 -20.984
  550    HB3  ASN  74           HB3      ASN  74  14.664   9.067 -20.943
  551   HD21  ASN  74          HD22      ASN  74  13.448   8.839 -18.910
  552   HD22  ASN  74          HD21      ASN  74  14.200   9.380 -17.419
  553    H    ASP  75           H        ASP  75  18.184  10.562 -19.477
  554    HA   ASP  75           HA       ASP  75  18.658   7.758 -18.804
  555    HB2  ASP  75           HB2      ASP  75  20.261   8.317 -20.695
  556    HB3  ASP  75           HB3      ASP  75  20.965   9.561 -19.667
  557    H    TRP  76           H        TRP  76  17.625  10.465 -17.646
  558    HA   TRP  76           HA       TRP  76  19.654  11.199 -15.641
  559    HB2  TRP  76           HB2      TRP  76  16.937  12.356 -16.372
  560    HB3  TRP  76           HB3      TRP  76  18.022  13.037 -15.174
  561    HD1  TRP  76           HD1      TRP  76  20.682  12.417 -17.168
  562    HE1  TRP  76           HE1      TRP  76  21.180  14.131 -18.991
  563    HE3  TRP  76           HE3      TRP  76  16.119  14.744 -17.367
  564    HZ2  TRP  76           HZ2      TRP  76  19.783  16.231 -20.390
  565    HZ3  TRP  76           HZ3      TRP  76  15.719  16.549 -19.004
  566    HH2  TRP  76           HH2      TRP  76  17.529  17.302 -20.517
  567    H    ASP  77           H        ASP  77  17.091   8.972 -15.567
  568    HA   ASP  77           HA       ASP  77  17.016   9.106 -12.599
  569    HB2  ASP  77           HB2      ASP  77  14.725   9.255 -12.472
  570    HB3  ASP  77           HB3      ASP  77  15.116  10.423 -13.723
  571    H    GLU  78           H        GLU  78  15.731   7.362 -11.621
  572    HA   GLU  78           HA       GLU  78  15.775   4.746 -13.026
  573    HB2  GLU  78           HB2      GLU  78  16.892   3.685 -11.171
  574    HB3  GLU  78           HB3      GLU  78  17.875   5.052 -11.686
  575    HG2  GLU  78           HG2      GLU  78  16.752   6.404  -9.802
  576    HG3  GLU  78           HG3      GLU  78  16.084   4.886  -9.218
  577    H    GLU  79           H        GLU  79  13.709   6.869 -11.916
  578    HA   GLU  79           HA       GLU  79  11.867   5.019 -10.622
  579    HB2  GLU  79           HB2      GLU  79  13.674   5.870  -8.862
  580    HB3  GLU  79           HB3      GLU  79  12.735   7.346  -8.888
  581    HG2  GLU  79           HG2      GLU  79  12.058   6.007  -7.022
  582    HG3  GLU  79           HG3      GLU  79  10.719   6.001  -8.148
  583    H    LEU  80           H        LEU  80  12.017   7.346 -12.835
  584    HA   LEU  80           HA       LEU  80   9.597   8.830 -11.866
  585    HB2  LEU  80           HB2      LEU  80  11.560   9.585 -14.053
  586    HB3  LEU  80           HB3      LEU  80  10.173  10.518 -13.529
  587    HG   LEU  80           HG       LEU  80  12.684  10.002 -11.897
  588   HD11  LEU  80          HD11      LEU  80  11.501  12.550 -13.034
  589   HD12  LEU  80          HD12      LEU  80  13.036  12.360 -12.152
  590   HD13  LEU  80          HD13      LEU  80  12.849  11.634 -13.747
  591   HD21  LEU  80          HD21      LEU  80  10.118  11.458 -11.167
  592   HD22  LEU  80          HD22      LEU  80  10.818  10.050 -10.337
  593   HD23  LEU  80          HD23      LEU  80  11.654  11.603 -10.282
  594    H    SER  81           H        SER  81   7.914   9.195 -13.056
  595    HA   SER  81           HA       SER  81   7.526   8.062 -15.783
  596    HB2  SER  81           HB2      SER  81   6.322   6.746 -14.009
  597    HB3  SER  81           HB3      SER  81   5.489   8.234 -13.516
  598    HG   SER  81           HG       SER  81   4.259   6.986 -14.998
  599    H    ILE  82           H        ILE  82   6.617   9.582 -17.184
  600    HA   ILE  82           HA       ILE  82   6.482  12.394 -16.156
  601    HB   ILE  82           HB       ILE  82   7.861  11.083 -18.473
  602   HG12  ILE  82          HG12      ILE  82   9.474  12.991 -18.091
  603   HG13  ILE  82          HG13      ILE  82   8.482  13.518 -16.738
  604   HG21  ILE  82          HG21      ILE  82   6.345  12.482 -19.732
  605   HG22  ILE  82          HG22      ILE  82   6.731  13.891 -18.711
  606   HG23  ILE  82          HG23      ILE  82   7.956  13.166 -19.778
  607   HD11  ILE  82          HD11      ILE  82   9.869  10.801 -16.928
  608   HD12  ILE  82          HD12      ILE  82  10.537  12.219 -16.107
  609   HD13  ILE  82          HD13      ILE  82   9.045  11.482 -15.499
  610    H    HIS  83           H        HIS  83   4.820  13.662 -16.666
  611    HA   HIS  83           HA       HIS  83   2.702  12.728 -18.566
  612    HB2  HIS  83           HB2      HIS  83   2.270  13.831 -15.759
  613    HB3  HIS  83           HB3      HIS  83   1.016  13.353 -16.897
  614    HD1  HIS  83           HD1      HIS  83   0.622  10.662 -17.155
  615    HD2  HIS  83           HD2      HIS  83   3.537  11.907 -14.385
  616    HE1  HIS  83           HE1      HIS  83   1.158   8.628 -15.716
  617    H    LEU  84           H        LEU  84   2.159  14.349 -19.999
  618    HA   LEU  84           HA       LEU  84   2.944  17.153 -19.323
  619    HB2  LEU  84           HB2      LEU  84   3.032  15.579 -21.879
  620    HB3  LEU  84           HB3      LEU  84   2.582  17.271 -21.974
  621    HG   LEU  84           HG       LEU  84   4.649  17.892 -20.690
  622   HD11  LEU  84          HD11      LEU  84   6.516  16.233 -20.749
  623   HD12  LEU  84          HD12      LEU  84   5.220  15.777 -19.637
  624   HD13  LEU  84          HD13      LEU  84   5.347  14.975 -21.218
  625   HD21  LEU  84          HD21      LEU  84   4.505  18.169 -23.096
  626   HD22  LEU  84          HD22      LEU  84   6.122  17.603 -22.669
  627   HD23  LEU  84          HD23      LEU  84   4.933  16.465 -23.357
  628    H    GLN  85           H        GLN  85   1.746  18.849 -20.029
  629    HA   GLN  85           HA       GLN  85  -1.182  18.519 -20.444
  630    HB2  GLN  85           HB2      GLN  85   0.219  20.089 -18.233
  631    HB3  GLN  85           HB3      GLN  85  -1.457  20.290 -18.693
  632    HG2  GLN  85           HG2      GLN  85  -1.468  19.004 -16.737
  633    HG3  GLN  85           HG3      GLN  85  -1.932  17.932 -18.053
  634   HE21  GLN  85          HE22      GLN  85   1.556  18.713 -17.404
  635   HE22  GLN  85          HE21      GLN  85   1.884  17.085 -16.836
  636    HA   PRO  86           HA       PRO  86  -2.709  19.416 -21.618
  637    HB2  PRO  86           HB2      PRO  86  -3.584  20.329 -24.005
  638    HB3  PRO  86           HB3      PRO  86  -3.678  21.330 -22.526
  639    HG2  PRO  86           HG2      PRO  86  -1.531  21.403 -24.679
  640    HG3  PRO  86           HG3      PRO  86  -2.469  22.778 -24.009
  641    HD2  PRO  86           HD2      PRO  86   0.019  22.114 -23.078
  642    HD3  PRO  86           HD3      PRO  86  -1.252  22.753 -21.998
  643    H    PHE  87           H        PHE  87   0.237  19.399 -23.371
  644    HA   PHE  87           HA       PHE  87  -0.427  17.848 -25.648
  645    HB2  PHE  87           HB2      PHE  87   2.240  18.336 -24.261
  646    HB3  PHE  87           HB3      PHE  87   2.040  17.622 -25.853
  647    HD1  PHE  87           HD2      PHE  87   1.040  18.937 -27.745
  648    HD2  PHE  87           HD1      PHE  87   2.177  20.750 -23.996
  649    HE1  PHE  87           HE2      PHE  87   1.039  21.180 -28.821
  650    HE2  PHE  87           HE1      PHE  87   2.157  22.989 -25.073
  651    HZ   PHE  87           HZ       PHE  87   1.601  23.202 -27.487
  652    H    LYS  88           H        LYS  88   0.130  15.802 -26.248
  653    HA   LYS  88           HA       LYS  88  -0.356  13.695 -24.368
  654    HB2  LYS  88           HB2      LYS  88   0.025  12.189 -26.276
  655    HB3  LYS  88           HB3      LYS  88  -1.204  13.417 -26.522
  656    HG2  LYS  88           HG2      LYS  88   0.252  14.735 -27.960
  657    HG3  LYS  88           HG3      LYS  88   1.618  13.659 -27.674
  658    HD2  LYS  88           HD2      LYS  88  -0.980  12.819 -29.009
  659    HD3  LYS  88           HD3      LYS  88   0.504  13.291 -29.864
  660    HE2  LYS  88           HE2      LYS  88   1.754  11.463 -28.715
  661    HE3  LYS  88           HE3      LYS  88   0.279  11.007 -27.860
  662    HZ1  LYS  88           HZ1      LYS  88  -0.730  10.435 -29.993
  663    HZ2  LYS  88           HZ2      LYS  88   0.663  10.771 -30.783
  664    HZ3  LYS  88           HZ3      LYS  88   0.614   9.557 -29.665
  665    HA   PRO  89           HA       PRO  89   4.032  12.754 -23.437
  666    HB2  PRO  89           HB2      PRO  89   3.700  11.224 -21.237
  667    HB3  PRO  89           HB3      PRO  89   3.384  12.979 -21.201
  668    HG2  PRO  89           HG2      PRO  89   1.354  10.744 -21.565
  669    HG3  PRO  89           HG3      PRO  89   1.280  12.115 -20.419
  670    HD2  PRO  89           HD2      PRO  89   0.044  12.121 -22.880
  671    HD3  PRO  89           HD3      PRO  89   0.656  13.610 -22.102
  672    H    ASP  90           H        ASP  90   3.526  11.698 -25.659
  673    HA   ASP  90           HA       ASP  90   4.029   8.820 -25.632
  674    HB2  ASP  90           HB2      ASP  90   1.605   8.756 -25.366
  675    HB3  ASP  90           HB3      ASP  90   1.398   9.986 -26.603
  676    H    ASP  91           H        ASP  91   4.607   8.058 -27.713
  677    HA   ASP  91           HA       ASP  91   6.327   9.667 -29.155
  678    HB2  ASP  91           HB2      ASP  91   6.505   7.252 -28.775
  679    HB3  ASP  91           HB3      ASP  91   5.232   6.979 -29.967
  680    H    SER  92           H        SER  92   4.729  11.416 -29.593
  681    HA   SER  92           HA       SER  92   3.108  11.488 -31.947
  682    HB2  SER  92           HB2      SER  92   3.070  13.149 -30.125
  683    HB3  SER  92           HB3      SER  92   4.701  13.681 -30.569
  684    HG   SER  92           HG       SER  92   2.877  14.916 -31.473
  685    H    ASN  93           H        ASN  93   3.504  12.605 -33.914
  686    HA   ASN  93           HA       ASN  93   6.024  12.025 -35.280
  687    HB2  ASN  93           HB2      ASN  93   3.517  13.551 -36.133
  688    HB3  ASN  93           HB3      ASN  93   4.855  13.134 -37.198
  689   HD21  ASN  93          HD22      ASN  93   5.297  10.803 -37.593
  690   HD22  ASN  93          HD21      ASN  93   3.956   9.685 -37.451
  691    H    GLN  94           H        GLN  94   5.131  14.522 -33.184
  692    HA   GLN  94           HA       GLN  94   7.305  16.297 -34.185
  693    HB2  GLN  94           HB2      GLN  94   5.958  18.252 -33.803
  694    HB3  GLN  94           HB3      GLN  94   5.060  17.207 -34.882
  695    HG2  GLN  94           HG2      GLN  94   3.485  16.621 -33.172
  696    HG3  GLN  94           HG3      GLN  94   4.512  17.189 -31.863
  697   HE21  GLN  94          HE22      GLN  94   4.836  19.491 -31.525
  698   HE22  GLN  94          HE21      GLN  94   3.657  20.617 -32.193
  699    HA   PRO  95           HA       PRO  95   8.209  16.494 -29.757
  700    HB2  PRO  95           HB2      PRO  95   9.293  18.979 -29.448
  701    HB3  PRO  95           HB3      PRO  95  10.164  17.643 -30.262
  702    HG2  PRO  95           HG2      PRO  95   8.568  19.889 -31.534
  703    HG3  PRO  95           HG3      PRO  95  10.212  19.314 -31.972
  704    HD2  PRO  95           HD2      PRO  95   7.991  18.521 -33.303
  705    HD3  PRO  95           HD3      PRO  95   9.351  17.401 -33.033
  706    H    GLN  96           H        GLN  96   6.993  17.048 -27.970
  707    HA   GLN  96           HA       GLN  96   4.582  18.623 -28.205
  708    HB2  GLN  96           HB2      GLN  96   6.035  17.449 -25.787
  709    HB3  GLN  96           HB3      GLN  96   4.482  18.259 -25.724
  710    HG2  GLN  96           HG2      GLN  96   3.957  15.976 -25.728
  711    HG3  GLN  96           HG3      GLN  96   3.559  16.546 -27.347
  712   HE21  GLN  96          HE22      GLN  96   3.698  13.996 -27.569
  713   HE22  GLN  96          HE21      GLN  96   5.285  13.406 -28.037
  714    H    VAL  97           H        VAL  97   7.874  19.424 -27.272
  715    HA   VAL  97           HA       VAL  97   7.021  22.188 -26.475
  716    HB   VAL  97           HB       VAL  97   9.457  20.583 -25.600
  717   HG11  VAL  97          HG11      VAL  97   9.916  23.012 -25.571
  718   HG12  VAL  97          HG12      VAL  97   8.442  23.279 -24.612
  719   HG13  VAL  97          HG13      VAL  97   9.800  22.362 -23.936
  720   HG21  VAL  97          HG21      VAL  97   7.427  19.655 -24.568
  721   HG22  VAL  97          HG22      VAL  97   8.371  20.537 -23.378
  722   HG23  VAL  97          HG23      VAL  97   6.916  21.284 -24.072
  723    H    VAL  98           H        VAL  98   7.916  23.892 -27.524
  724    HA   VAL  98           HA       VAL  98  10.167  23.405 -29.440
  725    HB   VAL  98           HB       VAL  98   7.593  24.867 -30.082
  726   HG11  VAL  98          HG11      VAL  98  10.112  24.540 -31.762
  727   HG12  VAL  98          HG12      VAL  98   8.555  25.148 -32.356
  728   HG13  VAL  98          HG13      VAL  98   9.439  26.070 -31.146
  729   HG21  VAL  98          HG21      VAL  98   7.360  22.428 -30.274
  730   HG22  VAL  98          HG22      VAL  98   7.401  23.158 -31.877
  731   HG23  VAL  98          HG23      VAL  98   8.849  22.346 -31.239
  732    H    ILE  99           H        ILE  99  11.557  25.025 -29.766
  733    HA   ILE  99           HA       ILE  99  11.618  27.276 -27.798
  734    HB   ILE  99           HB       ILE  99  13.875  25.432 -28.737
  735   HG12  ILE  99          HG12      ILE  99  13.982  24.978 -26.156
  736   HG13  ILE  99          HG13      ILE  99  12.285  25.422 -26.158
  737   HG21  ILE  99          HG21      ILE  99  14.681  27.701 -28.275
  738   HG22  ILE  99          HG22      ILE  99  13.850  27.697 -26.700
  739   HG23  ILE  99          HG23      ILE  99  15.201  26.590 -27.031
  740   HD11  ILE  99          HD11      ILE  99  11.786  23.510 -27.633
  741   HD12  ILE  99          HD12      ILE  99  13.522  23.203 -27.861
  742   HD13  ILE  99          HD13      ILE  99  12.761  22.958 -26.276
  743    H    LEU 100           H        LEU 100  11.889  29.216 -28.729
  744    HA   LEU 100           HA       LEU 100  12.717  29.460 -31.553
  745    HB2  LEU 100           HB2      LEU 100  12.171  31.720 -29.599
