*HEADER    OXIDOREDUCTASE                          08-MAR-05   1Z2E              
*TITLE     SOLUTION STRUCTURE OF BACILLUS SUBTILIS ARSC IN OXIDIZED              
*TITLE    2 STATE                                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ARSENATE REDUCTASE;                                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: ARSENICAL PUMP MODIFIER;                                    
*COMPND   5 EC: 1.20.4.1;                                                        
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS;                              
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    BACILLUS SUBTILIS, ARSENATE REDUCTASE, SOLUTION STRUCTURE,            
*KEYWDS   2 STRUCTURAL GENOMICS                                                  
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    C.JIN, Y.LI                                                           
*REVDAT   1   04-OCT-05 1Z2E    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:  CA CG HB2 HB3
 &rst iat=22,27,25,26, &end
#
#  chirality for residue 2 atoms:  CB CD HG2 HG3
 &rst iat=24,30,28,29, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=20,33,23,24, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=37,42,40,41, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=35,47,38,39, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=51,56,54,55, &end
#
#  chirality for residue 4 atoms:  CB CD HG2 HG3
 &rst iat=53,59,57,58, &end
#
#  chirality for residue 4 atoms:  CD NZ HE2 HE3
 &rst iat=59,65,63,64, &end
#
#  chirality for residue 4 atoms:  CG CE HD2 HD3
 &rst iat=56,62,60,61, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=49,69,52,53, &end
#
#  chirality for residue 5 atoms:  CA CG2 CG1 HB
 &rst iat=73,77,81,76, &end
#
#  chirality for residue 5 atoms:  CB CD1 HG12 HG13
 &rst iat=75,84,82,83, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=71,88,74,75, &end
#
#  chirality for residue 6 atoms:  CA CG2 CG1 HB
 &rst iat=92,96,100,95, &end
#
#  chirality for residue 6 atoms:  CB CD1 HG12 HG13
 &rst iat=94,103,101,102, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=90,107,93,94, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=111,116,114,115, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=109,128,112,113, &end
#
#  chirality for residue 8 atoms:  CA CG HB2 HB3
 &rst iat=132,137,135,136, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=130,148,133,134, &end
#
#  chirality for residue 9 atoms:  CA CG HB2 HB3
 &rst iat=152,157,155,156, &end
#
#  chirality for residue 9 atoms:  CB CD1 CD2 HG
 &rst iat=154,159,163,158, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=150,167,153,154, &end
#
#  chirality for residue 10 atoms:  CA SG HB2 HB3
 &rst iat=171,176,174,175, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=169,178,172,173, &end
#
#  chirality for residue 11 atoms:  CA CG2 OG1 HB
 &rst iat=182,186,190,185, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=180,192,183,184, &end
#
#  chirality for residue 12 atoms:  N C HA2 HA3
 &rst iat=194,199,197,198, &end
#
#  chirality for residue 13 atoms:  CA CG HB2 HB3
 &rst iat=203,208,206,207, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=201,213,204,205, &end
#
#  chirality for residue 14 atoms:  CA OG HB2 HB3
 &rst iat=217,222,220,221, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=215,224,218,219, &end
#
#  chirality for residue 15 atoms:  CA SG HB2 HB3
 &rst iat=228,233,231,232, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=226,235,229,230, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=239,244,242,243, &end
#
#  chirality for residue 16 atoms:  CB CD HG2 HG3
 &rst iat=241,247,245,246, &end
#
#  chirality for residue 16 atoms:  CG NE HD2 HD3
 &rst iat=244,250,248,249, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=237,259,240,241, &end
#
#  chirality for residue 17 atoms:  CA OG HB2 HB3
 &rst iat=263,268,266,267, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=261,270,264,265, &end
#
#  chirality for residue 18 atoms:  CA CG HB2 HB3
 &rst iat=274,279,277,278, &end
#
#  chirality for residue 18 atoms:  CB CD HG2 HG3
 &rst iat=276,282,280,281, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=272,287,275,276, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=291,296,294,295, &end
#
#  chirality for residue 19 atoms:  CB SD HG2 HG3
 &rst iat=293,299,297,298, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=289,304,292,293, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=306,314,309,310, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=318,323,321,322, &end
#
#  chirality for residue 21 atoms:  CB CD HG2 HG3
 &rst iat=320,326,324,325, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=316,329,319,320, &end