  746    HB3  LEU 100           HB3      LEU 100  12.234  31.787 -31.355
  747    HG   LEU 100           HG       LEU 100  10.045  30.776 -29.563
  748   HD11  LEU 100          HD11      LEU 100   8.701  32.325 -30.875
  749   HD12  LEU 100          HD12      LEU 100  10.160  33.166 -30.320
  750   HD13  LEU 100          HD13      LEU 100  10.048  32.611 -31.998
  751   HD21  LEU 100          HD21      LEU 100  10.234  28.994 -31.284
  752   HD22  LEU 100          HD22      LEU 100   8.815  29.993 -31.601
  753   HD23  LEU 100          HD23      LEU 100  10.290  30.229 -32.564
  754    H    ALA 101           H        ALA 101  14.338  30.900 -32.227
  755    HA   ALA 101           HA       ALA 101  16.927  30.792 -31.032
  756    HB1  ALA 101           HB1      ALA 101  17.475  32.493 -32.747
  757    HB2  ALA 101           HB2      ALA 101  16.466  31.204 -33.440
  758    HB3  ALA 101           HB3      ALA 101  15.750  32.778 -33.035
  759    H    ASP 102           H        ASP 102  14.273  33.014 -30.494
  760    HA   ASP 102           HA       ASP 102  15.894  34.972 -28.998
  761    HB2  ASP 102           HB2      ASP 102  14.150  35.587 -30.719
  762    HB3  ASP 102           HB3      ASP 102  12.920  34.929 -29.644
  763    H    GLY 103           H        GLY 103  15.120  32.073 -28.038
  764    HA2  GLY 103           HA2      GLY 103  14.877  31.108 -25.988
  765    HA3  GLY 103           HA3      GLY 103  15.044  32.706 -25.254
  766    H    GLN 104           H        GLN 104  12.391  32.435 -27.451
  767    HA   GLN 104           HA       GLN 104  10.432  32.354 -25.236
  768    HB2  GLN 104           HB2      GLN 104   9.765  32.422 -28.177
  769    HB3  GLN 104           HB3      GLN 104   8.725  32.781 -26.818
  770    HG2  GLN 104           HG2      GLN 104  10.997  34.444 -27.923
  771    HG3  GLN 104           HG3      GLN 104   9.278  34.831 -27.883
  772   HE21  GLN 104          HE22      GLN 104  12.275  34.877 -26.123
  773   HE22  GLN 104          HE21      GLN 104  11.647  35.694 -24.691
  774    H    ILE 105           H        ILE 105   8.995  30.704 -25.015
  775    HA   ILE 105           HA       ILE 105   9.663  28.077 -26.277
  776    HB   ILE 105           HB       ILE 105   9.097  28.268 -23.317
  777   HG12  ILE 105          HG12      ILE 105  11.071  29.711 -23.568
  778   HG13  ILE 105          HG13      ILE 105  11.378  28.258 -22.643
  779   HG21  ILE 105          HG21      ILE 105  10.516  26.278 -25.121
  780   HG22  ILE 105          HG22      ILE 105  10.442  26.123 -23.351
  781   HG23  ILE 105          HG23      ILE 105   8.953  26.062 -24.308
  782   HD11  ILE 105          HD11      ILE 105  13.201  28.951 -24.203
  783   HD12  ILE 105          HD12      ILE 105  12.642  27.283 -24.445
  784   HD13  ILE 105          HD13      ILE 105  12.123  28.573 -25.553
  785    H    THR 106           H        THR 106   7.897  26.664 -26.496
  786    HA   THR 106           HA       THR 106   5.228  27.595 -26.521
  787    HB   THR 106           HB       THR 106   4.734  25.055 -26.352
  788    HG1  THR 106           HG1      THR 106   6.716  24.630 -25.278
  789   HG21  THR 106          HG21      THR 106   4.848  26.173 -28.510
  790   HG22  THR 106          HG22      THR 106   6.622  26.110 -28.480
  791   HG23  THR 106          HG23      THR 106   5.672  24.604 -28.596
  792    HA   PRO 107           HA       PRO 107   4.490  27.352 -22.034
  793    HB2  PRO 107           HB2      PRO 107   1.858  28.089 -21.945
  794    HB3  PRO 107           HB3      PRO 107   3.219  29.231 -22.148
  795    HG2  PRO 107           HG2      PRO 107   1.412  28.087 -24.274
  796    HG3  PRO 107           HG3      PRO 107   2.003  29.772 -24.083
  797    HD2  PRO 107           HD2      PRO 107   3.123  27.943 -25.817
  798    HD3  PRO 107           HD3      PRO 107   4.060  29.259 -25.046
  799    H    PHE 108           H        PHE 108   4.146  25.557 -20.924
  800    HA   PHE 108           HA       PHE 108   1.957  23.716 -21.250
  801    HB2  PHE 108           HB2      PHE 108   3.084  21.806 -21.971
  802    HB3  PHE 108           HB3      PHE 108   3.657  23.028 -23.079
  803    HD1  PHE 108           HD2      PHE 108   5.937  24.241 -22.291
  804    HD2  PHE 108           HD1      PHE 108   4.652  20.337 -21.018
  805    HE1  PHE 108           HE2      PHE 108   8.273  23.666 -21.745
  806    HE2  PHE 108           HE1      PHE 108   7.011  19.753 -20.495
  807    HZ   PHE 108           HZ       PHE 108   8.814  21.421 -20.804
  808    H    SER 109           H        SER 109   2.307  21.801 -19.702
  809    HA   SER 109           HA       SER 109   4.217  22.407 -17.522
  810    HB2  SER 109           HB2      SER 109   1.286  21.749 -17.044
  811    HB3  SER 109           HB3      SER 109   2.548  21.764 -15.798
  812    HG   SER 109           HG       SER 109   1.809  23.965 -17.437
  813    H    LEU 110           H        LEU 110   5.027  20.654 -16.482
  814    HA   LEU 110           HA       LEU 110   4.541  17.932 -17.625
  815    HB2  LEU 110           HB2      LEU 110   6.307  18.451 -18.891
  816    HB3  LEU 110           HB3      LEU 110   6.834  19.778 -17.869
  817    HG   LEU 110           HG       LEU 110   8.014  18.218 -16.377
  818   HD11  LEU 110          HD11      LEU 110   7.368  16.097 -18.473
  819   HD12  LEU 110          HD12      LEU 110   8.428  15.906 -17.066
  820   HD13  LEU 110          HD13      LEU 110   6.689  16.103 -16.833
  821   HD21  LEU 110          HD21      LEU 110   9.148  19.309 -18.265
  822   HD22  LEU 110          HD22      LEU 110   9.809  17.691 -17.981
  823   HD23  LEU 110          HD23      LEU 110   8.692  17.969 -19.333
  824    H    LEU 111           H        LEU 111   4.056  16.601 -16.033
  825    HA   LEU 111           HA       LEU 111   4.966  17.147 -13.249
  826    HB2  LEU 111           HB2      LEU 111   2.571  17.299 -13.652
  827    HB3  LEU 111           HB3      LEU 111   2.522  15.690 -14.349
  828    HG   LEU 111           HG       LEU 111   3.613  15.992 -11.557
  829   HD11  LEU 111          HD11      LEU 111   1.616  17.381 -11.477
  830   HD12  LEU 111          HD12      LEU 111   0.646  16.090 -12.226
  831   HD13  LEU 111          HD13      LEU 111   1.336  15.872 -10.599
  832   HD21  LEU 111          HD21      LEU 111   2.539  13.827 -11.203
  833   HD22  LEU 111          HD22      LEU 111   1.718  13.925 -12.776
  834   HD23  LEU 111          HD23      LEU 111   3.472  13.722 -12.692
  835    H    MET 112           H        MET 112   5.836  15.549 -12.023
  836    HA   MET 112           HA       MET 112   6.761  13.071 -13.424
  837    HB2  MET 112           HB2      MET 112   8.158  14.801 -11.350
  838    HB3  MET 112           HB3      MET 112   8.743  13.230 -11.920
  839    HG2  MET 112           HG2      MET 112   8.953  14.095 -14.200
  840    HG3  MET 112           HG3      MET 112   8.299  15.659 -13.695
  841    HE1  MET 112           HE1      MET 112  10.302  16.864 -14.839
  842    HE2  MET 112           HE2      MET 112  12.013  16.552 -14.466
  843    HE3  MET 112           HE3      MET 112  11.050  15.319 -15.312
  844    H    ALA 113           H        ALA 113   6.280  11.206 -12.483
  845    HA   ALA 113           HA       ALA 113   5.197  11.117  -9.698
  846    HB1  ALA 113           HB1      ALA 113   4.107   9.744 -12.176
  847    HB2  ALA 113           HB2      ALA 113   3.502   9.546 -10.517
  848    HB3  ALA 113           HB3      ALA 113   3.368  11.120 -11.326
  849    H    ASN 114           H        ASN 114   5.895   9.485  -8.445
  850    HA   ASN 114           HA       ASN 114   8.199   8.035  -8.924
  851    HB2  ASN 114           HB2      ASN 114   7.044   8.561  -6.740
  852    HB3  ASN 114           HB3      ASN 114   5.895   7.277  -7.066
  853   HD21  ASN 114          HD22      ASN 114   8.300   7.872  -5.124
  854   HD22  ASN 114          HD21      ASN 114   9.202   6.373  -5.145
  855    H    ALA 115           H        ALA 115   8.651   6.383 -10.294
  856    HA   ALA 115           HA       ALA 115   6.732   5.018 -11.847
  857    HB1  ALA 115           HB1      ALA 115   8.659   3.707 -12.636
  858    HB2  ALA 115           HB2      ALA 115   9.069   5.424 -12.507
  859    HB3  ALA 115           HB3      ALA 115   9.628   4.279 -11.263
  860    H    GLY 116           H        GLY 116   7.741   4.205  -8.609
  861    HA2  GLY 116           HA2      GLY 116   6.618   1.427  -8.827
  862    HA3  GLY 116           HA3      GLY 116   7.709   2.032  -7.583
  863    H    THR 117           H        THR 117   6.545   4.320  -6.652
  864    HA   THR 117           HA       THR 117   4.293   3.331  -5.121
  865    HB   THR 117           HB       THR 117   5.394   6.158  -5.217
  866    HG1  THR 117           HG1      THR 117   6.717   5.444  -3.551
  867   HG21  THR 117          HG21      THR 117   4.712   6.148  -2.791
  868   HG22  THR 117          HG22      THR 117   3.357   6.127  -3.921
  869   HG23  THR 117          HG23      THR 117   3.838   4.629  -3.099
  870    H    GLY 118           H        GLY 118   4.490   5.220  -8.089
  871    HA2  GLY 118           HA2      GLY 118   2.862   5.895  -9.520
  872    HA3  GLY 118           HA3      GLY 118   1.665   5.035  -8.546
  873    H    GLU 119           H        GLU 119   3.766   7.763  -7.512
  874    HA   GLU 119           HA       GLU 119   1.378   9.464  -7.034
  875    HB2  GLU 119           HB2      GLU 119   1.895   8.105  -5.071
  876    HB3  GLU 119           HB3      GLU 119   3.579   8.650  -5.095
  877    HG2  GLU 119           HG2      GLU 119   2.891  10.933  -4.658
  878    HG3  GLU 119           HG3      GLU 119   1.185  10.487  -4.789
  879    HA   PRO 120           HA       PRO 120   3.988  12.675  -8.841
  880    HB2  PRO 120           HB2      PRO 120   2.417  14.445  -6.975
  881    HB3  PRO 120           HB3      PRO 120   2.826  14.705  -8.700
  882    HG2  PRO 120           HG2      PRO 120   0.362  13.830  -7.995
  883    HG3  PRO 120           HG3      PRO 120   1.203  13.084  -9.392
  884    HD2  PRO 120           HD2      PRO 120   0.957  12.035  -6.572
  885    HD3  PRO 120           HD3      PRO 120   0.795  11.170  -8.131
  886    H    LEU 121           H        LEU 121   5.808  13.876  -8.361
  887    HA   LEU 121           HA       LEU 121   6.492  14.509  -5.535
  888    HB2  LEU 121           HB2      LEU 121   8.773  13.619  -5.775
  889    HB3  LEU 121           HB3      LEU 121   7.531  12.405  -5.718
  890    HG   LEU 121           HG       LEU 121   9.525  12.047  -7.308
  891   HD11  LEU 121          HD11      LEU 121   8.284  10.863  -8.912
  892   HD12  LEU 121          HD12      LEU 121   7.543  10.677  -7.305
  893   HD13  LEU 121          HD13      LEU 121   6.804  11.759  -8.498
  894   HD21  LEU 121          HD21      LEU 121   7.942  13.802  -9.189
  895   HD22  LEU 121          HD22      LEU 121   9.444  14.297  -8.385
  896   HD23  LEU 121          HD23      LEU 121   9.432  12.923  -9.512
  897    H    LEU 122           H        LEU 122   6.501  15.600  -8.748
  898    HA   LEU 122           HA       LEU 122   7.506  18.201  -8.031
  899    HB2  LEU 122           HB2      LEU 122   9.657  16.705  -8.481
  900    HB3  LEU 122           HB3      LEU 122   9.121  16.732 -10.152
  901    HG   LEU 122           HG       LEU 122   9.184  19.342  -9.897
  902   HD11  LEU 122          HD11      LEU 122  10.746  20.165  -8.207
  903   HD12  LEU 122          HD12      LEU 122   9.408  19.332  -7.401
  904   HD13  LEU 122          HD13      LEU 122  10.961  18.511  -7.562
  905   HD21  LEU 122          HD21      LEU 122  11.530  19.395 -10.446
  906   HD22  LEU 122          HD22      LEU 122  11.780  17.778  -9.751
  907   HD23  LEU 122          HD23      LEU 122  10.792  17.990 -11.214
  908    H    THR 123           H        THR 123   7.127  19.710  -9.759
  909    HA   THR 123           HA       THR 123   6.185  18.723 -12.360
  910    HB   THR 123           HB       THR 123   4.462  20.698 -10.814
  911    HG1  THR 123           HG1      THR 123   4.518  17.991 -10.808
  912   HG21  THR 123          HG21      THR 123   4.269  20.975 -13.258
  913   HG22  THR 123          HG22      THR 123   3.924  19.235 -13.411
  914   HG23  THR 123          HG23      THR 123   2.806  20.302 -12.565
  915    H    LEU 124           H        LEU 124   6.430  20.216 -13.986
  916    HA   LEU 124           HA       LEU 124   8.063  22.651 -13.436
  917    HB2  LEU 124           HB2      LEU 124   8.207  20.722 -15.793
  918    HB3  LEU 124           HB3      LEU 124   9.223  22.141 -15.546
  919    HG   LEU 124           HG       LEU 124   9.213  19.636 -13.795
  920   HD11  LEU 124          HD11      LEU 124  11.273  20.694 -15.773
  921   HD12  LEU 124          HD12      LEU 124  11.454  19.259 -14.739
  922   HD13  LEU 124          HD13      LEU 124  10.232  19.278 -16.016
  923   HD21  LEU 124          HD21      LEU 124  11.200  20.594 -12.750
  924   HD22  LEU 124          HD22      LEU 124  11.010  22.089 -13.704
  925   HD23  LEU 124          HD23      LEU 124   9.801  21.618 -12.483
  926    H    VAL 125           H        VAL 125   7.408  24.470 -14.442
  927    HA   VAL 125           HA       VAL 125   4.989  24.372 -16.224
  928    HB   VAL 125           HB       VAL 125   5.483  26.205 -13.844
  929   HG11  VAL 125          HG11      VAL 125   3.119  26.905 -14.198
  930   HG12  VAL 125          HG12      VAL 125   4.152  27.362 -15.549
  931   HG13  VAL 125          HG13      VAL 125   3.073  25.954 -15.697
  932   HG21  VAL 125          HG21      VAL 125   3.524  23.890 -14.178
  933   HG22  VAL 125          HG22      VAL 125   4.894  23.962 -13.046
  934   HG23  VAL 125          HG23      VAL 125   3.527  25.045 -12.826
  935    H    CYS 126           H        CYS 126   4.903  25.709 -17.907
  936    HA   CYS 126           HA       CYS 126   7.002  27.821 -18.264
  937    HB2  CYS 126           HB2      CYS 126   7.164  25.753 -19.760
  938    HB3  CYS 126           HB3      CYS 126   5.581  26.151 -20.375
  939    HG   CYS 126           HG       CYS 126   7.128  26.919 -22.211
  940    H    SER 127           H        SER 127   6.365  29.770 -19.156
  941    HA   SER 127           HA       SER 127   3.446  30.327 -19.511
  942    HB2  SER 127           HB2      SER 127   3.870  32.483 -18.394
  943    HB3  SER 127           HB3      SER 127   4.252  31.107 -17.346
  944    HG   SER 127           HG       SER 127   5.899  32.712 -17.317
  945    H    GLY 128           H        GLY 128   6.218  30.185 -21.289
  946    HA2  GLY 128           HA2      GLY 128   5.656  30.970 -23.645
  947    HA3  GLY 128           HA3      GLY 128   5.579  32.591 -22.966
  948    H    SER 129           H        SER 129   8.074  31.466 -21.225
  949    HA   SER 129           HA       SER 129  10.210  31.747 -23.233
  950    HB2  SER 129           HB2      SER 129  11.110  33.802 -22.266
  951    HB3  SER 129           HB3      SER 129   9.482  34.059 -22.908
  952    HG   SER 129           HG       SER 129   9.741  34.998 -20.835
  953    H    TRP 130           H        TRP 130  12.336  31.607 -22.440
  954    HA   TRP 130           HA       TRP 130  12.915  29.617 -20.606
  955    HB2  TRP 130           HB2      TRP 130  14.423  30.253 -22.310
  956    HB3  TRP 130           HB3      TRP 130  14.452  31.929 -21.805
  957    HD1  TRP 130           HD1      TRP 130  16.307  32.714 -20.287
  958    HE1  TRP 130           HE1      TRP 130  18.212  31.639 -18.948
  959    HE3  TRP 130           HE3      TRP 130  15.076  27.794 -20.954
  960    HZ2  TRP 130           HZ2      TRP 130  19.102  28.962 -18.253
  961    HZ3  TRP 130           HZ3      TRP 130  16.419  26.020 -19.840
  962    HH2  TRP 130           HH2      TRP 130  18.415  26.597 -18.502
  963    HA   PRO 131           HA       PRO 131  13.508  28.542 -19.023
  964    HB2  PRO 131           HB2      PRO 131  14.281  27.734 -16.604
  965    HB3  PRO 131           HB3      PRO 131  15.401  28.692 -17.609
  966    HG2  PRO 131           HG2      PRO 131  13.648  29.656 -15.343
  967    HG3  PRO 131           HG3      PRO 131  15.385  29.990 -15.642
  968    HD2  PRO 131           HD2      PRO 131  13.290  31.677 -16.427
  969    HD3  PRO 131           HD3      PRO 131  14.894  31.629 -17.212
  970    H    LEU 132           H        LEU 132  12.418  26.643 -17.713
  971    HA   LEU 132           HA       LEU 132   9.676  27.327 -16.942
  972    HB2  LEU 132           HB2      LEU 132  11.260  24.750 -17.268
  973    HB3  LEU 132           HB3      LEU 132   9.842  24.768 -16.235
  974    HG   LEU 132           HG       LEU 132   8.622  25.909 -18.210
  975   HD11  LEU 132          HD11      LEU 132   9.362  25.240 -20.439
  976   HD12  LEU 132          HD12      LEU 132  10.558  26.283 -19.675
  977   HD13  LEU 132          HD13      LEU 132  10.836  24.528 -19.755
  978   HD21  LEU 132          HD21      LEU 132   7.880  23.772 -19.061
  979   HD22  LEU 132          HD22      LEU 132   9.327  22.964 -18.429
  980   HD23  LEU 132          HD23      LEU 132   8.120  23.655 -17.330
  981    H    ASP 133           H        ASP 133   8.809  26.529 -14.923
  982    HA   ASP 133           HA       ASP 133  10.595  27.178 -12.593
  983    HB2  ASP 133           HB2      ASP 133   8.955  28.934 -13.203
  984    HB3  ASP 133           HB3      ASP 133   7.642  27.768 -13.004
  985    H    GLN 134           H        GLN 134  10.569  25.890 -10.819
  986    HA   GLN 134           HA       GLN 134   9.325  23.234 -11.053
  987    HB2  GLN 134           HB2      GLN 134  11.288  24.356  -8.995
  988    HB3  GLN 134           HB3      GLN 134  10.782  22.673  -9.151
  989    HG2  GLN 134           HG2      GLN 134  11.803  22.644 -11.458
  990    HG3  GLN 134           HG3      GLN 134  12.430  24.261 -11.163
  991   HE21  GLN 134          HE22      GLN 134  12.654  20.816 -10.125
  992   HE22  GLN 134          HE21      GLN 134  14.251  21.035  -9.428
  993    H    THR 135           H        THR 135   8.017  22.332  -9.573
  994    HA   THR 135           HA       THR 135   7.374  23.563  -6.983
  995    HB   THR 135           HB       THR 135   5.729  24.533  -8.614
  996    HG1  THR 135           HG1      THR 135   5.132  24.404  -6.492
  997   HG21  THR 135          HG21      THR 135   4.612  21.705  -8.751
  998   HG22  THR 135          HG22      THR 135   3.852  23.186  -9.367
  999   HG23  THR 135          HG23      THR 135   5.357  22.622 -10.097
 1000    H    LEU 136           H        LEU 136   5.801  22.019  -5.778
 1001    HA   LEU 136           HA       LEU 136   6.450  19.155  -6.401
 1002    HB2  LEU 136           HB2      LEU 136   5.975  20.594  -3.776
 1003    HB3  LEU 136           HB3      LEU 136   5.590  18.888  -3.960
 1004    HG   LEU 136           HG       LEU 136   7.925  18.398  -4.640
 1005   HD11  LEU 136          HD11      LEU 136   9.710  20.045  -4.087
 1006   HD12  LEU 136          HD12      LEU 136   8.728  20.561  -5.455
 1007   HD13  LEU 136          HD13      LEU 136   8.464  21.295  -3.858
 1008   HD21  LEU 136          HD21      LEU 136   7.162  18.130  -2.313
 1009   HD22  LEU 136          HD22      LEU 136   8.864  18.604  -2.381
 1010   HD23  LEU 136          HD23      LEU 136   7.626  19.809  -1.960
 1011    H    ALA 137           H        ALA 137   4.800  17.816  -6.797
 1012    HA   ALA 137           HA       ALA 137   2.821  17.339  -7.832
 1013    HB1  ALA 137           HB1      ALA 137   1.953  17.957  -4.978
 1014    HB2  ALA 137           HB2      ALA 137   1.143  16.843  -6.103
 1015    HB3  ALA 137           HB3      ALA 137   2.776  16.476  -5.514
 1016    H    ARG 138           H        ARG 138   3.126  19.465  -9.033
 1017    HA   ARG 138           HA       ARG 138   2.483  21.485  -9.832
 1018    HB2  ARG 138           HB2      ARG 138   0.576  21.302 -11.158
 1019    HB3  ARG 138           HB3      ARG 138   1.358  19.732 -11.052
 1020    HG2  ARG 138           HG2      ARG 138  -0.380  18.944  -9.470
 1021    HG3  ARG 138           HG3      ARG 138  -1.195  20.522  -9.605
 1022    HD2  ARG 138           HD2      ARG 138  -1.265  20.163 -12.116
 1023    HD3  ARG 138           HD3      ARG 138  -0.598  18.555 -11.856
 1024    HE   ARG 138           HE       ARG 138  -2.664  17.802 -11.062
 1025   HH11  ARG 138          HH21      ARG 138  -2.834  21.313 -11.308
 1026   HH12  ARG 138          HH22      ARG 138  -4.571  21.320 -11.215
 1027   HH21  ARG 138          HH11      ARG 138  -4.894  17.918 -10.869
 1028   HH22  ARG 138          HH12      ARG 138  -5.679  19.467 -10.919
 1029    H    ASP 139           H        ASP 139   2.367  21.825  -6.963
 1030    HA   ASP 139           HA       ASP 139   0.017  23.138  -6.162
 1031    HB2  ASP 139           HB2      ASP 139   1.836  22.426  -4.660
 1032    HB3  ASP 139           HB3      ASP 139   2.864  23.715  -5.286
 1033    H    THR 140           H        THR 140   2.666  24.522  -8.092
 1034    HA   THR 140           HA       THR 140   1.519  27.220  -8.114
 1035    HB   THR 140           HB       THR 140   3.181  27.654  -9.914
 1036    HG1  THR 140           HG1      THR 140   4.600  26.035 -10.440
 1037   HG21  THR 140          HG21      THR 140   4.318  26.289  -7.444
 1038   HG22  THR 140          HG22      THR 140   5.205  27.362  -8.547
 1039   HG23  THR 140          HG23      THR 140   3.852  27.993  -7.590
 1040    H    ARG 141           H        ARG 141   0.439  24.420  -9.637
 1041    HA   ARG 141           HA       ARG 141  -0.952  25.959 -11.762
 1042    HB2  ARG 141           HB2      ARG 141   1.056  25.031 -12.776
 1043    HB3  ARG 141           HB3      ARG 141   0.630  23.416 -12.236
 1044    HG2  ARG 141           HG2      ARG 141   0.197  23.778 -14.618
 1045    HG3  ARG 141           HG3      ARG 141  -1.278  23.346 -13.781
 1046    HD2  ARG 141           HD2      ARG 141  -0.524  26.228 -14.391
 1047    HD3  ARG 141           HD3      ARG 141  -1.376  25.205 -15.552
 1048    HE   ARG 141           HE       ARG 141  -3.067  24.900 -13.512
 1049   HH11  ARG 141          HH11      ARG 141  -1.676  27.934 -14.635
 1050   HH12  ARG 141          HH12      ARG 141  -3.042  28.836 -14.047
 1051   HH21  ARG 141          HH21      ARG 141  -4.650  26.032 -12.831
 1052   HH22  ARG 141          HH22      ARG 141  -4.741  27.783 -13.050
 1053    HA   PRO 142           HA       PRO 142  -4.112  23.472  -9.401
 1054    HB2  PRO 142           HB2      PRO 142  -5.521  25.988 -10.300
 1055    HB3  PRO 142           HB3      PRO 142  -5.741  25.049  -8.791
 1056    HG2  PRO 142           HG2      PRO 142  -4.294  27.337  -8.772
 1057    HG3  PRO 142           HG3      PRO 142  -3.699  25.896  -7.882
 1058    HD2  PRO 142           HD2      PRO 142  -2.851  26.906 -10.605
 1059    HD3  PRO 142           HD3      PRO 142  -1.850  26.316  -9.245
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1   9.393  -6.193  -1.726
    2    H2   MET   1           H2       MET   1   8.351  -6.643  -2.902
    3    H3   MET   1           H3       MET   1   9.948  -6.968  -3.052
    4    HA   MET   1           HA       MET   1  10.483  -4.627  -3.171
    5    HB2  MET   1           HB2      MET   1  10.053  -5.913  -5.264
    6    HB3  MET   1           HB3      MET   1   8.359  -5.414  -5.219
    7    HG2  MET   1           HG2      MET   1   9.030  -3.055  -5.425
    8    HG3  MET   1           HG3      MET   1  10.735  -3.507  -5.379
    9    HE1  MET   1           HE1      MET   1  11.094  -5.960  -7.346
   10    HE2  MET   1           HE2      MET   1  11.386  -5.086  -8.862
   11    HE3  MET   1           HE3      MET   1  12.090  -4.484  -7.346
   12    H    ALA   2           H        ALA   2   9.937  -2.524  -2.791
   13    HA   ALA   2           HA       ALA   2   7.120  -1.713  -2.437
   14    HB1  ALA   2           HB1      ALA   2   9.246  -1.417  -0.262
   15    HB2  ALA   2           HB2      ALA   2   7.596  -0.760  -0.204
   16    HB3  ALA   2           HB3      ALA   2   7.847  -2.512  -0.201
   17    H    TYR   3           H        TYR   3   6.962   0.671  -2.128
   18    HA   TYR   3           HA       TYR   3   9.045   2.127  -3.723
   19    HB2  TYR   3           HB2      TYR   3   6.052   2.460  -3.959
   20    HB3  TYR   3           HB3      TYR   3   7.291   3.057  -5.053
   21    HD1  TYR   3           HD1      TYR   3   8.856   1.046  -6.068
   22    HD2  TYR   3           HD2      TYR   3   4.788   0.658  -4.673
   23    HE1  TYR   3           HE1      TYR   3   8.544  -0.965  -7.512
   24    HE2  TYR   3           HE2      TYR   3   4.476  -1.331  -6.121
   25    HH   TYR   3           HH       TYR   3   5.437  -2.747  -7.644
   26    H    GLY   4           H        GLY   4   7.884   2.164  -0.716
   27    HA2  GLY   4           HA2      GLY   4   6.817   4.822  -0.368
   28    HA3  GLY   4           HA3      GLY   4   7.204   3.654   0.894
   29    H    ARG   5           H        ARG   5   9.177   5.374  -1.541
   30    HA   ARG   5           HA       ARG   5  10.777   6.692   0.601
   31    HB2  ARG   5           HB2      ARG   5  11.885   4.561  -0.168
   32    HB3  ARG   5           HB3      ARG   5  12.000   5.251  -1.783
   33    HG2  ARG   5           HG2      ARG   5  14.124   5.478  -0.666
   34    HG3  ARG   5           HG3      ARG   5  13.433   7.079  -0.873
   35    HD2  ARG   5           HD2      ARG   5  12.673   7.017   1.527
   36    HD3  ARG   5           HD3      ARG   5  13.514   5.478   1.713
   37    HE   ARG   5           HE       ARG   5  14.708   8.190   1.382
   38   HH11  ARG   5          HH11      ARG   5  15.508   4.770   1.597
   39   HH12  ARG   5          HH12      ARG   5  17.190   5.137   1.841
   40   HH21  ARG   5          HH21      ARG   5  16.695   8.556   1.634
   41   HH22  ARG   5          HH22      ARG   5  17.881   7.273   1.886
   42    H    GLU   6           H        GLU   6   8.927   8.061  -0.305
   43    HA   GLU   6           HA       GLU   6   9.142   9.702  -2.560
   44    HB2  GLU   6           HB2      GLU   6   7.822  11.279  -1.436
   45    HB3  GLU   6           HB3      GLU   6   7.286   9.696  -0.899
   46    HG2  GLU   6           HG2      GLU   6   9.019  11.661   0.672
   47    HG3  GLU   6           HG3      GLU   6   7.315  11.346   0.920
   48    H    ASP   7           H        ASP   7  11.058   9.953   0.429
   49    HA   ASP   7           HA       ASP   7  12.549  12.260  -0.004
   50    HB2  ASP   7           HB2      ASP   7  12.737  11.012   2.008
   51    HB3  ASP   7           HB3      ASP   7  13.163   9.536   1.153
   52    H    VAL   8           H        VAL   8  13.262   9.063  -1.449
   53    HA   VAL   8           HA       VAL   8  15.539  10.138  -3.006
   54    HB   VAL   8           HB       VAL   8  14.165   7.430  -3.109
   55   HG11  VAL   8          HG11      VAL   8  15.064   7.891  -5.360
   56   HG12  VAL   8          HG12      VAL   8  16.611   8.408  -4.659
   57   HG13  VAL   8          HG13      VAL   8  16.081   6.717  -4.538
   58   HG21  VAL   8          HG21      VAL   8  15.630   7.945  -1.103
   59   HG22  VAL   8          HG22      VAL   8  16.255   6.630  -2.109
   60   HG23  VAL   8          HG23      VAL   8  16.971   8.253  -2.209
   61    H    ALA   9           H        ALA   9  12.123   9.128  -3.689
   62    HA   ALA   9           HA       ALA   9  12.253   9.616  -6.465
   63    HB1  ALA   9           HB1      ALA   9  10.409   8.440  -5.267
   64    HB2  ALA   9           HB2      ALA   9   9.846  10.010  -4.650
   65    HB3  ALA   9           HB3      ALA   9   9.830   9.678  -6.397
   66    H    ASN  10           H        ASN  10  11.405  12.004  -3.889
   67    HA   ASN  10           HA       ASN  10  11.052  14.242  -5.651
   68    HB2  ASN  10           HB2      ASN  10  10.245  14.203  -3.314
   69    HB3  ASN  10           HB3      ASN  10  11.899  14.076  -2.720
   70   HD21  ASN  10          HD22      ASN  10   9.590  16.299  -4.353
   71   HD22  ASN  10          HD21      ASN  10  10.519  17.719  -3.941
   72    H    THR  11           H        THR  11  13.986  13.047  -3.947
   73    HA   THR  11           HA       THR  11  15.785  15.060  -4.875
   74    HB   THR  11           HB       THR  11  16.349  12.120  -4.310
   75    HG1  THR  11           HG1      THR  11  15.573  12.987  -2.483
   76   HG21  THR  11          HG21      THR  11  18.201  14.546  -4.387
   77   HG22  THR  11          HG22      THR  11  18.642  12.937  -3.770
   78   HG23  THR  11          HG23      THR  11  18.253  13.144  -5.482