#
#  chirality for residue 22 atoms:  N C HA2 HA3
 &rst iat=331,336,334,335, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=340,345,343,344, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=338,360,341,342, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=362,370,365,366, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=374,379,377,378, &end
#
#  chirality for residue 25 atoms:  CB CD HG2 HG3
 &rst iat=376,382,380,381, &end
#
#  chirality for residue 25 atoms:  CD NZ HE2 HE3
 &rst iat=382,388,386,387, &end
#
#  chirality for residue 25 atoms:  CG CE HD2 HD3
 &rst iat=379,385,383,384, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=372,392,375,376, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=396,401,399,400, &end
#
#  chirality for residue 26 atoms:  CB CD HG2 HG3
 &rst iat=398,404,402,403, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=394,409,397,398, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=413,418,416,417, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=411,430,414,415, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=434,439,437,438, &end
#
#  chirality for residue 28 atoms:  CB CD1 CD2 HG
 &rst iat=436,441,445,440, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=432,449,435,436, &end
#
#  chirality for residue 29 atoms:  N C HA2 HA3
 &rst iat=451,456,454,455, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=460,465,463,464, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=458,468,461,462, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=472,477,475,476, &end
#
#  chirality for residue 31 atoms:  CB CD HG2 HG3
 &rst iat=474,480,478,479, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=470,483,473,474, &end
#
#  chirality for residue 32 atoms:  CA CG HB2 HB3
 &rst iat=487,492,490,491, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=485,507,488,489, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=511,516,514,515, &end
#
#  chirality for residue 33 atoms:  CB CD HG2 HG3
 &rst iat=513,519,517,518, &end
#
#  chirality for residue 33 atoms:  CD NZ HE2 HE3
 &rst iat=519,525,523,524, &end
#
#  chirality for residue 33 atoms:  CG CE HD2 HD3
 &rst iat=516,522,520,521, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=509,529,512,513, &end
#
#  chirality for residue 34 atoms:  CA CG1 CG2 HB
 &rst iat=533,537,541,536, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=531,545,534,535, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=549,554,552,553, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=547,566,550,551, &end
#
#  chirality for residue 36 atoms:  CA OG HB2 HB3
 &rst iat=570,575,573,574, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=568,577,571,572, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=579,587,582,583, &end
#
#  chirality for residue 38 atoms:  N C HA2 HA3
 &rst iat=589,594,592,593, &end
#
#  chirality for residue 39 atoms:  CA CG2 CG1 HB
 &rst iat=598,602,606,601, &end
#
#  chirality for residue 39 atoms:  CB CD1 HG12 HG13
 &rst iat=600,609,607,608, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=596,613,599,600, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=617,622,620,621, &end
#
#  chirality for residue 40 atoms:  CB CD HG2 HG3
 &rst iat=619,625,623,624, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=615,628,618,619, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=630,638,633,634, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=642,647,645,646, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=640,655,643,644, &end
#
#  chirality for residue 43 atoms:  N C HA2 HA3
 &rst iat=657,662,660,661, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=666,671,669,670, &end
#
#  chirality for residue 44 atoms:  CB CD1 CD2 HG
 &rst iat=668,673,677,672, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=664,681,667,668, &end
#
#  chirality for residue 45 atoms:  CA CG HB2 HB3
 &rst iat=685,690,688,689, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=683,695,686,687, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=707,701,705,706, &end
#
#  chirality for residue 46 atoms:  CB CD HG2 HG3
 &rst iat=704,698,702,703, &end
#
#  chirality for residue 46 atoms:  CG N HD2 HD3
 &rst iat=701,697,699,700, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=697,709,708,704, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=713,718,716,717, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=711,723,714,715, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=725,733,728,729, &end
#
#  chirality for residue 49 atoms:  CA CG1 CG2 HB
 &rst iat=737,741,745,740, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=735,749,738,739, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=753,758,756,757, &end
#
#  chirality for residue 50 atoms:  CB CD HG2 HG3
 &rst iat=755,761,759,760, &end
#
#  chirality for residue 50 atoms:  CD NZ HE2 HE3
 &rst iat=761,767,765,766, &end
#
#  chirality for residue 50 atoms:  CG CE HD2 HD3
 &rst iat=758,764,762,763, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=751,771,754,755, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=773,781,776,777, &end
#
#  chirality for residue 52 atoms:  CA CG HB2 HB3
 &rst iat=785,790,788,789, &end
#
#  chirality for residue 52 atoms:  CB SD HG2 HG3
 &rst iat=787,793,791,792, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=783,798,786,787, &end
#
#  chirality for residue 53 atoms:  CA CG HB2 HB3
 &rst iat=802,807,805,806, &end
#
#  chirality for residue 53 atoms:  CB CD HG2 HG3
 &rst iat=804,810,808,809, &end
#
#  chirality for residue 53 atoms:  CD NZ HE2 HE3
 &rst iat=810,816,814,815, &end
#
#  chirality for residue 53 atoms:  CG CE HD2 HD3
 &rst iat=807,813,811,812, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=800,820,803,804, &end
#
#  chirality for residue 54 atoms:  CA CG HB2 HB3
 &rst iat=824,829,827,828, &end
#
#  chirality for residue 54 atoms:  CB CD HG2 HG3
 &rst iat=826,832,830,831, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=822,835,825,826, &end
#
#  chirality for residue 55 atoms:  CA CG1 CG2 HB
 &rst iat=839,843,847,842, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=837,851,840,841, &end
#
#  chirality for residue 56 atoms:  N C HA2 HA3
 &rst iat=853,858,856,857, &end
#
#  chirality for residue 57 atoms:  CA CG2 CG1 HB
 &rst iat=862,866,870,865, &end
#
#  chirality for residue 57 atoms:  CB CD1 HG12 HG13
 &rst iat=864,873,871,872, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=860,877,863,864, &end
#
#  chirality for residue 58 atoms:  CA CG HB2 HB3
 &rst iat=881,886,884,885, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=879,889,882,883, &end
#
#  chirality for residue 59 atoms:  CA CG2 CG1 HB
 &rst iat=893,897,901,896, &end
#
#  chirality for residue 59 atoms:  CB CD1 HG12 HG13
 &rst iat=895,904,902,903, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=891,908,894,895, &end
#
#  chirality for residue 60 atoms:  CA OG HB2 HB3
 &rst iat=912,917,915,916, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=910,919,913,914, &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=921,933,924,925, &end
#
#  chirality for residue 62 atoms:  CA CG HB2 HB3
 &rst iat=937,942,940,941, &end
#
#  chirality for residue 62 atoms:  CB CD HG2 HG3
 &rst iat=939,945,943,944, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=935,950,938,939, &end
#
#  chirality for residue 63 atoms:  CA CG2 OG1 HB
 &rst iat=954,958,962,957, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=952,964,955,956, &end
#
#  chirality for residue 64 atoms:  CA OG HB2 HB3
 &rst iat=968,973,971,972, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=966,975,969,970, &end
#
#  chirality for residue 65 atoms:  CA CG HB2 HB3
 &rst iat=979,984,982,983, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=977,987,980,981, &end
#
#  chirality for residue 66 atoms:  CA CG2 CG1 HB
 &rst iat=991,995,999,994, &end
#
#  chirality for residue 66 atoms:  CB CD1 HG12 HG13
 &rst iat=993,1002,1000,1001, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=989,1006,992,993, &end
#
#  chirality for residue 67 atoms:  CA CG2 CG1 HB
 &rst iat=1010,1014,1018,1013, &end
#
#  chirality for residue 67 atoms:  CB CD1 HG12 HG13
 &rst iat=1012,1021,1019,1020, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1008,1025,1011,1012, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1029,1034,1032,1033, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1027,1037,1030,1031, &end
#
#  chirality for residue 69 atoms:  CA OG HB2 HB3
 &rst iat=1041,1046,1044,1045, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1039,1048,1042,1043, &end
#
#  chirality for residue 70 atoms:  CA CG HB2 HB3
 &rst iat=1052,1057,1055,1056, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1050,1060,1053,1054, &end
#
#  chirality for residue 71 atoms:  CA CG2 CG1 HB
 &rst iat=1064,1068,1072,1067, &end
#
#  chirality for residue 71 atoms:  CB CD1 HG12 HG13
 &rst iat=1066,1075,1073,1074, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1062,1079,1065,1066, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1083,1088,1086,1087, &end