   79    H    ARG  12           H        ARG  12  14.997  11.868  -6.351
   80    HA   ARG  12           HA       ARG  12  16.553  12.278  -8.739
   81    HB2  ARG  12           HB2      ARG  12  14.098  10.511  -8.249
   82    HB3  ARG  12           HB3      ARG  12  15.150  10.400  -9.658
   83    HG2  ARG  12           HG2      ARG  12  15.990   9.867  -6.775
   84    HG3  ARG  12           HG3      ARG  12  15.654   8.644  -7.990
   85    HD2  ARG  12           HD2      ARG  12  17.828  10.750  -8.238
   86    HD3  ARG  12           HD3      ARG  12  18.085   9.148  -7.545
   87    HE   ARG  12           HE       ARG  12  17.220   8.255  -9.775
   88   HH11  ARG  12          HH21      ARG  12  18.901  11.393  -9.813
   89   HH12  ARG  12          HH22      ARG  12  19.232  11.183 -11.519
   90   HH21  ARG  12          HH11      ARG  12  18.083   7.954 -11.615
   91   HH22  ARG  12          HH12      ARG  12  18.577   9.335 -12.607
   92    H    ALA  13           H        ALA  13  13.148  13.129  -8.048
   93    HA   ALA  13           HA       ALA  13  12.477  13.994 -10.665
   94    HB1  ALA  13           HB1      ALA  13  10.878  13.669  -8.811
   95    HB2  ALA  13           HB2      ALA  13  11.538  15.117  -8.010
   96    HB3  ALA  13           HB3      ALA  13  10.733  15.255  -9.586
   97    H    ARG  14           H        ARG  14  14.010  15.765  -7.961
   98    HA   ARG  14           HA       ARG  14  14.178  18.317  -9.330
   99    HB2  ARG  14           HB2      ARG  14  15.560  17.155  -6.874
  100    HB3  ARG  14           HB3      ARG  14  15.747  18.837  -7.390
  101    HG2  ARG  14           HG2      ARG  14  13.475  19.369  -6.970
  102    HG3  ARG  14           HG3      ARG  14  12.966  17.680  -7.008
  103    HD2  ARG  14           HD2      ARG  14  12.843  18.457  -4.765
  104    HD3  ARG  14           HD3      ARG  14  14.093  17.212  -4.909
  105    HE   ARG  14           HE       ARG  14  15.295  19.805  -5.128
  106   HH11  ARG  14          HH11      ARG  14  13.795  17.737  -2.712
  107   HH12  ARG  14          HH12      ARG  14  14.747  18.425  -1.418
  108   HH21  ARG  14          HH21      ARG  14  16.464  20.629  -3.409
  109   HH22  ARG  14          HH22      ARG  14  16.199  20.019  -1.807
  110    H    GLU  15           H        GLU  15  16.459  15.632  -8.979
  111    HA   GLU  15           HA       GLU  15  18.617  16.859 -10.493
  112    HB2  GLU  15           HB2      GLU  15  17.805  13.969  -9.975
  113    HB3  GLU  15           HB3      GLU  15  19.272  14.417 -10.863
  114    HG2  GLU  15           HG2      GLU  15  20.064  15.693  -8.877
  115    HG3  GLU  15           HG3      GLU  15  18.661  15.127  -7.967
  116    H    THR  16           H        THR  16  15.966  14.670 -11.496
  117    HA   THR  16           HA       THR  16  16.646  14.575 -14.267
  118    HB   THR  16           HB       THR  16  13.925  14.218 -12.946
  119    HG1  THR  16           HG1      THR  16  15.341  12.829 -12.053
  120   HG21  THR  16          HG21      THR  16  13.442  12.678 -14.769
  121   HG22  THR  16          HG22      THR  16  13.766  14.289 -15.444
  122   HG23  THR  16          HG23      THR  16  15.012  13.012 -15.520
  123    H    ALA  17           H        ALA  17  14.599  16.835 -12.448
  124    HA   ALA  17           HA       ALA  17  13.798  18.453 -14.666
  125    HB1  ALA  17           HB1      ALA  17  13.248  20.085 -12.865
  126    HB2  ALA  17           HB2      ALA  17  12.645  18.444 -12.517
  127    HB3  ALA  17           HB3      ALA  17  14.094  19.060 -11.695
  128    H    ALA  18           H        ALA  18  16.631  18.785 -12.424
  129    HA   ALA  18           HA       ALA  18  17.674  21.146 -13.647
  130    HB1  ALA  18           HB1      ALA  18  19.785  20.483 -12.575
  131    HB2  ALA  18           HB2      ALA  18  18.419  20.266 -11.464
  132    HB3  ALA  18           HB3      ALA  18  19.146  18.856 -12.265
  133    H    ARG  19           H        ARG  19  18.232  17.676 -14.413
  134    HA   ARG  19           HA       ARG  19  19.958  18.132 -16.653
  135    HB2  ARG  19           HB2      ARG  19  19.679  15.960 -15.452
  136    HB3  ARG  19           HB3      ARG  19  18.073  15.787 -16.145
  137    HG2  ARG  19           HG2      ARG  19  19.777  14.445 -17.338
  138    HG3  ARG  19           HG3      ARG  19  18.979  15.608 -18.391
  139    HD2  ARG  19           HD2      ARG  19  21.391  15.432 -18.842
  140    HD3  ARG  19           HD3      ARG  19  20.890  17.065 -18.399
  141    HE   ARG  19           HE       ARG  19  21.900  15.391 -16.185
  142   HH11  ARG  19          HH11      ARG  19  22.874  17.721 -18.612
  143   HH12  ARG  19          HH12      ARG  19  24.257  18.231 -17.689
  144   HH21  ARG  19          HH21      ARG  19  23.685  16.094 -15.071
  145   HH22  ARG  19          HH22      ARG  19  24.706  17.320 -15.754
  146    H    PHE  20           H        PHE  20  16.366  17.776 -16.581
  147    HA   PHE  20           HA       PHE  20  15.977  18.208 -19.366
  148    HB2  PHE  20           HB2      PHE  20  14.164  17.457 -17.855
  149    HB3  PHE  20           HB3      PHE  20  14.198  19.006 -17.032
  150    HD1  PHE  20           HD1      PHE  20  14.003  17.761 -20.614
  151    HD2  PHE  20           HD2      PHE  20  12.538  20.539 -17.648
  152    HE1  PHE  20           HE1      PHE  20  12.384  18.672 -22.250
  153    HE2  PHE  20           HE2      PHE  20  10.945  21.466 -19.311
  154    HZ   PHE  20           HZ       PHE  20  10.864  20.533 -21.615
  155    H    THR  21           H        THR  21  16.247  20.620 -16.728
  156    HA   THR  21           HA       THR  21  15.834  22.934 -18.340
  157    HB   THR  21           HB       THR  21  17.566  22.710 -15.845
  158    HG1  THR  21           HG1      THR  21  15.507  21.954 -15.443
  159   HG21  THR  21          HG21      THR  21  16.779  25.085 -15.492
  160   HG22  THR  21          HG22      THR  21  17.883  24.888 -16.855
  161   HG23  THR  21          HG23      THR  21  16.135  25.076 -17.143
  162    H    ALA  22           H        ALA  22  18.935  21.217 -17.565
  163    HA   ALA  22           HA       ALA  22  20.548  22.879 -19.242
  164    HB1  ALA  22           HB1      ALA  22  21.438  21.377 -17.491
  165    HB2  ALA  22           HB2      ALA  22  20.914  19.959 -18.426
  166    HB3  ALA  22           HB3      ALA  22  22.177  21.031 -19.067
  167    H    ALA  23           H        ALA  23  18.746  19.888 -20.022
  168    HA   ALA  23           HA       ALA  23  19.614  19.656 -22.733
  169    HB1  ALA  23           HB1      ALA  23  16.993  18.745 -21.480
  170    HB2  ALA  23           HB2      ALA  23  17.744  18.116 -22.956
  171    HB3  ALA  23           HB3      ALA  23  18.536  17.861 -21.395
  172    H    LEU  24           H        LEU  24  16.917  21.501 -21.305
  173    HA   LEU  24           HA       LEU  24  15.875  22.505 -23.793
  174    HB2  LEU  24           HB2      LEU  24  14.648  22.310 -21.625
  175    HB3  LEU  24           HB3      LEU  24  15.684  23.548 -20.943
  176    HG   LEU  24           HG       LEU  24  14.779  25.165 -22.695
  177   HD11  LEU  24          HD11      LEU  24  12.807  22.873 -23.165
  178   HD12  LEU  24          HD12      LEU  24  12.655  24.523 -23.802
  179   HD13  LEU  24          HD13      LEU  24  13.983  23.487 -24.344
  180   HD21  LEU  24          HD21      LEU  24  13.893  25.086 -20.382
  181   HD22  LEU  24          HD22      LEU  24  12.609  25.447 -21.550
  182   HD23  LEU  24          HD23      LEU  24  12.759  23.811 -20.865
  183    H    GLU  25           H        GLU  25  18.382  23.722 -21.544
  184    HA   GLU  25           HA       GLU  25  18.915  26.184 -22.931
  185    HB2  GLU  25           HB2      GLU  25  19.793  25.466 -20.641
  186    HB3  GLU  25           HB3      GLU  25  20.981  24.486 -21.495
  187    HG2  GLU  25           HG2      GLU  25  21.809  26.532 -22.659
  188    HG3  GLU  25           HG3      GLU  25  20.615  27.496 -21.789
  189    H    LEU  26           H        LEU  26  20.330  22.915 -23.312
  190    HA   LEU  26           HA       LEU  26  21.993  23.306 -25.556
  191    HB2  LEU  26           HB2      LEU  26  22.192  21.234 -24.576
  192    HB3  LEU  26           HB3      LEU  26  20.492  21.091 -24.261
  193    HG   LEU  26           HG       LEU  26  20.134  20.586 -26.748
  194   HD11  LEU  26          HD11      LEU  26  22.076  19.703 -27.952
  195   HD12  LEU  26          HD12      LEU  26  22.342  21.408 -27.556
  196   HD13  LEU  26          HD13      LEU  26  23.147  20.143 -26.603
  197   HD21  LEU  26          HD21      LEU  26  19.975  18.897 -25.027
  198   HD22  LEU  26          HD22      LEU  26  20.811  18.238 -26.440
  199   HD23  LEU  26          HD23      LEU  26  21.744  18.701 -24.998
  200    H    ALA  27           H        ALA  27  18.482  22.670 -25.522
  201    HA   ALA  27           HA       ALA  27  18.125  22.819 -28.350
  202    HB1  ALA  27           HB1      ALA  27  16.156  23.398 -26.091
  203    HB2  ALA  27           HB2      ALA  27  15.739  23.097 -27.786
  204    HB3  ALA  27           HB3      ALA  27  16.488  21.814 -26.812
  205    H    ILE  28           H        ILE  28  17.938  25.460 -25.894
  206    HA   ILE  28           HA       ILE  28  17.237  27.550 -27.766
  207    HB   ILE  28           HB       ILE  28  18.696  27.670 -25.097
  208   HG12  ILE  28          HG12      ILE  28  15.820  28.457 -25.716
  209   HG13  ILE  28          HG13      ILE  28  16.244  26.826 -25.213
  210   HG21  ILE  28          HG21      ILE  28  19.221  29.715 -26.370
  211   HG22  ILE  28          HG22      ILE  28  17.502  29.942 -26.760
  212   HG23  ILE  28          HG23      ILE  28  18.085  30.101 -25.091
  213   HD11  ILE  28          HD11      ILE  28  17.254  27.750 -23.123
  214   HD12  ILE  28          HD12      ILE  28  16.586  29.340 -23.572
  215   HD13  ILE  28          HD13      ILE  28  15.504  27.957 -23.299
  216    H    ASP  29           H        ASP  29  20.400  26.380 -26.583
  217    HA   ASP  29           HA       ASP  29  22.056  28.152 -28.023
  218    HB2  ASP  29           HB2      ASP  29  22.665  26.560 -26.125
  219    HB3  ASP  29           HB3      ASP  29  22.687  25.266 -27.333
  220    H    ARG  30           H        ARG  30  20.159  25.545 -29.299
  221    HA   ARG  30           HA       ARG  30  21.673  25.705 -31.874
  222    HB2  ARG  30           HB2      ARG  30  21.706  23.489 -30.881
  223    HB3  ARG  30           HB3      ARG  30  19.935  23.446 -30.790
  224    HG2  ARG  30           HG2      ARG  30  19.707  23.421 -33.150
  225    HG3  ARG  30           HG3      ARG  30  21.390  23.928 -33.411
  226    HD2  ARG  30           HD2      ARG  30  22.191  21.746 -32.699
  227    HD3  ARG  30           HD3      ARG  30  20.515  21.208 -32.424
  228    HE   ARG  30           HE       ARG  30  20.508  22.218 -35.020
  229   HH11  ARG  30          HH11      ARG  30  22.514  19.700 -33.550
  230   HH12  ARG  30          HH12      ARG  30  22.500  18.788 -35.071
  231   HH21  ARG  30          HH21      ARG  30  20.697  20.903 -36.884
  232   HH22  ARG  30          HH22      ARG  30  21.606  19.393 -36.719
  233    H    ALA  31           H        ALA  31  18.425  26.248 -30.538
  234    HA   ALA  31           HA       ALA  31  17.135  26.695 -33.062
  235    HB1  ALA  31           HB1      ALA  31  16.685  28.082 -30.372
  236    HB2  ALA  31           HB2      ALA  31  15.541  28.020 -31.732
  237    HB3  ALA  31           HB3      ALA  31  15.963  26.538 -30.861
  238    H    THR  32           H        THR  32  19.406  28.736 -31.275
  239    HA   THR  32           HA       THR  32  19.040  31.093 -32.899
  240    HB   THR  32           HB       THR  32  20.099  30.954 -30.614
  241    HG1  THR  32           HG1      THR  32  21.468  32.648 -31.077
  242   HG21  THR  32          HG21      THR  32  21.728  29.113 -31.128
  243   HG22  THR  32          HG22      THR  32  22.625  30.234 -32.172
  244   HG23  THR  32          HG23      THR  32  22.480  30.554 -30.429
  245    H    LEU  33           H        LEU  33  20.616  28.082 -33.649
  246    HA   LEU  33           HA       LEU  33  22.203  29.375 -35.765
  247    HB2  LEU  33           HB2      LEU  33  23.982  27.997 -35.344
  248    HB3  LEU  33           HB3      LEU  33  23.327  28.353 -33.755
  249    HG   LEU  33           HG       LEU  33  22.133  26.062 -33.945
  250   HD11  LEU  33          HD11      LEU  33  24.355  25.650 -35.987
  251   HD12  LEU  33          HD12      LEU  33  23.463  24.347 -35.174
  252   HD13  LEU  33          HD13      LEU  33  22.616  25.424 -36.267
  253   HD21  LEU  33          HD21      LEU  33  23.993  26.613 -32.394
  254   HD22  LEU  33          HD22      LEU  33  24.078  24.949 -32.967
  255   HD23  LEU  33          HD23      LEU  33  25.158  26.184 -33.659
  256    H    SER  34           H        SER  34  19.779  26.903 -35.266
  257    HA   SER  34           HA       SER  34  20.385  25.496 -37.753
  258    HB2  SER  34           HB2      SER  34  18.031  25.168 -35.865
  259    HB3  SER  34           HB3      SER  34  18.504  24.072 -37.182
  260    HG   SER  34           HG       SER  34  20.001  24.755 -34.885
  261    H    GLY  35           H        GLY  35  18.430  28.271 -37.146
  262    HA2  GLY  35           HA2      GLY  35  17.414  29.596 -38.780
  263    HA3  GLY  35           HA3      GLY  35  17.606  28.304 -39.964
  264    H    GLN  36           H        GLN  36  16.127  26.966 -37.317
  265    HA   GLN  36           HA       GLN  36  13.361  27.863 -37.701
  266    HB2  GLN  36           HB2      GLN  36  13.644  25.933 -39.303
  267    HB3  GLN  36           HB3      GLN  36  14.243  24.954 -37.969
  268    HG2  GLN  36           HG2      GLN  36  11.853  25.485 -36.909
  269    HG3  GLN  36           HG3      GLN  36  11.424  25.841 -38.575
  270   HE21  GLN  36          HE22      GLN  36  12.399  23.393 -36.202
  271   HE22  GLN  36          HE21      GLN  36  11.930  22.026 -37.196
  272    HA   PRO  37           HA       PRO  37  13.453  27.177 -33.193
  273    HB2  PRO  37           HB2      PRO  37  10.734  26.010 -33.913
  274    HB3  PRO  37           HB3      PRO  37  11.169  26.951 -32.456