#
#  chirality for residue 72 atoms:  CB CD1 CD2 HG
 &rst iat=1085,1090,1094,1089, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1081,1098,1084,1085, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1102,1107,1105,1106, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1100,1112,1103,1104, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1116,1121,1119,1120, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1114,1126,1117,1118, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1128,1136,1131,1132, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1140,1145,1143,1144, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1138,1148,1141,1142, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1152,1157,1155,1156, &end
#
#  chirality for residue 77 atoms:  CB CD1 CD2 HG
 &rst iat=1154,1159,1163,1158, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1150,1167,1153,1154, &end
#
#  chirality for residue 78 atoms:  CA CG1 CG2 HB
 &rst iat=1171,1175,1179,1174, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1169,1183,1172,1173, &end
#
#  chirality for residue 79 atoms:  CA CG1 CG2 HB
 &rst iat=1187,1191,1195,1190, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1185,1199,1188,1189, &end
#
#  chirality for residue 80 atoms:  CA CG2 OG1 HB
 &rst iat=1203,1207,1211,1206, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1201,1213,1204,1205, &end
#
#  chirality for residue 81 atoms:  CA CG HB2 HB3
 &rst iat=1217,1222,1220,1221, &end
#
#  chirality for residue 81 atoms:  CB CD1 CD2 HG
 &rst iat=1219,1224,1228,1223, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1215,1232,1218,1219, &end
#
#  chirality for residue 82 atoms:  CA SG HB2 HB3
 &rst iat=1236,1241,1239,1240, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1234,1242,1237,1238, &end
#
#  chirality for residue 83 atoms:  N C HA2 HA3
 &rst iat=1244,1249,1247,1248, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1253,1258,1256,1257, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1251,1261,1254,1255, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1263,1271,1266,1267, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1273,1281,1276,1277, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1285,1290,1288,1289, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1283,1293,1286,1287, &end
#
#  chirality for residue 88 atoms:  CA CG HB2 HB3
 &rst iat=1297,1302,1300,1301, &end
#
#  chirality for residue 88 atoms:  CB CD HG2 HG3
 &rst iat=1299,1305,1303,1304, &end
#
#  chirality for residue 88 atoms:  CD NZ HE2 HE3
 &rst iat=1305,1311,1309,1310, &end
#
#  chirality for residue 88 atoms:  CG CE HD2 HD3
 &rst iat=1302,1308,1306,1307, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1295,1315,1298,1299, &end
#
#  chirality for residue 89 atoms:  CA SG HB2 HB3
 &rst iat=1319,1324,1322,1323, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1317,1325,1320,1321, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=1337,1331,1335,1336, &end
#
#  chirality for residue 90 atoms:  CB CD HG2 HG3
 &rst iat=1334,1328,1332,1333, &end
#
#  chirality for residue 90 atoms:  CG N HD2 HD3
 &rst iat=1331,1327,1329,1330, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1327,1339,1338,1334, &end
#
#  chirality for residue 91 atoms:  CA CG HB2 HB3
 &rst iat=1343,1348,1346,1347, &end
#
#  chirality for residue 91 atoms:  CB SD HG2 HG3
 &rst iat=1345,1351,1349,1350, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1341,1356,1344,1345, &end
#
#  chirality for residue 92 atoms:  CA CG2 OG1 HB
 &rst iat=1360,1364,1368,1363, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1358,1370,1361,1362, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1382,1376,1380,1381, &end
#
#  chirality for residue 93 atoms:  CB CD HG2 HG3
 &rst iat=1379,1373,1377,1378, &end
#
#  chirality for residue 93 atoms:  CG N HD2 HD3
 &rst iat=1376,1372,1374,1375, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1372,1384,1383,1379, &end
#
#  chirality for residue 94 atoms:  CA CG HB2 HB3
 &rst iat=1396,1390,1394,1395, &end
#
#  chirality for residue 94 atoms:  CB CD HG2 HG3
 &rst iat=1393,1387,1391,1392, &end
#
#  chirality for residue 94 atoms:  CG N HD2 HD3
 &rst iat=1390,1386,1388,1389, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1386,1398,1397,1393, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1402,1407,1405,1406, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1400,1415,1403,1404, &end
#
#  chirality for residue 96 atoms:  CA CG1 CG2 HB
 &rst iat=1419,1423,1427,1422, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1417,1431,1420,1421, &end
#
#  chirality for residue 97 atoms:  CA CG HB2 HB3
 &rst iat=1435,1440,1438,1439, &end
#
#  chirality for residue 97 atoms:  CB CD HG2 HG3
 &rst iat=1437,1443,1441,1442, &end
#
#  chirality for residue 97 atoms:  CD NZ HE2 HE3
 &rst iat=1443,1449,1447,1448, &end
#
#  chirality for residue 97 atoms:  CG CE HD2 HD3
 &rst iat=1440,1446,1444,1445, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1433,1453,1436,1437, &end
#
#  chirality for residue 98 atoms:  CA CG HB2 HB3
 &rst iat=1457,1462,1460,1461, &end
#
#  chirality for residue 98 atoms:  CB CD HG2 HG3
 &rst iat=1459,1465,1463,1464, &end
#
#  chirality for residue 98 atoms:  CG NE HD2 HD3
 &rst iat=1462,1468,1466,1467, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1455,1477,1458,1459, &end
#
#  chirality for residue 99 atoms:  CA CG HB2 HB3
 &rst iat=1481,1486,1484,1485, &end
#
#  chirality for residue 99 atoms:  CB CD HG2 HG3
 &rst iat=1483,1489,1487,1488, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1479,1492,1482,1483, &end
#
#  chirality for residue 100 atoms:  CA CG HB2 HB3
 &rst iat=1496,1501,1499,1500, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1494,1509,1497,1498, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=1513,1518,1516,1517, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1511,1533,1514,1515, &end
#
#  chirality for residue 102 atoms:  N C HA2 HA3
 &rst iat=1535,1540,1538,1539, &end
#
#  chirality for residue 103 atoms:  CA CG HB2 HB3
 &rst iat=1544,1549,1547,1548, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1542,1560,1545,1546, &end
#
#  chirality for residue 104 atoms:  CA CG HB2 HB3
 &rst iat=1564,1569,1567,1568, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1562,1572,1565,1566, &end
#
#  chirality for residue 105 atoms:  CA CG HB2 HB3
 &rst iat=1576,1581,1579,1580, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1574,1584,1577,1578, &end
#
#  chirality for residue 106 atoms:  CA CG HB2 HB3
 &rst iat=1596,1590,1594,1595, &end
#
#  chirality for residue 106 atoms:  CB CD HG2 HG3
 &rst iat=1593,1587,1591,1592, &end
#
#  chirality for residue 106 atoms:  CG N HD2 HD3
 &rst iat=1590,1586,1588,1589, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1586,1598,1597,1593, &end
#
#  chirality for residue 107 atoms:  N C HA CB
 &rst iat=1600,1608,1603,1604, &end
#
#  chirality for residue 108 atoms:  CA CG HB2 HB3
 &rst iat=1612,1617,1615,1616, &end
#
#  chirality for residue 108 atoms:  CB CD HG2 HG3
 &rst iat=1614,1620,1618,1619, &end
#
#  chirality for residue 108 atoms:  CG NE HD2 HD3
 &rst iat=1617,1623,1621,1622, &end
#
#  chirality for residue 108 atoms:  N C HA CB
 &rst iat=1610,1632,1613,1614, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=1634,1642,1637,1638, &end
#
#  chirality for residue 110 atoms:  CA CG HB2 HB3
 &rst iat=1646,1651,1649,1650, &end
#
#  chirality for residue 110 atoms:  CB CD HG2 HG3
 &rst iat=1648,1654,1652,1653, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=1644,1659,1647,1648, &end
#
#  chirality for residue 111 atoms:  N C HA2 HA3
 &rst iat=1661,1666,1664,1665, &end
#
#  chirality for residue 112 atoms:  CA CG2 OG1 HB
 &rst iat=1670,1674,1678,1673, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=1668,1680,1671,1672, &end
#
#  chirality for residue 113 atoms:  CA CG HB2 HB3
 &rst iat=1684,1689,1687,1688, &end
#
#  chirality for residue 113 atoms:  CB CD HG2 HG3
 &rst iat=1686,1692,1690,1691, &end
#
#  chirality for residue 113 atoms:  N C HA CB
 &rst iat=1682,1695,1685,1686, &end
#
#  chirality for residue 114 atoms:  CA CG HB2 HB3
 &rst iat=1699,1704,1702,1703, &end
#
#  chirality for residue 114 atoms:  CB CD HG2 HG3
 &rst iat=1701,1707,1705,1706, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=1697,1710,1700,1701, &end
#
#  chirality for residue 115 atoms:  CA CG HB2 HB3
 &rst iat=1714,1719,1717,1718, &end
#
#  chirality for residue 115 atoms:  CB CD HG2 HG3
 &rst iat=1716,1722,1720,1721, &end
#
#  chirality for residue 115 atoms:  N C HA CB
 &rst iat=1712,1725,1715,1716, &end
#
#  chirality for residue 116 atoms:  CA CG HB2 HB3
 &rst iat=1729,1734,1732,1733, &end
#
#  chirality for residue 116 atoms:  CB CD HG2 HG3
 &rst iat=1731,1737,1735,1736, &end
#
#  chirality for residue 116 atoms:  CD NZ HE2 HE3
 &rst iat=1737,1743,1741,1742, &end
#
#  chirality for residue 116 atoms:  CG CE HD2 HD3
 &rst iat=1734,1740,1738,1739, &end
#
#  chirality for residue 116 atoms:  N C HA CB
 &rst iat=1727,1747,1730,1731, &end
#
#  chirality for residue 117 atoms:  CA CG HB2 HB3
 &rst iat=1751,1756,1754,1755, &end
#
#  chirality for residue 117 atoms:  N C HA CB
 &rst iat=1749,1771,1752,1753, &end
#
#  chirality for residue 118 atoms:  N C HA CB
 &rst iat=1773,1781,1776,1777, &end
#
#  chirality for residue 119 atoms:  CA CG HB2 HB3
 &rst iat=1785,1790,1788,1789, &end
#
#  chirality for residue 119 atoms:  N C HA CB
 &rst iat=1783,1801,1786,1787, &end
#
#  chirality for residue 120 atoms:  CA CG HB2 HB3
 &rst iat=1805,1810,1808,1809, &end
#
#  chirality for residue 120 atoms:  N C HA CB
 &rst iat=1803,1821,1806,1807, &end