  275    HG2  PRO  37           HG2      PRO  37  10.002  28.222 -34.509
  276    HG3  PRO  37           HG3      PRO  37  11.458  28.957 -33.756
  277    HD2  PRO  37           HD2      PRO  37  11.246  27.444 -36.338
  278    HD3  PRO  37           HD3      PRO  37  12.242  28.868 -35.937
  279    H    VAL  38           H        VAL  38  13.746  25.475 -31.774
  280    HA   VAL  38           HA       VAL  38  14.183  22.725 -32.925
  281    HB   VAL  38           HB       VAL  38  15.583  24.257 -30.702
  282   HG11  VAL  38          HG11      VAL  38  16.086  21.358 -31.472
  283   HG12  VAL  38          HG12      VAL  38  17.124  22.351 -30.444
  284   HG13  VAL  38          HG13      VAL  38  15.505  21.943 -29.894
  285   HG21  VAL  38          HG21      VAL  38  16.286  24.706 -33.078
  286   HG22  VAL  38          HG22      VAL  38  17.563  23.911 -32.145
  287   HG23  VAL  38          HG23      VAL  38  16.589  22.983 -33.302
  288    H    GLY  39           H        GLY  39  13.777  20.910 -31.200
  289    HA2  GLY  39           HA2      GLY  39  11.777  21.710 -29.171
  290    HA3  GLY  39           HA3      GLY  39  11.175  20.742 -30.498
  291    H    ILE  40           H        ILE  40  10.698  19.764 -28.216
  292    HA   ILE  40           HA       ILE  40  12.564  17.473 -27.857
  293    HB   ILE  40           HB       ILE  40  11.234  18.849 -25.497
  294   HG12  ILE  40          HG12      ILE  40  14.093  19.135 -26.508
  295   HG13  ILE  40          HG13      ILE  40  12.885  20.405 -26.395
  296   HG21  ILE  40          HG21      ILE  40  12.696  17.338 -24.195
  297   HG22  ILE  40          HG22      ILE  40  11.676  16.414 -25.280
  298   HG23  ILE  40          HG23      ILE  40  13.378  16.684 -25.697
  299   HD11  ILE  40          HD11      ILE  40  12.874  20.232 -23.938
  300   HD12  ILE  40          HD12      ILE  40  14.200  19.037 -24.032
  301   HD13  ILE  40          HD13      ILE  40  14.449  20.687 -24.613
  302    H    HIS  41           H        HIS  41  11.558  15.660 -28.168
  303    HA   HIS  41           HA       HIS  41   8.623  15.503 -28.296
  304    HB2  HIS  41           HB2      HIS  41  10.142  14.613 -30.083
  305    HB3  HIS  41           HB3      HIS  41  10.758  13.425 -28.937
  306    HD1  HIS  41           HD1      HIS  41   8.933  11.464 -28.222
  307    HD2  HIS  41           HD2      HIS  41   7.732  14.245 -31.138
  308    HE1  HIS  41           HE1      HIS  41   6.758  10.579 -29.204
  309    H    PHE  42           H        PHE  42   7.459  14.058 -27.004
  310    HA   PHE  42           HA       PHE  42   8.800  12.810 -24.631
  311    HB2  PHE  42           HB2      PHE  42   6.537  14.804 -24.785
  312    HB3  PHE  42           HB3      PHE  42   6.543  13.612 -23.503
  313    HD1  PHE  42           HD1      PHE  42   8.419  16.534 -24.875
  314    HD2  PHE  42           HD2      PHE  42   8.052  13.679 -21.655
  315    HE1  PHE  42           HE1      PHE  42   9.946  17.903 -23.474
  316    HE2  PHE  42           HE2      PHE  42   9.575  15.058 -20.262
  317    HZ   PHE  42           HZ       PHE  42  10.512  17.169 -21.163
  318    H    SER  43           H        SER  43   7.893  11.061 -23.747
  319    HA   SER  43           HA       SER  43   5.426   9.807 -24.778
  320    HB2  SER  43           HB2      SER  43   7.382   9.012 -26.159
  321    HB3  SER  43           HB3      SER  43   8.086   8.335 -24.677
  322    HG   SER  43           HG       SER  43   6.798   6.827 -25.898
  323    H    ASP  44           H        ASP  44   5.371   7.542 -23.409
  324    HA   ASP  44           HA       ASP  44   4.504   8.398 -20.883
  325    HB2  ASP  44           HB2      ASP  44   3.691   6.446 -22.196
  326    HB3  ASP  44           HB3      ASP  44   5.160   5.567 -21.772
  327    H    SER  45           H        SER  45   7.655   6.987 -21.650
  328    HA   SER  45           HA       SER  45   8.587   7.520 -18.849
  329    HB2  SER  45           HB2      SER  45   9.189   5.022 -20.483
  330    HB3  SER  45           HB3      SER  45   9.872   5.416 -18.896
  331    HG   SER  45           HG       SER  45   8.089   3.990 -18.752
  332    H    ALA  46           H        ALA  46   9.052   8.560 -21.898
  333    HA   ALA  46           HA       ALA  46  11.897   9.118 -21.526
  334    HB1  ALA  46           HB1      ALA  46  11.912   6.843 -22.540
  335    HB2  ALA  46           HB2      ALA  46  10.931   7.445 -23.894
  336    HB3  ALA  46           HB3      ALA  46  12.588   8.041 -23.650
  337    H    TRP  47           H        TRP  47  12.801  10.347 -23.378
  338    HA   TRP  47           HA       TRP  47  11.057  11.929 -25.059
  339    HB2  TRP  47           HB2      TRP  47  11.960  14.097 -23.999
  340    HB3  TRP  47           HB3      TRP  47  10.698  13.248 -23.135
  341    HD1  TRP  47           HD1      TRP  47  14.428  14.068 -22.889
  342    HE1  TRP  47           HE1      TRP  47  15.190  13.794 -20.446
  343    HE3  TRP  47           HE3      TRP  47  10.206  11.900 -20.954
  344    HZ2  TRP  47           HZ2      TRP  47  14.083  12.829 -17.969
  345    HZ3  TRP  47           HZ3      TRP  47  10.153  11.196 -18.578
  346    HH2  TRP  47           HH2      TRP  47  12.058  11.699 -17.066
  347    H    ARG  48           H        ARG  48  12.384  13.387 -26.430
  348    HA   ARG  48           HA       ARG  48  15.306  13.155 -26.399
  349    HB2  ARG  48           HB2      ARG  48  14.444  11.038 -27.645
  350    HB3  ARG  48           HB3      ARG  48  13.850  12.143 -28.889
  351    HG2  ARG  48           HG2      ARG  48  16.295  13.018 -29.028
  352    HG3  ARG  48           HG3      ARG  48  16.727  11.648 -28.017
  353    HD2  ARG  48           HD2      ARG  48  15.337  11.475 -30.712
  354    HD3  ARG  48           HD3      ARG  48  17.079  11.375 -30.499
  355    HE   ARG  48           HE       ARG  48  15.113   9.290 -29.983
  356   HH11  ARG  48          HH21      ARG  48  18.418  10.224 -29.006
  357   HH12  ARG  48          HH22      ARG  48  18.803   8.521 -28.761
  358   HH21  ARG  48          HH11      ARG  48  15.878   7.200 -29.643
  359   HH22  ARG  48          HH12      ARG  48  17.561   7.008 -29.147
  360    H    ILE  49           H        ILE  49  16.297  14.750 -27.526
  361    HA   ILE  49           HA       ILE  49  14.849  17.117 -28.322
  362    HB   ILE  49           HB       ILE  49  17.720  16.365 -28.991
  363   HG12  ILE  49          HG12      ILE  49  17.515  16.014 -26.614
  364   HG13  ILE  49          HG13      ILE  49  18.479  17.434 -26.969
  365   HG21  ILE  49          HG21      ILE  49  17.019  18.367 -30.174
  366   HG22  ILE  49          HG22      ILE  49  16.253  19.035 -28.720
  367   HG23  ILE  49          HG23      ILE  49  18.014  18.894 -28.815
  368   HD11  ILE  49          HD11      ILE  49  17.025  17.824 -25.053
  369   HD12  ILE  49          HD12      ILE  49  16.559  18.905 -26.371
  370   HD13  ILE  49          HD13      ILE  49  15.591  17.449 -26.010
  371    H    MET  50           H        MET  50  14.455  17.950 -30.396
  372    HA   MET  50           HA       MET  50  15.046  16.295 -32.802
  373    HB2  MET  50           HB2      MET  50  12.330  17.389 -31.983
  374    HB3  MET  50           HB3      MET  50  12.731  16.996 -33.657
  375    HG2  MET  50           HG2      MET  50  13.216  14.684 -33.043
  376    HG3  MET  50           HG3      MET  50  12.852  15.030 -31.354
  377    HE1  MET  50           HE1      MET  50  10.915  15.897 -34.819
  378    HE2  MET  50           HE2      MET  50  11.503  14.220 -34.917
  379    HE3  MET  50           HE3      MET  50   9.759  14.555 -34.795
  380    H    VAL  51           H        VAL  51  15.171  17.463 -34.726
  381    HA   VAL  51           HA       VAL  51  15.492  20.429 -34.556
  382    HB   VAL  51           HB       VAL  51  17.757  20.122 -35.686
  383   HG11  VAL  51          HG11      VAL  51  17.491  19.122 -32.833
  384   HG12  VAL  51          HG12      VAL  51  18.965  19.743 -33.598
  385   HG13  VAL  51          HG13      VAL  51  17.573  20.809 -33.362
  386   HG21  VAL  51          HG21      VAL  51  18.987  18.065 -35.400
  387   HG22  VAL  51          HG22      VAL  51  17.570  17.258 -34.697
  388   HG23  VAL  51          HG23      VAL  51  17.556  17.781 -36.390
  389    HA   PRO  52           HA       PRO  52  13.862  20.568 -38.627
  390    HB2  PRO  52           HB2      PRO  52  15.589  22.273 -40.036
  391    HB3  PRO  52           HB3      PRO  52  14.287  22.769 -38.926
  392    HG2  PRO  52           HG2      PRO  52  17.230  22.397 -38.332
  393    HG3  PRO  52           HG3      PRO  52  16.181  23.775 -37.869
  394    HD2  PRO  52           HD2      PRO  52  16.705  21.897 -36.075
  395    HD3  PRO  52           HD3      PRO  52  15.017  22.438 -36.256
  396    H    GLY  53           H        GLY  53  17.037  19.289 -38.382
  397    HA2  GLY  53           HA2      GLY  53  18.414  18.043 -39.756
  398    HA3  GLY  53           HA3      GLY  53  16.919  17.141 -39.943
  399    H    LYS  54           H        LYS  54  15.773  17.196 -41.854
  400    HA   LYS  54           HA       LYS  54  17.465  17.498 -44.182
  401    HB2  LYS  54           HB2      LYS  54  14.530  16.757 -43.854
  402    HB3  LYS  54           HB3      LYS  54  15.361  16.735 -45.400
  403    HG2  LYS  54           HG2      LYS  54  15.931  14.995 -42.969
  404    HG3  LYS  54           HG3      LYS  54  15.257  14.498 -44.515
  405    HD2  LYS  54           HD2      LYS  54  18.121  15.330 -43.920
  406    HD3  LYS  54           HD3      LYS  54  17.524  13.753 -44.436
  407    HE2  LYS  54           HE2      LYS  54  16.807  14.778 -46.621
  408    HE3  LYS  54           HE3      LYS  54  17.516  16.313 -46.105
  409    HZ1  LYS  54           HZ1      LYS  54  19.068  15.042 -47.477
  410    HZ2  LYS  54           HZ2      LYS  54  19.685  15.184 -45.977
  411    HZ3  LYS  54           HZ3      LYS  54  19.025  13.773 -46.461
  412    H    THR  55           H        THR  55  15.013  19.630 -42.833
  413    HA   THR  55           HA       THR  55  16.104  21.728 -44.350
  414    HB   THR  55           HB       THR  55  15.065  21.211 -46.305
  415    HG1  THR  55           HG1      THR  55  13.850  22.936 -46.646
  416   HG21  THR  55          HG21      THR  55  12.371  20.875 -44.946
  417   HG22  THR  55          HG22      THR  55  12.739  20.726 -46.683
  418   HG23  THR  55          HG23      THR  55  13.392  19.545 -45.561
  419    HA   PRO  56           HA       PRO  56  13.827  23.837 -41.010
  420    HB2  PRO  56           HB2      PRO  56  15.261  26.165 -41.029
  421    HB3  PRO  56           HB3      PRO  56  15.913  24.662 -40.320
  422    HG2  PRO  56           HG2      PRO  56  16.441  25.821 -43.065
  423    HG3  PRO  56           HG3      PRO  56  17.626  25.176 -41.887
  424    HD2  PRO  56           HD2      PRO  56  16.642  23.710 -43.983
  425    HD3  PRO  56           HD3      PRO  56  17.091  22.954 -42.427
  426    H    SER  57           H        SER  57  14.317  24.692 -44.365
  427    HA   SER  57           HA       SER  57  12.712  27.125 -44.393
  428    HB2  SER  57           HB2      SER  57  14.619  26.605 -45.945
  429    HB3  SER  57           HB3      SER  57  13.610  25.359 -46.704
  430    HG   SER  57           HG       SER  57  13.529  27.397 -47.789
  431    H    ALA  58           H        ALA  58  12.103  23.688 -44.949
  432    HA   ALA  58           HA       ALA  58   9.228  24.265 -45.556
  433    HB1  ALA  58           HB1      ALA  58   9.337  22.491 -47.211
  434    HB2  ALA  58           HB2      ALA  58  10.608  23.686 -47.537
  435    HB3  ALA  58           HB3      ALA  58  11.017  22.141 -46.758
  436    H    TRP  59           H        TRP  59  10.748  23.304 -43.035
  437    HA   TRP  59           HA       TRP  59  10.235  22.142 -41.160
  438    HB2  TRP  59           HB2      TRP  59   8.268  23.482 -41.454
  439    HB3  TRP  59           HB3      TRP  59   7.518  22.273 -42.470
  440    HD1  TRP  59           HD1      TRP  59   6.495  20.164 -41.364
  441    HE1  TRP  59           HE1      TRP  59   5.411  19.808 -39.054
  442    HE3  TRP  59           HE3      TRP  59   8.709  24.026 -38.847
  443    HZ2  TRP  59           HZ2      TRP  59   5.411  21.125 -36.490
  444    HZ3  TRP  59           HZ3      TRP  59   8.148  24.455 -36.464
  445    HH2  TRP  59           HH2      TRP  59   6.494  23.026 -35.281
  446    H    ARG  60           H        ARG  60  11.701  20.449 -41.860
  447    HA   ARG  60           HA       ARG  60  10.283  17.820 -42.093
  448    HB2  ARG  60           HB2      ARG  60  11.387  18.814 -44.253
  449    HB3  ARG  60           HB3      ARG  60  12.899  18.356 -43.503
  450    HG2  ARG  60           HG2      ARG  60  12.317  16.517 -44.886
  451    HG3  ARG  60           HG3      ARG  60  11.882  15.984 -43.265
  452    HD2  ARG  60           HD2      ARG  60  10.100  15.330 -44.687
  453    HD3  ARG  60           HD3      ARG  60   9.473  16.704 -43.791
  454    HE   ARG  60           HE       ARG  60  10.270  16.601 -46.664
  455   HH11  ARG  60          HH11      ARG  60   8.833  18.616 -44.140
  456   HH12  ARG  60          HH12      ARG  60   8.451  19.859 -45.264
  457   HH21  ARG  60          HH21      ARG  60   9.570  18.186 -48.040
  458   HH22  ARG  60          HH22      ARG  60   8.666  19.533 -47.419
  459    H    TRP  61           H        TRP  61  10.579  18.353 -39.744
  460    HA   TRP  61           HA       TRP  61  12.800  18.187 -38.189
  461    HB2  TRP  61           HB2      TRP  61  10.137  16.780 -37.774
  462    HB3  TRP  61           HB3      TRP  61  11.365  16.984 -36.542
  463    HD1  TRP  61           HD1      TRP  61   8.488  18.774 -38.095
  464    HE1  TRP  61           HE1      TRP  61   8.091  20.993 -36.850
  465    HE3  TRP  61           HE3      TRP  61  12.765  18.928 -35.316
  466    HZ2  TRP  61           HZ2      TRP  61   9.327  22.479 -34.714
  467    HZ3  TRP  61           HZ3      TRP  61  13.130  20.763 -33.673
  468    HH2  TRP  61           HH2      TRP  61  11.411  22.511 -33.341
  469    H    VAL  62           H        VAL  62  14.068  16.702 -37.165
  470    HA   VAL  62           HA       VAL  62  13.684  13.788 -37.576
  471    HB   VAL  62           HB       VAL  62  16.054  13.402 -37.989