#
#  chirality for residue 121 atoms:  CA CG HB2 HB3
 &rst iat=1825,1830,1828,1829, &end
#
#  chirality for residue 121 atoms:  CB CD HG2 HG3
 &rst iat=1827,1833,1831,1832, &end
#
#  chirality for residue 121 atoms:  N C HA CB
 &rst iat=1823,1838,1826,1827, &end
#
#  chirality for residue 122 atoms:  CA CG HB2 HB3
 &rst iat=1842,1847,1845,1846, &end
#
#  chirality for residue 122 atoms:  CB CD HG2 HG3
 &rst iat=1844,1850,1848,1849, &end
#
#  chirality for residue 122 atoms:  CG NE HD2 HD3
 &rst iat=1847,1853,1851,1852, &end
#
#  chirality for residue 122 atoms:  N C HA CB
 &rst iat=1840,1862,1843,1844, &end
#
#  chirality for residue 123 atoms:  CA CG1 CG2 HB
 &rst iat=1866,1870,1874,1869, &end
#
#  chirality for residue 123 atoms:  N C HA CB
 &rst iat=1864,1878,1867,1868, &end
#
#  chirality for residue 124 atoms:  CA CG HB2 HB3
 &rst iat=1882,1887,1885,1886, &end
#
#  chirality for residue 124 atoms:  CB CD HG2 HG3
 &rst iat=1884,1890,1888,1889, &end
#
#  chirality for residue 124 atoms:  CG NE HD2 HD3
 &rst iat=1887,1893,1891,1892, &end
#
#  chirality for residue 124 atoms:  N C HA CB
 &rst iat=1880,1902,1883,1884, &end
#
#  chirality for residue 125 atoms:  CA CG HB2 HB3
 &rst iat=1906,1911,1909,1910, &end
#
#  chirality for residue 125 atoms:  N C HA CB
 &rst iat=1904,1914,1907,1908, &end
#
#  chirality for residue 126 atoms:  CA CG HB2 HB3
 &rst iat=1918,1923,1921,1922, &end
#
#  chirality for residue 126 atoms:  CB CD HG2 HG3
 &rst iat=1920,1926,1924,1925, &end
#
#  chirality for residue 126 atoms:  N C HA CB
 &rst iat=1916,1929,1919,1920, &end
#
#  chirality for residue 127 atoms:  CA CG2 CG1 HB
 &rst iat=1933,1937,1941,1936, &end
#
#  chirality for residue 127 atoms:  CB CD1 HG12 HG13
 &rst iat=1935,1944,1942,1943, &end
#
#  chirality for residue 127 atoms:  N C HA CB
 &rst iat=1931,1948,1934,1935, &end
#
#  chirality for residue 128 atoms:  N C HA2 HA3
 &rst iat=1950,1955,1953,1954, &end
#
#  chirality for residue 129 atoms:  CA CG HB2 HB3
 &rst iat=1959,1964,1962,1963, &end
#
#  chirality for residue 129 atoms:  N C HA CB
 &rst iat=1957,1969,1960,1961, &end
#
#  chirality for residue 130 atoms:  CA CG HB2 HB3
 &rst iat=1973,1978,1976,1977, &end
#
#  chirality for residue 130 atoms:  CB CD HG2 HG3
 &rst iat=1975,1981,1979,1980, &end
#
#  chirality for residue 130 atoms:  CG NE HD2 HD3
 &rst iat=1978,1984,1982,1983, &end
#
#  chirality for residue 130 atoms:  N C HA CB
 &rst iat=1971,1993,1974,1975, &end
#
#  chirality for residue 131 atoms:  CA CG HB2 HB3
 &rst iat=1997,2002,2000,2001, &end
#
#  chirality for residue 131 atoms:  CB CD1 CD2 HG
 &rst iat=1999,2004,2008,2003, &end
#
#  chirality for residue 131 atoms:  N C HA CB
 &rst iat=1995,2012,1998,1999, &end
#
#  chirality for residue 132 atoms:  CA CG HB2 HB3
 &rst iat=2016,2021,2019,2020, &end
#
#  chirality for residue 132 atoms:  CB CD HG2 HG3
 &rst iat=2018,2024,2022,2023, &end
#
#  chirality for residue 132 atoms:  CD NZ HE2 HE3
 &rst iat=2024,2030,2028,2029, &end
#
#  chirality for residue 132 atoms:  CG CE HD2 HD3
 &rst iat=2021,2027,2025,2026, &end
#
#  chirality for residue 132 atoms:  N C HA CB
 &rst iat=2014,2034,2017,2018, &end
#
#  chirality for residue 133 atoms:  CA CG HB2 HB3
 &rst iat=2038,2043,2041,2042, &end
#
#  chirality for residue 133 atoms:  CB CD HG2 HG3
 &rst iat=2040,2046,2044,2045, &end
#
#  chirality for residue 133 atoms:  N C HA CB
 &rst iat=2036,2049,2039,2040, &end
#
#  chirality for residue 134 atoms:  CA CG HB2 HB3
 &rst iat=2053,2058,2056,2057, &end
#
#  chirality for residue 134 atoms:  N C HA CB
 &rst iat=2051,2069,2054,2055, &end
#
#  chirality for residue 135 atoms:  N C HA CB
 &rst iat=2071,2079,2074,2075, &end
#
#  chirality for residue 136 atoms:  CA CG HB2 HB3
 &rst iat=2083,2088,2086,2087, &end
#
#  chirality for residue 136 atoms:  CB CD HG2 HG3
 &rst iat=2085,2091,2089,2090, &end
#
#  chirality for residue 136 atoms:  N C HA CB
 &rst iat=2081,2094,2084,2085, &end
#
#  chirality for residue 137 atoms:  CA CG2 OG1 HB
 &rst iat=2098,2102,2106,2101, &end
#
#  chirality for residue 137 atoms:  N C HA CB
 &rst iat=2096,2108,2099,2100, &end
#
#  chirality for residue 138 atoms:  N C HA2 HA3
 &rst iat=2110,2115,2113,2114, &end
#
#  chirality for residue 139 atoms:  CA CG HB2 HB3
 &rst iat=2119,2124,2122,2123, &end
#
#  chirality for residue 139 atoms:  CB CD HG2 HG3
 &rst iat=2121,2127,2125,2126, &end
#
#  chirality for residue 139 atoms:  CD NZ HE2 HE3
 &rst iat=2127,2133,2131,2132, &end
#
#  chirality for residue 139 atoms:  CG CE HD2 HD3
 &rst iat=2124,2130,2128,2129, &end
#
#  chirality for residue 139 atoms:  N C HA CB
 &rst iat=2117,2137,2120,2121, &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=37,35,33,22, &end
#
#  trans-omega constraint for residue 4
 &rst iat=51,49,47,37, &end
#
#  trans-omega constraint for residue 5
 &rst iat=73,71,69,51, &end
#
#  trans-omega constraint for residue 6
 &rst iat=92,90,88,73, &end
#
#  trans-omega constraint for residue 7
 &rst iat=111,109,107,92, &end
#
#  trans-omega constraint for residue 8
 &rst iat=132,130,128,111, &end
#
#  trans-omega constraint for residue 9
 &rst iat=152,150,148,132, &end
#
#  trans-omega constraint for residue 10
 &rst iat=171,169,167,152, &end
#
#  trans-omega constraint for residue 11
 &rst iat=182,180,178,171, &end
#
#  trans-omega constraint for residue 12
 &rst iat=196,194,192,182, &end
#
#  trans-omega constraint for residue 13
 &rst iat=203,201,199,196, &end
#
#  trans-omega constraint for residue 14
 &rst iat=217,215,213,203, &end
#
#  trans-omega constraint for residue 15
 &rst iat=228,226,224,217, &end
#
#  trans-omega constraint for residue 16
 &rst iat=239,237,235,228, &end
#
#  trans-omega constraint for residue 17
 &rst iat=263,261,259,239, &end
#
#  trans-omega constraint for residue 18
 &rst iat=274,272,270,263, &end
#
#  trans-omega constraint for residue 19
 &rst iat=291,289,287,274, &end
#
#  trans-omega constraint for residue 20
 &rst iat=308,306,304,291, &end
#
#  trans-omega constraint for residue 21
 &rst iat=318,316,314,308, &end
#
#  trans-omega constraint for residue 22
 &rst iat=333,331,329,318, &end
#
#  trans-omega constraint for residue 23
 &rst iat=340,338,336,333, &end
#
#  trans-omega constraint for residue 24
 &rst iat=364,362,360,340, &end
#
#  trans-omega constraint for residue 25
 &rst iat=374,372,370,364, &end
#
#  trans-omega constraint for residue 26
 &rst iat=396,394,392,374, &end
#
#  trans-omega constraint for residue 27
 &rst iat=413,411,409,396, &end
#
#  trans-omega constraint for residue 28
 &rst iat=434,432,430,413, &end
#
#  trans-omega constraint for residue 29
 &rst iat=453,451,449,434, &end
#
#  trans-omega constraint for residue 30
 &rst iat=460,458,456,453, &end
#
#  trans-omega constraint for residue 31
 &rst iat=472,470,468,460, &end
#
#  trans-omega constraint for residue 32
 &rst iat=487,485,483,472, &end
#
#  trans-omega constraint for residue 33
 &rst iat=511,509,507,487, &end
#
#  trans-omega constraint for residue 34
 &rst iat=533,531,529,511, &end
#
#  trans-omega constraint for residue 35
 &rst iat=549,547,545,533, &end
#
#  trans-omega constraint for residue 36
 &rst iat=570,568,566,549, &end
#
#  trans-omega constraint for residue 37
 &rst iat=581,579,577,570, &end
#
#  trans-omega constraint for residue 38
 &rst iat=591,589,587,581, &end
#
#  trans-omega constraint for residue 39
 &rst iat=598,596,594,591, &end
#
#  trans-omega constraint for residue 40
 &rst iat=617,615,613,598, &end
#
#  trans-omega constraint for residue 41
 &rst iat=632,630,628,617, &end
#
#  trans-omega constraint for residue 42
 &rst iat=642,640,638,632, &end
#
#  trans-omega constraint for residue 43
 &rst iat=659,657,655,642, &end
#
#  trans-omega constraint for residue 44
 &rst iat=666,664,662,659, &end
#
#  trans-omega constraint for residue 45
 &rst iat=685,683,681,666, &end
#
#  trans-omega constraint for residue 46
 &rst iat=707,697,695,685, &end
#
#  trans-omega constraint for residue 47
 &rst iat=713,711,709,707, &end
#
#  trans-omega constraint for residue 48
 &rst iat=727,725,723,713, &end
#
#  trans-omega constraint for residue 49
 &rst iat=737,735,733,727, &end
#
#  trans-omega constraint for residue 50
 &rst iat=753,751,749,737, &end
#
#  trans-omega constraint for residue 51
 &rst iat=775,773,771,753, &end
#
#  trans-omega constraint for residue 52
 &rst iat=785,783,781,775, &end
#
#  trans-omega constraint for residue 53
 &rst iat=802,800,798,785, &end
#
#  trans-omega constraint for residue 54
 &rst iat=824,822,820,802, &end
#
#  trans-omega constraint for residue 55
 &rst iat=839,837,835,824, &end
#
#  trans-omega constraint for residue 56
 &rst iat=855,853,851,839, &end
#
#  trans-omega constraint for residue 57
 &rst iat=862,860,858,855, &end
#
#  trans-omega constraint for residue 58
 &rst iat=881,879,877,862, &end
#
#  trans-omega constraint for residue 59
 &rst iat=893,891,889,881, &end
#
#  trans-omega constraint for residue 60
 &rst iat=912,910,908,893, &end
#
#  trans-omega constraint for residue 61
 &rst iat=923,921,919,912, &end
#
#  trans-omega constraint for residue 62
 &rst iat=937,935,933,923, &end
#
#  trans-omega constraint for residue 63
 &rst iat=954,952,950,937, &end
#
#  trans-omega constraint for residue 64
 &rst iat=968,966,964,954, &end
#
#  trans-omega constraint for residue 65
 &rst iat=979,977,975,968, &end