  472   HG11  VAL  62          HG11      VAL  62  16.290  14.188 -40.253
  473   HG12  VAL  62          HG12      VAL  62  14.600  13.747 -39.963
  474   HG13  VAL  62          HG13      VAL  62  15.078  15.459 -39.999
  475   HG21  VAL  62          HG21      VAL  62  17.131  15.230 -36.843
  476   HG22  VAL  62          HG22      VAL  62  17.610  15.270 -38.537
  477   HG23  VAL  62          HG23      VAL  62  16.386  16.415 -37.930
  478    HA   PRO  63           HA       PRO  63  14.949  13.714 -33.206
  479    HB2  PRO  63           HB2      PRO  63  16.155  11.261 -33.010
  480    HB3  PRO  63           HB3      PRO  63  14.380  11.490 -33.091
  481    HG2  PRO  63           HG2      PRO  63  16.280  10.781 -35.341
  482    HG3  PRO  63           HG3      PRO  63  14.704  10.027 -34.938
  483    HD2  PRO  63           HD2      PRO  63  14.929  11.897 -36.884
  484    HD3  PRO  63           HD3      PRO  63  13.501  11.859 -35.815
  485    H    LEU  64           H        LEU  64  16.663  14.700 -32.270
  486    HA   LEU  64           HA       LEU  64  19.075  15.153 -33.850
  487    HB2  LEU  64           HB2      LEU  64  18.197  16.962 -32.460
  488    HB3  LEU  64           HB3      LEU  64  18.284  15.943 -31.031
  489    HG   LEU  64           HG       LEU  64  20.754  15.902 -31.150
  490   HD11  LEU  64          HD11      LEU  64  21.960  17.381 -32.693
  491   HD12  LEU  64          HD12      LEU  64  21.081  16.152 -33.593
  492   HD13  LEU  64          HD13      LEU  64  20.431  17.798 -33.505
  493   HD21  LEU  64          HD21      LEU  64  21.177  18.278 -30.627
  494   HD22  LEU  64          HD22      LEU  64  19.567  18.698 -31.254
  495   HD23  LEU  64          HD23      LEU  64  19.740  17.647 -29.826
  496    H    GLN  65           H        GLN  65  20.485  13.434 -34.008
  497    HA   GLN  65           HA       GLN  65  21.673  12.468 -31.437
  498    HB2  GLN  65           HB2      GLN  65  20.793  10.785 -33.803
  499    HB3  GLN  65           HB3      GLN  65  21.991  10.227 -32.629
  500    HG2  GLN  65           HG2      GLN  65  20.460  10.177 -30.843
  501    HG3  GLN  65           HG3      GLN  65  19.247  11.110 -31.731
  502   HE21  GLN  65          HE22      GLN  65  20.980   7.927 -32.081
  503   HE22  GLN  65          HE21      GLN  65  19.535   7.139 -32.705
  504    H    GLU  66           H        GLU  66  22.257  14.227 -34.113
  505    HA   GLU  66           HA       GLU  66  24.348  13.217 -35.563
  506    HB2  GLU  66           HB2      GLU  66  23.933  16.123 -34.757
  507    HB3  GLU  66           HB3      GLU  66  24.908  15.560 -36.117
  508    HG2  GLU  66           HG2      GLU  66  22.858  14.537 -37.127
  509    HG3  GLU  66           HG3      GLU  66  21.894  15.237 -35.822
  510    H    ASP  67           H        ASP  67  24.710  14.743 -32.408
  511    HA   ASP  67           HA       ASP  67  27.546  13.859 -32.341
  512    HB2  ASP  67           HB2      ASP  67  27.366  16.317 -32.926
  513    HB3  ASP  67           HB3      ASP  67  26.565  16.584 -31.379
  514    H    ALA  68           H        ALA  68  25.040  12.787 -31.293
  515    HA   ALA  68           HA       ALA  68  25.853  12.485 -28.427
  516    HB1  ALA  68           HB1      ALA  68  23.492  12.450 -27.788
  517    HB2  ALA  68           HB2      ALA  68  23.862  13.973 -28.610
  518    HB3  ALA  68           HB3      ALA  68  22.993  12.691 -29.475
  519    H    ALA  69           H        ALA  69  25.135  10.973 -31.383
  520    HA   ALA  69           HA       ALA  69  24.848   8.983 -32.212
  521    HB1  ALA  69           HB1      ALA  69  26.056   7.901 -29.641
  522    HB2  ALA  69           HB2      ALA  69  25.885   7.027 -31.176
  523    HB3  ALA  69           HB3      ALA  69  26.946   8.445 -31.080
  524    H    ASP  70           H        ASP  70  23.855   8.655 -28.849
  525    HA   ASP  70           HA       ASP  70  21.025   8.375 -29.579
  526    HB2  ASP  70           HB2      ASP  70  21.794   6.031 -29.629
  527    HB3  ASP  70           HB3      ASP  70  22.412   6.195 -27.980
  528    H    GLU  71           H        GLU  71  23.451   9.405 -27.330
  529    HA   GLU  71           HA       GLU  71  22.002   9.250 -24.875
  530    HB2  GLU  71           HB2      GLU  71  24.362  10.990 -25.709
  531    HB3  GLU  71           HB3      GLU  71  23.795  10.762 -24.050
  532    HG2  GLU  71           HG2      GLU  71  24.199   8.301 -24.274
  533    HG3  GLU  71           HG3      GLU  71  24.900   8.581 -25.868
  534    H    SER  72           H        SER  72  21.176  11.117 -27.439
  535    HA   SER  72           HA       SER  72  20.330  13.599 -26.204
  536    HB2  SER  72           HB2      SER  72  19.114  13.878 -28.304
  537    HB3  SER  72           HB3      SER  72  20.766  13.330 -28.632
  538    HG   SER  72           HG       SER  72  19.267  12.285 -29.844
  539    H    GLN  73           H        GLN  73  19.081  10.334 -26.110
  540    HA   GLN  73           HA       GLN  73  16.368  11.257 -25.489
  541    HB2  GLN  73           HB2      GLN  73  15.648   9.043 -25.419
  542    HB3  GLN  73           HB3      GLN  73  16.658   9.224 -26.823
  543    HG2  GLN  73           HG2      GLN  73  18.479   7.984 -25.761
  544    HG3  GLN  73           HG3      GLN  73  17.626   7.960 -24.218
  545   HE21  GLN  73          HE22      GLN  73  18.363   5.908 -26.747
  546   HE22  GLN  73          HE21      GLN  73  16.917   4.910 -26.638
  547    H    ASN  74           H        ASN  74  15.401   9.758 -23.538
  548    HA   ASN  74           HA       ASN  74  16.391  10.909 -21.110
  549    HB2  ASN  74           HB2      ASN  74  14.007  10.524 -21.533
  550    HB3  ASN  74           HB3      ASN  74  14.264   8.772 -21.503
  551   HD21  ASN  74          HD22      ASN  74  12.775   8.566 -19.548
  552   HD22  ASN  74          HD21      ASN  74  13.434   9.135 -18.012
  553    H    ASP  75           H        ASP  75  15.595   7.732 -20.244
  554    HA   ASP  75           HA       ASP  75  16.637   6.276 -18.934
  555    HB2  ASP  75           HB2      ASP  75  17.749   5.698 -21.108
  556    HB3  ASP  75           HB3      ASP  75  19.135   6.667 -20.612
  557    H    TRP  76           H        TRP  76  16.876   9.306 -18.420
  558    HA   TRP  76           HA       TRP  76  19.215   9.663 -16.731
  559    HB2  TRP  76           HB2      TRP  76  16.634  11.270 -16.796
  560    HB3  TRP  76           HB3      TRP  76  18.183  11.790 -16.172
  561    HD1  TRP  76           HD1      TRP  76  19.435  10.503 -19.183
  562    HE1  TRP  76           HE1      TRP  76  19.209  12.009 -21.233
  563    HE3  TRP  76           HE3      TRP  76  16.168  13.962 -17.297
  564    HZ2  TRP  76           HZ2      TRP  76  17.989  14.538 -21.897
  565    HZ3  TRP  76           HZ3      TRP  76  15.503  15.911 -18.656
  566    HH2  TRP  76           HH2      TRP  76  16.414  16.233 -20.952
  567    H    ASP  77           H        ASP  77  16.176   8.141 -16.223
  568    HA   ASP  77           HA       ASP  77  16.395   8.263 -13.247
  569    HB2  ASP  77           HB2      ASP  77  14.130   8.933 -13.050
  570    HB3  ASP  77           HB3      ASP  77  14.862  10.048 -14.191
  571    H    GLU  78           H        GLU  78  15.006   6.919 -12.125
  572    HA   GLU  78           HA       GLU  78  14.077   4.369 -13.313
  573    HB2  GLU  78           HB2      GLU  78  15.380   3.071 -11.777
  574    HB3  GLU  78           HB3      GLU  78  16.458   4.079 -12.730
  575    HG2  GLU  78           HG2      GLU  78  15.599   4.583  -9.851
  576    HG3  GLU  78           HG3      GLU  78  17.153   3.949 -10.379
  577    H    GLU  79           H        GLU  79  14.218   6.549 -10.514
  578    HA   GLU  79           HA       GLU  79  12.025   5.205  -9.133
  579    HB2  GLU  79           HB2      GLU  79  14.148   6.492  -8.210
  580    HB3  GLU  79           HB3      GLU  79  13.148   7.924  -8.420
  581    HG2  GLU  79           HG2      GLU  79  12.971   7.198  -6.143
  582    HG3  GLU  79           HG3      GLU  79  11.428   6.857  -6.893
  583    H    LEU  80           H        LEU  80  11.829   7.094 -11.811
  584    HA   LEU  80           HA       LEU  80   9.447   8.652 -10.890
  585    HB2  LEU  80           HB2      LEU  80  11.380   9.344 -13.116
  586    HB3  LEU  80           HB3      LEU  80  10.045  10.324 -12.549
  587    HG   LEU  80           HG       LEU  80  12.617   9.755 -11.018
  588   HD11  LEU  80          HD11      LEU  80  13.072  12.051 -11.435
  589   HD12  LEU  80          HD12      LEU  80  12.724  11.283 -12.973
  590   HD13  LEU  80          HD13      LEU  80  11.488  12.308 -12.211
  591   HD21  LEU  80          HD21      LEU  80  11.737  11.399  -9.398
  592   HD22  LEU  80          HD22      LEU  80  10.183  11.444 -10.257
  593   HD23  LEU  80          HD23      LEU  80  10.719   9.963  -9.431
  594    H    SER  81           H        SER  81   7.950   9.273 -12.425
  595    HA   SER  81           HA       SER  81   7.704   7.991 -15.074
  596    HB2  SER  81           HB2      SER  81   6.349   6.623 -13.466
  597    HB3  SER  81           HB3      SER  81   5.472   8.093 -12.990
  598    HG   SER  81           HG       SER  81   4.398   6.876 -14.644
  599    H    ILE  82           H        ILE  82   6.727   9.490 -16.539
  600    HA   ILE  82           HA       ILE  82   6.451  12.271 -15.464
  601    HB   ILE  82           HB       ILE  82   8.138  11.101 -17.610
  602   HG12  ILE  82          HG12      ILE  82   9.512  13.178 -17.077
  603   HG13  ILE  82          HG13      ILE  82   8.314  13.600 -15.873
  604   HG21  ILE  82          HG21      ILE  82   6.878  13.828 -18.077
  605   HG22  ILE  82          HG22      ILE  82   8.240  13.133 -18.972
  606   HG23  ILE  82          HG23      ILE  82   6.665  12.365 -19.078
  607   HD11  ILE  82          HD11      ILE  82  10.415  12.492 -14.999
  608   HD12  ILE  82          HD12      ILE  82   8.935  11.652 -14.523
  609   HD13  ILE  82          HD13      ILE  82   9.948  11.011 -15.842
  610    H    HIS  83           H        HIS  83   5.004  13.641 -16.302
  611    HA   HIS  83           HA       HIS  83   3.094  12.770 -18.415
  612    HB2  HIS  83           HB2      HIS  83   2.292  13.989 -15.735
  613    HB3  HIS  83           HB3      HIS  83   1.207  13.552 -17.050
  614    HD1  HIS  83           HD1      HIS  83   0.707  10.870 -17.331
  615    HD2  HIS  83           HD2      HIS  83   3.145  12.037 -14.106
  616    HE1  HIS  83           HE1      HIS  83   0.862   8.850 -15.785
  617    H    LEU  84           H        LEU  84   1.998  14.649 -19.426
  618    HA   LEU  84           HA       LEU  84   2.712  17.305 -18.514
  619    HB2  LEU  84           HB2      LEU  84   3.675  18.106 -20.638
  620    HB3  LEU  84           HB3      LEU  84   4.684  17.002 -19.742
  621    HG   LEU  84           HG       LEU  84   4.276  15.197 -21.323
  622   HD11  LEU  84          HD11      LEU  84   2.021  15.564 -22.107
  623   HD12  LEU  84          HD12      LEU  84   2.439  17.179 -22.717
  624   HD13  LEU  84          HD13      LEU  84   3.097  15.720 -23.497
  625   HD21  LEU  84          HD21      LEU  84   4.949  17.852 -22.674
  626   HD22  LEU  84          HD22      LEU  84   6.077  16.822 -21.763
  627   HD23  LEU  84          HD23      LEU  84   5.374  16.241 -23.278
  628    H    GLN  85           H        GLN  85   1.825  19.043 -19.941
  629    HA   GLN  85           HA       GLN  85  -0.546  18.544 -21.548
  630    HB2  GLN  85           HB2      GLN  85  -2.051  19.829 -20.016
  631    HB3  GLN  85           HB3      GLN  85  -1.627  18.244 -19.418
  632    HG2  GLN  85           HG2      GLN  85   0.020  20.608 -18.467
  633    HG3  GLN  85           HG3      GLN  85  -1.623  20.434 -17.880
  634   HE21  GLN  85          HE22      GLN  85   1.639  19.223 -17.504
  635   HE22  GLN  85          HE21      GLN  85   1.194  18.057 -16.258
  636    HA   PRO  86           HA       PRO  86  -2.485  20.405 -22.115
  637    HB2  PRO  86           HB2      PRO  86  -1.917  22.015 -24.583
  638    HB3  PRO  86           HB3      PRO  86  -3.375  22.005 -23.548
  639    HG2  PRO  86           HG2      PRO  86  -1.605  24.054 -23.423
  640    HG3  PRO  86           HG3      PRO  86  -2.312  23.380 -21.915
  641    HD2  PRO  86           HD2      PRO  86   0.385  22.760 -23.159
  642    HD3  PRO  86           HD3      PRO  86  -0.010  23.163 -21.460
  643    H    PHE  87           H        PHE  87   0.500  20.012 -23.900
  644    HA   PHE  87           HA       PHE  87  -0.404  18.378 -26.059
  645    HB2  PHE  87           HB2      PHE  87   2.302  18.263 -24.697
  646    HB3  PHE  87           HB3      PHE  87   1.914  17.878 -26.366
  647    HD1  PHE  87           HD1      PHE  87   0.505  20.109 -27.478
  648    HD2  PHE  87           HD2      PHE  87   3.698  20.123 -24.570
  649    HE1  PHE  87           HE1      PHE  87   1.138  22.403 -28.176
  650    HE2  PHE  87           HE2      PHE  87   4.347  22.399 -25.303
  651    HZ   PHE  87           HZ       PHE  87   3.058  23.549 -27.095
  652    H    LYS  88           H        LYS  88   0.896  16.052 -26.116
  653    HA   LYS  88           HA       LYS  88   0.170  14.495 -23.716
  654    HB2  LYS  88           HB2      LYS  88  -1.183  12.927 -24.776
  655    HB3  LYS  88           HB3      LYS  88  -1.805  14.482 -25.269
  656    HG2  LYS  88           HG2      LYS  88  -0.085  12.589 -26.931
  657    HG3  LYS  88           HG3      LYS  88  -1.814  12.784 -27.069
  658    HD2  LYS  88           HD2      LYS  88   0.286  14.872 -27.777
  659    HD3  LYS  88           HD3      LYS  88  -0.628  13.900 -28.906
  660    HE2  LYS  88           HE2      LYS  88  -1.872  15.920 -26.979
  661    HE3  LYS  88           HE3      LYS  88  -1.450  16.260 -28.658
  662    HZ1  LYS  88           HZ1      LYS  88  -3.440  14.221 -27.803
  663    HZ2  LYS  88           HZ2      LYS  88  -3.785  15.665 -28.469
  664    HZ3  LYS  88           HZ3      LYS  88  -3.023  14.532 -29.351
  665    HA   PRO  89           HA       PRO  89   3.914  12.278 -24.791
  666    HB2  PRO  89           HB2      PRO  89   3.741  10.153 -23.085
  667    HB3  PRO  89           HB3      PRO  89   4.033  11.824 -22.515
  668    HG2  PRO  89           HG2      PRO  89   1.423  10.285 -22.582
  669    HG3  PRO  89           HG3      PRO  89   2.105  11.262 -21.246
  670    HD2  PRO  89           HD2      PRO  89   0.233  12.218 -23.019
  671    HD3  PRO  89           HD3      PRO  89   1.466  13.261 -22.255
  672    H    ASP  90           H        ASP  90   3.458  11.773 -26.951
  673    HA   ASP  90           HA       ASP  90   2.688   9.027 -27.588
  674    HB2  ASP  90           HB2      ASP  90   0.487  10.242 -27.402
  675    HB3  ASP  90           HB3      ASP  90   1.041  11.358 -28.656
  676    H    ASP  91           H        ASP  91   2.920   8.602 -29.933
  677    HA   ASP  91           HA       ASP  91   5.433   9.661 -30.904
  678    HB2  ASP  91           HB2      ASP  91   4.794   7.268 -30.895
  679    HB3  ASP  91           HB3      ASP  91   3.530   7.602 -32.076
  680    H    SER  92           H        SER  92   4.059  11.890 -31.004
  681    HA   SER  92           HA       SER  92   2.568  12.559 -33.329
  682    HB2  SER  92           HB2      SER  92   4.454  14.339 -31.753
  683    HB3  SER  92           HB3      SER  92   3.103  14.872 -32.762
  684    HG   SER  92           HG       SER  92   1.685  13.821 -31.313
  685    H    ASN  93           H        ASN  93   3.161  13.847 -35.183
  686    HA   ASN  93           HA       ASN  93   5.589  12.996 -36.533
  687    HB2  ASN  93           HB2      ASN  93   4.650  14.077 -38.440
  688    HB3  ASN  93           HB3      ASN  93   3.323  13.272 -37.622
  689   HD21  ASN  93          HD22      ASN  93   3.536  15.744 -39.466
  690   HD22  ASN  93          HD21      ASN  93   2.629  16.956 -38.580
  691    H    GLN  94           H        GLN  94   5.383  15.248 -34.211
  692    HA   GLN  94           HA       GLN  94   7.747  16.751 -35.075
  693    HB2  GLN  94           HB2      GLN  94   6.726  18.927 -34.579
  694    HB3  GLN  94           HB3      GLN  94   5.841  18.157 -35.879
  695    HG2  GLN  94           HG2      GLN  94   3.960  17.699 -34.480
  696    HG3  GLN  94           HG3      GLN  94   4.869  17.928 -32.991
  697   HE21  GLN  94          HE22      GLN  94   5.507  20.083 -32.310
  698   HE22  GLN  94          HE21      GLN  94   4.588  21.456 -32.926
  699    HA   PRO  95           HA       PRO  95   8.343  16.493 -30.568
  700    HB2  PRO  95           HB2      PRO  95   9.546  18.882 -29.955
  701    HB3  PRO  95           HB3      PRO  95  10.409  17.512 -30.721
  702    HG2  PRO  95           HG2      PRO  95   9.193  19.960 -32.042
  703    HG3  PRO  95           HG3      PRO  95  10.812  19.244 -32.324
  704    HD2  PRO  95           HD2      PRO  95   8.736  18.752 -33.976
  705    HD3  PRO  95           HD3      PRO  95   9.899  17.467 -33.572
  706    H    GLN  96           H        GLN  96   7.038  17.067 -28.782
  707    HA   GLN  96           HA       GLN  96   4.749  18.793 -29.300
  708    HB2  GLN  96           HB2      GLN  96   5.669  17.439 -26.723
  709    HB3  GLN  96           HB3      GLN  96   4.159  18.293 -26.966
  710    HG2  GLN  96           HG2      GLN  96   3.556  16.043 -27.212
  711    HG3  GLN  96           HG3      GLN  96   3.616  16.656 -28.860
  712   HE21  GLN  96          HE22      GLN  96   3.871  14.310 -29.558
  713   HE22  GLN  96          HE21      GLN  96   5.432  13.550 -29.327
  714    H    VAL  97           H        VAL  97   7.652  19.071 -27.188
  715    HA   VAL  97           HA       VAL  97   6.994  21.867 -26.439
  716    HB   VAL  97           HB       VAL  97   9.445  20.146 -25.868
  717   HG11  VAL  97          HG11      VAL  97   9.966  22.550 -25.632
  718   HG12  VAL  97          HG12      VAL  97   8.557  22.751 -24.567
  719   HG13  VAL  97          HG13      VAL  97   9.931  21.750 -24.062
  720   HG21  VAL  97          HG21      VAL  97   7.006  20.731 -24.139
  721   HG22  VAL  97          HG22      VAL  97   7.479  19.149 -24.798
  722   HG23  VAL  97          HG23      VAL  97   8.485  19.925 -23.577
  723    H    VAL  98           H        VAL  98   7.891  23.664 -27.394
  724    HA   VAL  98           HA       VAL  98  10.069  23.276 -29.412
  725    HB   VAL  98           HB       VAL  98   7.450  24.694 -29.960
  726   HG11  VAL  98          HG11      VAL  98   8.369  25.111 -32.232
  727   HG12  VAL  98          HG12      VAL  98   9.238  26.009 -30.995
  728   HG13  VAL  98          HG13      VAL  98   9.955  24.530 -31.687
  729   HG21  VAL  98          HG21      VAL  98   7.294  22.263 -30.273
  730   HG22  VAL  98          HG22      VAL  98   7.294  23.072 -31.837
  731   HG23  VAL  98          HG23      VAL  98   8.774  22.277 -31.256
  732    H    ILE  99           H        ILE  99  11.418  24.921 -29.740
  733    HA   ILE  99           HA       ILE  99  11.526  27.128 -27.724
  734    HB   ILE  99           HB       ILE  99  13.764  25.339 -28.807
  735   HG12  ILE  99          HG12      ILE  99  14.025  24.836 -26.254
  736   HG13  ILE  99          HG13      ILE  99  12.330  25.284 -26.140
  737   HG21  ILE  99          HG21      ILE  99  13.834  27.591 -26.756
  738   HG22  ILE  99          HG22      ILE  99  15.177  26.498 -27.171
  739   HG23  ILE  99          HG23      ILE  99  14.566  27.610 -28.371
  740   HD11  ILE  99          HD11      ILE  99  11.710  23.405 -27.573
  741   HD12  ILE  99          HD12      ILE  99  13.413  23.117 -27.997
  742   HD13  ILE  99          HD13      ILE  99  12.826  22.814 -26.350
  743    H    LEU 100           H        LEU 100  11.590  29.070 -28.694
  744    HA   LEU 100           HA       LEU 100  12.360  29.389 -31.520
  745    HB2  LEU 100           HB2      LEU 100  11.785  31.605 -29.528
  746    HB3  LEU 100           HB3      LEU 100  11.793  31.696 -31.280
  747    HG   LEU 100           HG       LEU 100   9.688  30.557 -29.451
  748   HD11  LEU 100          HD11      LEU 100   9.672  32.969 -30.170
  749   HD12  LEU 100          HD12      LEU 100   9.540  32.434 -31.849
  750   HD13  LEU 100          HD13      LEU 100   8.241  32.065 -30.693
  751   HD21  LEU 100          HD21      LEU 100   9.855  30.100 -32.469
  752   HD22  LEU 100          HD22      LEU 100   9.922  28.828 -31.227
  753   HD23  LEU 100          HD23      LEU 100   8.440  29.755 -31.453
  754    H    ALA 101           H        ALA 101  13.895  31.012 -32.140
  755    HA   ALA 101           HA       ALA 101  16.538  30.522 -31.200
  756    HB1  ALA 101           HB1      ALA 101  17.139  32.322 -32.804
  757    HB2  ALA 101           HB2      ALA 101  15.963  31.194 -33.508
  758    HB3  ALA 101           HB3      ALA 101  15.435  32.788 -32.925
  759    H    ASP 102           H        ASP 102  14.239  32.973 -30.247
  760    HA   ASP 102           HA       ASP 102  16.150  34.717 -28.880
  761    HB2  ASP 102           HB2      ASP 102  14.201  35.532 -30.154
  762    HB3  ASP 102           HB3      ASP 102  13.116  34.633 -29.096
  763    H    GLY 103           H        GLY 103  14.716  31.767 -27.976
  764    HA2  GLY 103           HA2      GLY 103  14.904  30.726 -25.895
  765    HA3  GLY 103           HA3      GLY 103  15.121  32.276 -25.082
  766    H    GLN 104           H        GLN 104  12.403  32.393 -27.184
  767    HA   GLN 104           HA       GLN 104  10.433  32.165 -25.040
  768    HB2  GLN 104           HB2      GLN 104  10.190  32.431 -28.051
  769    HB3  GLN 104           HB3      GLN 104   8.828  32.494 -26.924
  770    HG2  GLN 104           HG2      GLN 104   9.664  34.533 -25.920
  771    HG3  GLN 104           HG3      GLN 104  11.208  34.375 -26.770
  772   HE21  GLN 104          HE22      GLN 104  11.431  35.855 -28.252
  773   HE22  GLN 104          HE21      GLN 104  10.181  36.345 -29.411
  774    H    ILE 105           H        ILE 105   9.087  30.446 -24.739
  775    HA   ILE 105           HA       ILE 105   9.680  27.885 -26.175
  776    HB   ILE 105           HB       ILE 105   9.188  27.960 -23.201
  777   HG12  ILE 105          HG12      ILE 105  11.163  29.369 -23.413
  778   HG13  ILE 105          HG13      ILE 105  11.492  27.858 -22.600
  779   HG21  ILE 105          HG21      ILE 105   8.966  25.786 -24.214
  780   HG22  ILE 105          HG22      ILE 105  10.482  25.991 -25.112
  781   HG23  ILE 105          HG23      ILE 105  10.500  25.792 -23.344
  782   HD11  ILE 105          HD11      ILE 105  12.652  26.987 -24.546
  783   HD12  ILE 105          HD12      ILE 105  12.175  28.417 -25.497
  784   HD13  ILE 105          HD13      ILE 105  13.289  28.589 -24.138
  785    H    THR 106           H        THR 106   7.927  26.381 -26.247
  786    HA   THR 106           HA       THR 106   5.270  27.243 -26.384
  787    HB   THR 106           HB       THR 106   4.817  24.716 -25.893
  788    HG1  THR 106           HG1      THR 106   6.853  24.386 -24.903
  789   HG21  THR 106          HG21      THR 106   5.691  24.102 -28.139
  790   HG22  THR 106          HG22      THR 106   4.775  25.621 -28.139
  791   HG23  THR 106          HG23      THR 106   6.549  25.667 -28.187
  792    HA   PRO 107           HA       PRO 107   4.533  27.737 -21.947
  793    HB2  PRO 107           HB2      PRO 107   2.041  28.834 -21.979
  794    HB3  PRO 107           HB3      PRO 107   3.525  29.718 -22.425
  795    HG2  PRO 107           HG2      PRO 107   1.527  28.403 -24.270
  796    HG3  PRO 107           HG3      PRO 107   2.282  30.028 -24.402
  797    HD2  PRO 107           HD2      PRO 107   3.186  27.827 -25.780
  798    HD3  PRO 107           HD3      PRO 107   4.269  29.144 -25.238
  799    H    PHE 108           H        PHE 108   4.676  25.469 -21.693
  800    HA   PHE 108           HA       PHE 108   2.091  24.013 -21.350
  801    HB2  PHE 108           HB2      PHE 108   2.951  22.178 -22.354
  802    HB3  PHE 108           HB3      PHE 108   3.854  23.378 -23.227
  803    HD1  PHE 108           HD2      PHE 108   6.297  23.898 -22.381
  804    HD2  PHE 108           HD1      PHE 108   4.031  20.451 -21.134
  805    HE1  PHE 108           HE2      PHE 108   8.393  22.758 -21.726
  806    HE2  PHE 108           HE1      PHE 108   6.129  19.287 -20.560
  807    HZ   PHE 108           HZ       PHE 108   8.318  20.446 -20.803
  808    H    SER 109           H        SER 109   2.575  21.950 -19.867
  809    HA   SER 109           HA       SER 109   4.478  22.600 -17.729
  810    HB2  SER 109           HB2      SER 109   1.592  21.942 -17.028
  811    HB3  SER 109           HB3      SER 109   2.918  22.268 -15.897
  812    HG   SER 109           HG       SER 109   2.870  24.299 -17.561
  813    H    LEU 110           H        LEU 110   5.256  20.922 -16.656
  814    HA   LEU 110           HA       LEU 110   4.729  18.125 -17.586
  815    HB2  LEU 110           HB2      LEU 110   6.720  18.511 -18.620
  816    HB3  LEU 110           HB3      LEU 110   7.098  19.902 -17.628
  817    HG   LEU 110           HG       LEU 110   7.893  18.342 -15.818
  818   HD11  LEU 110          HD11      LEU 110   7.860  16.303 -18.114
  819   HD12  LEU 110          HD12      LEU 110   8.583  16.066 -16.510
  820   HD13  LEU 110          HD13      LEU 110   6.833  16.183 -16.687
  821   HD21  LEU 110          HD21      LEU 110  10.045  17.971 -16.943
  822   HD22  LEU 110          HD22      LEU 110   9.284  18.224 -18.528
  823   HD23  LEU 110          HD23      LEU 110   9.385  19.558 -17.367
  824    H    LEU 111           H        LEU 111   4.840  16.511 -15.980
  825    HA   LEU 111           HA       LEU 111   5.280  17.338 -13.156
  826    HB2  LEU 111           HB2      LEU 111   2.918  17.524 -13.684
  827    HB3  LEU 111           HB3      LEU 111   2.863  15.891 -14.333
  828    HG   LEU 111           HG       LEU 111   3.831  16.240 -11.511
  829   HD11  LEU 111          HD11      LEU 111   0.898  16.425 -12.292
  830   HD12  LEU 111          HD12      LEU 111   1.529  16.275 -10.634
  831   HD13  LEU 111          HD13      LEU 111   1.895  17.721 -11.588
  832   HD21  LEU 111          HD21      LEU 111   2.619  14.138 -11.134
  833   HD22  LEU 111          HD22      LEU 111   1.914  14.214 -12.761
  834   HD23  LEU 111          HD23      LEU 111   3.650  13.942 -12.550
  835    H    MET 112           H        MET 112   6.032  15.769 -11.798
  836    HA   MET 112           HA       MET 112   6.928  13.183 -13.019
  837    HB2  MET 112           HB2      MET 112   8.413  14.915 -10.998
  838    HB3  MET 112           HB3      MET 112   8.943  13.355 -11.642
  839    HG2  MET 112           HG2      MET 112   8.944  14.358 -13.936
  840    HG3  MET 112           HG3      MET 112   8.567  15.928 -13.224
  841    HE1  MET 112           HE1      MET 112  10.972  15.401 -15.216
  842    HE2  MET 112           HE2      MET 112  10.612  16.992 -14.502
  843    HE3  MET 112           HE3      MET 112  12.263  16.339 -14.435
  844    H    ALA 113           H        ALA 113   6.377  11.425 -11.961
  845    HA   ALA 113           HA       ALA 113   5.269  11.549  -9.191
  846    HB1  ALA 113           HB1      ALA 113   3.484  11.396 -10.852
  847    HB2  ALA 113           HB2      ALA 113   4.275   9.986 -11.597
  848    HB3  ALA 113           HB3      ALA 113   3.632   9.878  -9.945
  849    H    ASN 114           H        ASN 114   5.792   9.853  -7.819
  850    HA   ASN 114           HA       ASN 114   8.113   8.280  -8.106
  851    HB2  ASN 114           HB2      ASN 114   7.068   8.748  -5.985
  852    HB3  ASN 114           HB3      ASN 114   5.572   8.003  -6.486
  853   HD21  ASN 114          HD22      ASN 114   7.750   7.545  -4.253
  854   HD22  ASN 114          HD21      ASN 114   7.829   5.793  -4.249
  855    H    ALA 115           H        ALA 115   8.563   6.456  -9.215
  856    HA   ALA 115           HA       ALA 115   6.997   5.491 -11.288
  857    HB1  ALA 115           HB1      ALA 115   9.294   4.128  -9.818
  858    HB2  ALA 115           HB2      ALA 115   8.700   3.680 -11.431
  859    HB3  ALA 115           HB3      ALA 115   9.421   5.268 -11.178
  860    H    GLY 116           H        GLY 116   6.589   4.462  -7.979
  861    HA2  GLY 116           HA2      GLY 116   5.062   2.018  -8.867
  862    HA3  GLY 116           HA3      GLY 116   6.081   2.095  -7.445
  863    H    THR 117           H        THR 117   5.148   4.650  -6.303
  864    HA   THR 117           HA       THR 117   2.509   3.866  -5.315
  865    HB   THR 117           HB       THR 117   2.625   5.901  -4.011
  866    HG1  THR 117           HG1      THR 117   4.440   7.233  -4.211
  867   HG21  THR 117          HG21      THR 117   4.565   5.518  -2.652
  868   HG22  THR 117          HG22      THR 117   4.016   3.933  -3.230
  869   HG23  THR 117          HG23      THR 117   5.421   4.726  -3.986
  870    H    GLY 118           H        GLY 118   3.757   5.984  -7.835
  871    HA2  GLY 118           HA2      GLY 118   2.666   7.158  -9.497
  872    HA3  GLY 118           HA3      GLY 118   1.096   6.688  -8.835
  873    H    GLU 119           H        GLU 119   3.030   7.998  -6.339
  874    HA   GLU 119           HA       GLU 119   1.376  10.327  -6.054
  875    HB2  GLU 119           HB2      GLU 119   2.387   8.865  -4.248
  876    HB3  GLU 119           HB3      GLU 119   3.961   9.541  -4.657
  877    HG2  GLU 119           HG2      GLU 119   3.294  10.771  -2.823
  878    HG3  GLU 119           HG3      GLU 119   2.926  11.845  -4.167
  879    HA   PRO 120           HA       PRO 120   4.034  13.133  -8.554
  880    HB2  PRO 120           HB2      PRO 120   2.439  15.157  -6.999
  881    HB3  PRO 120           HB3      PRO 120   2.862  15.142  -8.738
  882    HG2  PRO 120           HG2      PRO 120   0.378  14.420  -7.926
  883    HG3  PRO 120           HG3      PRO 120   1.216  13.461  -9.190
  884    HD2  PRO 120           HD2      PRO 120   0.988  12.867  -6.230
  885    HD3  PRO 120           HD3      PRO 120   0.746  11.769  -7.624
  886    H    LEU 121           H        LEU 121   5.952  14.152  -8.073
  887    HA   LEU 121           HA       LEU 121   6.538  14.900  -5.211
  888    HB2  LEU 121           HB2      LEU 121   8.830  14.535  -7.092
  889    HB3  LEU 121           HB3      LEU 121   8.728  14.330  -5.370
  890    HG   LEU 121           HG       LEU 121   9.335  12.286  -6.380
  891   HD11  LEU 121          HD11      LEU 121   6.435  12.005  -5.536
  892   HD12  LEU 121          HD12      LEU 121   7.676  10.750  -5.547
  893   HD13  LEU 121          HD13      LEU 121   7.826  12.116  -4.438
  894   HD21  LEU 121          HD21      LEU 121   8.372  11.176  -8.099
  895   HD22  LEU 121          HD22      LEU 121   6.877  12.130  -8.010
  896   HD23  LEU 121          HD23      LEU 121   8.378  12.876  -8.616
  897    H    LEU 122           H        LEU 122   6.739  15.829  -8.605
  898    HA   LEU 122           HA       LEU 122   7.427  18.629  -7.923
  899    HB2  LEU 122           HB2      LEU 122   9.513  17.037  -8.177
  900    HB3  LEU 122           HB3      LEU 122   9.047  16.932  -9.859
  901    HG   LEU 122           HG       LEU 122   9.223  19.548  -9.872
  902   HD11  LEU 122          HD11      LEU 122  10.714  20.507  -8.182
  903   HD12  LEU 122          HD12      LEU 122   9.322  19.790  -7.366
  904   HD13  LEU 122          HD13      LEU 122  10.861  18.931  -7.368
  905   HD21  LEU 122          HD21      LEU 122  11.733  17.909  -9.398
  906   HD22  LEU 122          HD22      LEU 122  10.837  17.979 -10.928
  907   HD23  LEU 122          HD23      LEU 122  11.599  19.439 -10.299
  908    H    THR 123           H        THR 123   7.038  20.075  -9.588
  909    HA   THR 123           HA       THR 123   5.901  19.147 -12.170
  910    HB   THR 123           HB       THR 123   4.568  21.300 -10.497
  911    HG1  THR 123           HG1      THR 123   4.172  18.535 -10.532
  912   HG21  THR 123          HG21      THR 123   2.664  20.971 -11.926
  913   HG22  THR 123          HG22      THR 123   4.065  21.326 -12.935
  914   HG23  THR 123          HG23      THR 123   3.480  19.650 -12.791
  915    H    LEU 124           H        LEU 124   6.258  20.589 -13.837
  916    HA   LEU 124           HA       LEU 124   7.948  22.992 -13.329
  917    HB2  LEU 124           HB2      LEU 124   8.311  20.753 -15.351
  918    HB3  LEU 124           HB3      LEU 124   8.865  22.384 -15.677
  919    HG   LEU 124           HG       LEU 124  10.225  22.322 -13.561
  920   HD11  LEU 124          HD11      LEU 124   9.304  20.455 -12.331
  921   HD12  LEU 124          HD12      LEU 124   9.514  19.356 -13.718
  922   HD13  LEU 124          HD13      LEU 124  10.912  19.991 -12.832
  923   HD21  LEU 124          HD21      LEU 124  11.154  22.023 -15.843
  924   HD22  LEU 124          HD22      LEU 124  12.053  21.123 -14.622
  925   HD23  LEU 124          HD23      LEU 124  10.922  20.263 -15.688
  926    H    VAL 125           H        VAL 125   7.327  24.759 -14.376
  927    HA   VAL 125           HA       VAL 125   4.969  24.640 -16.237
  928    HB   VAL 125           HB       VAL 125   5.404  26.541 -13.895
  929   HG11  VAL 125          HG11      VAL 125   3.040  27.190 -14.287
  930   HG12  VAL 125          HG12      VAL 125   4.063  27.598 -15.659
  931   HG13  VAL 125          HG13      VAL 125   3.003  26.171 -15.740
  932   HG21  VAL 125          HG21      VAL 125   3.478  25.391 -12.835
  933   HG22  VAL 125          HG22      VAL 125   3.490  24.175 -14.140
  934   HG23  VAL 125          HG23      VAL 125   4.855  24.319 -13.010
  935    H    CYS 126           H        CYS 126   4.918  26.008 -17.943
  936    HA   CYS 126           HA       CYS 126   7.230  27.875 -18.303
  937    HB2  CYS 126           HB2      CYS 126   7.080  25.841 -19.799
  938    HB3  CYS 126           HB3      CYS 126   5.523  26.441 -20.356
  939    HG   CYS 126           HG       CYS 126   7.161  27.030 -22.207
  940    H    SER 127           H        SER 127   6.666  29.955 -18.053
  941    HA   SER 127           HA       SER 127   4.019  31.032 -18.544
  942    HB2  SER 127           HB2      SER 127   6.677  32.482 -18.243
  943    HB3  SER 127           HB3      SER 127   5.062  33.182 -18.044
  944    HG   SER 127           HG       SER 127   4.747  31.817 -16.253
  945    H    GLY 128           H        GLY 128   6.381  30.107 -20.768
  946    HA2  GLY 128           HA2      GLY 128   5.814  30.479 -23.155
  947    HA3  GLY 128           HA3      GLY 128   5.621  32.192 -22.796
  948    H    SER 129           H        SER 129   8.256  31.114 -20.993
  949    HA   SER 129           HA       SER 129  10.323  31.467 -23.045
  950    HB2  SER 129           HB2      SER 129  11.246  33.504 -22.032
  951    HB3  SER 129           HB3      SER 129   9.617  33.775 -22.666
  952    HG   SER 129           HG       SER 129   9.889  34.670 -20.573
  953    H    TRP 130           H        TRP 130  12.457  31.292 -22.303
  954    HA   TRP 130           HA       TRP 130  12.985  29.214 -20.539
  955    HB2  TRP 130           HB2      TRP 130  14.447  29.733 -22.317
  956    HB3  TRP 130           HB3      TRP 130  14.604  31.411 -21.838
  957    HD1  TRP 130           HD1      TRP 130  16.559  32.100 -20.394
  958    HE1  TRP 130           HE1      TRP 130  18.467  30.920 -19.150
  959    HE3  TRP 130           HE3      TRP 130  15.027  27.252 -20.991
  960    HZ2  TRP 130           HZ2      TRP 130  19.264  28.204 -18.540
  961    HZ3  TRP 130           HZ3      TRP 130  16.365  25.400 -20.014
  962    HH2  TRP 130           HH2      TRP 130  18.472  25.867 -18.810
  963    HA   PRO 131           HA       PRO 131  13.659  28.083 -19.029
  964    HB2  PRO 131           HB2      PRO 131  14.406  27.175 -16.630
  965    HB3  PRO 131           HB3      PRO 131  15.580  28.025 -17.669
  966    HG2  PRO 131           HG2      PRO 131  14.017  29.138 -15.336
  967    HG3  PRO 131           HG3      PRO 131  15.763  29.314 -15.715
  968    HD2  PRO 131           HD2      PRO 131  13.799  31.193 -16.391
  969    HD3  PRO 131           HD3      PRO 131  15.349  31.002 -17.258
  970    H    LEU 132           H        LEU 132  12.407  26.251 -17.777
  971    HA   LEU 132           HA       LEU 132   9.751  27.155 -16.993
  972    HB2  LEU 132           HB2      LEU 132  11.112  24.442 -17.184
  973    HB3  LEU 132           HB3      LEU 132   9.648  24.647 -16.233
  974    HG   LEU 132           HG       LEU 132   8.597  25.753 -18.288
  975   HD11  LEU 132          HD11      LEU 132   9.427  24.973 -20.475
  976   HD12  LEU 132          HD12      LEU 132  10.607  26.022 -19.688
  977   HD13  LEU 132          HD13      LEU 132  10.843  24.257 -19.678
  978   HD21  LEU 132          HD21      LEU 132   7.893  23.579 -17.473
  979   HD22  LEU 132          HD22      LEU 132   7.945  23.564 -19.230
  980   HD23  LEU 132          HD23      LEU 132   9.250  22.787 -18.307
  981    H    ASP 133           H        ASP 133   8.800  26.825 -15.038
  982    HA   ASP 133           HA       ASP 133  10.541  27.420 -12.690
  983    HB2  ASP 133           HB2      ASP 133   8.820  29.051 -13.345
  984    HB3  ASP 133           HB3      ASP 133   7.569  27.814 -13.202
  985    H    GLN 134           H        GLN 134  10.974  25.785 -11.311
  986    HA   GLN 134           HA       GLN 134   9.418  23.314 -11.219
  987    HB2  GLN 134           HB2      GLN 134  11.844  24.349  -9.686
  988    HB3  GLN 134           HB3      GLN 134  11.081  22.788  -9.369
  989    HG2  GLN 134           HG2      GLN 134  11.567  22.009 -11.620
  990    HG3  GLN 134           HG3      GLN 134  12.242  23.579 -12.071
  991   HE21  GLN 134          HE22      GLN 134  12.732  20.849  -9.709
  992   HE22  GLN 134          HE21      GLN 134  14.473  21.077  -9.673
  993    H    THR 135           H        THR 135   8.124  22.654  -9.635
  994    HA   THR 135           HA       THR 135   7.973  24.024  -7.018
  995    HB   THR 135           HB       THR 135   6.219  25.061  -8.436
  996    HG1  THR 135           HG1      THR 135   5.864  24.934  -6.257
  997   HG21  THR 135          HG21      THR 135   4.160  23.832  -8.971
  998   HG22  THR 135          HG22      THR 135   5.537  23.196  -9.873
  999   HG23  THR 135          HG23      THR 135   4.902  22.313  -8.454
 1000    H    LEU 136           H        LEU 136   7.209  22.631  -5.323
 1001    HA   LEU 136           HA       LEU 136   7.442  19.739  -5.844
 1002    HB2  LEU 136           HB2      LEU 136   7.005  21.454  -3.384
 1003    HB3  LEU 136           HB3      LEU 136   6.594  19.743  -3.362
 1004    HG   LEU 136           HG       LEU 136   8.887  19.123  -4.009
 1005   HD11  LEU 136          HD11      LEU 136   9.698  21.113  -5.170
 1006   HD12  LEU 136          HD12      LEU 136   9.514  22.087  -3.692
 1007   HD13  LEU 136          HD13      LEU 136  10.725  20.789  -3.774
 1008   HD21  LEU 136          HD21      LEU 136   8.720  20.916  -1.555
 1009   HD22  LEU 136          HD22      LEU 136   8.211  19.215  -1.642
 1010   HD23  LEU 136          HD23      LEU 136   9.919  19.634  -1.837
 1011    H    ALA 137           H        ALA 137   5.837  18.383  -6.158
 1012    HA   ALA 137           HA       ALA 137   3.772  17.869  -7.162
 1013    HB1  ALA 137           HB1      ALA 137   3.348  18.081  -4.158
 1014    HB2  ALA 137           HB2      ALA 137   2.436  17.035  -5.268
 1015    HB3  ALA 137           HB3      ALA 137   4.169  16.759  -5.015
 1016    H    ARG 138           H        ARG 138   3.445  19.964  -8.302
 1017    HA   ARG 138           HA       ARG 138   2.226  21.702  -9.036
 1018    HB2  ARG 138           HB2      ARG 138  -0.090  20.167  -7.795
 1019    HB3  ARG 138           HB3      ARG 138  -0.189  21.373  -9.068
 1020    HG2  ARG 138           HG2      ARG 138   1.382  19.867 -10.428
 1021    HG3  ARG 138           HG3      ARG 138   0.991  18.599  -9.257
 1022    HD2  ARG 138           HD2      ARG 138  -0.921  20.155 -11.053
 1023    HD3  ARG 138           HD3      ARG 138  -0.424  18.487 -11.267
 1024    HE   ARG 138           HE       ARG 138  -1.689  17.826  -9.319
 1025   HH11  ARG 138          HH11      ARG 138  -2.356  21.178 -10.196
 1026   HH12  ARG 138          HH12      ARG 138  -3.952  21.125  -9.515
 1027   HH21  ARG 138          HH21      ARG 138  -3.711  17.889  -8.385
 1028   HH22  ARG 138          HH22      ARG 138  -4.661  19.340  -8.488
 1029    H    ASP 139           H        ASP 139   3.154  22.218  -6.110
 1030    HA   ASP 139           HA       ASP 139   1.105  23.681  -4.854
 1031    HB2  ASP 139           HB2      ASP 139   3.161  22.921  -3.762
 1032    HB3  ASP 139           HB3      ASP 139   4.091  24.129  -4.639
 1033    H    THR 140           H        THR 140   3.211  24.859  -7.458
 1034    HA   THR 140           HA       THR 140   1.759  27.475  -7.434
 1035    HB   THR 140           HB       THR 140   3.333  28.233  -9.108
 1036    HG1  THR 140           HG1      THR 140   4.989  26.925  -9.777
 1037   HG21  THR 140          HG21      THR 140   4.822  26.889  -6.824
 1038   HG22  THR 140          HG22      THR 140   5.401  28.232  -7.832
 1039   HG23  THR 140          HG23      THR 140   4.012  28.468  -6.754
 1040    H    ARG 141           H        ARG 141   0.881  24.604  -8.523
 1041    HA   ARG 141           HA       ARG 141  -0.370  25.575 -11.042
 1042    HB2  ARG 141           HB2      ARG 141   1.876  24.331 -11.355
 1043    HB3  ARG 141           HB3      ARG 141   1.046  22.888 -10.811
 1044    HG2  ARG 141           HG2      ARG 141   1.215  22.969 -13.231
 1045    HG3  ARG 141           HG3      ARG 141  -0.485  23.036 -12.776
 1046    HD2  ARG 141           HD2      ARG 141  -0.596  25.418 -13.249
 1047    HD3  ARG 141           HD3      ARG 141   1.158  25.523 -13.387
 1048    HE   ARG 141           HE       ARG 141   1.114  24.487 -15.504
 1049   HH11  ARG 141          HH11      ARG 141  -2.198  24.693 -14.339
 1050   HH12  ARG 141          HH12      ARG 141  -2.835  24.361 -15.922
 1051   HH21  ARG 141          HH21      ARG 141   0.275  24.090 -17.383
 1052   HH22  ARG 141          HH22      ARG 141  -1.461  24.043 -17.641
 1053    HA   PRO 142           HA       PRO 142  -2.978  22.901  -8.039
 1054    HB2  PRO 142           HB2      PRO 142  -4.826  24.700  -7.115
 1055    HB3  PRO 142           HB3      PRO 142  -3.212  24.462  -6.378
 1056    HG2  PRO 142           HG2      PRO 142  -4.038  26.574  -8.398
 1057    HG3  PRO 142           HG3      PRO 142  -3.155  26.804  -6.854
 1058    HD2  PRO 142           HD2      PRO 142  -1.828  26.628  -9.213
 1059    HD3  PRO 142           HD3      PRO 142  -1.186  25.867  -7.724