#
#  trans-omega constraint for residue 66
 &rst iat=991,989,987,979, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1010,1008,1006,991, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1029,1027,1025,1010, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1041,1039,1037,1029, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1052,1050,1048,1041, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1064,1062,1060,1052, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1083,1081,1079,1064, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1102,1100,1098,1083, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1116,1114,1112,1102, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1130,1128,1126,1116, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1140,1138,1136,1130, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1152,1150,1148,1140, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1171,1169,1167,1152, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1187,1185,1183,1171, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1203,1201,1199,1187, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1217,1215,1213,1203, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1236,1234,1232,1217, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1246,1244,1242,1236, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1253,1251,1249,1246, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1265,1263,1261,1253, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1275,1273,1271,1265, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1285,1283,1281,1275, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1297,1295,1293,1285, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1319,1317,1315,1297, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1337,1327,1325,1319, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1343,1341,1339,1337, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1360,1358,1356,1343, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1382,1372,1370,1360, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1396,1386,1384,1382, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1402,1400,1398,1396, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1419,1417,1415,1402, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1435,1433,1431,1419, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1457,1455,1453,1435, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1481,1479,1477,1457, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1496,1494,1492,1481, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1513,1511,1509,1496, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1537,1535,1533,1513, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1544,1542,1540,1537, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1564,1562,1560,1544, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1576,1574,1572,1564, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1596,1586,1584,1576, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1602,1600,1598,1596, &end
#
#  trans-omega constraint for residue 108
 &rst iat=1612,1610,1608,1602, &end
#
#  trans-omega constraint for residue 109
 &rst iat=1636,1634,1632,1612, &end
#
#  trans-omega constraint for residue 110
 &rst iat=1646,1644,1642,1636, &end
#
#  trans-omega constraint for residue 111
 &rst iat=1663,1661,1659,1646, &end
#
#  trans-omega constraint for residue 112
 &rst iat=1670,1668,1666,1663, &end
#
#  trans-omega constraint for residue 113
 &rst iat=1684,1682,1680,1670, &end
#
#  trans-omega constraint for residue 114
 &rst iat=1699,1697,1695,1684, &end
#
#  trans-omega constraint for residue 115
 &rst iat=1714,1712,1710,1699, &end
#
#  trans-omega constraint for residue 116
 &rst iat=1729,1727,1725,1714, &end
#
#  trans-omega constraint for residue 117
 &rst iat=1751,1749,1747,1729, &end
#
#  trans-omega constraint for residue 118
 &rst iat=1775,1773,1771,1751, &end
#
#  trans-omega constraint for residue 119
 &rst iat=1785,1783,1781,1775, &end
#
#  trans-omega constraint for residue 120
 &rst iat=1805,1803,1801,1785, &end
#
#  trans-omega constraint for residue 121
 &rst iat=1825,1823,1821,1805, &end
#
#  trans-omega constraint for residue 122
 &rst iat=1842,1840,1838,1825, &end
#
#  trans-omega constraint for residue 123
 &rst iat=1866,1864,1862,1842, &end
#
#  trans-omega constraint for residue 124
 &rst iat=1882,1880,1878,1866, &end
#
#  trans-omega constraint for residue 125
 &rst iat=1906,1904,1902,1882, &end
#
#  trans-omega constraint for residue 126
 &rst iat=1918,1916,1914,1906, &end
#
#  trans-omega constraint for residue 127
 &rst iat=1933,1931,1929,1918, &end
#
#  trans-omega constraint for residue 128
 &rst iat=1952,1950,1948,1933, &end
#
#  trans-omega constraint for residue 129
 &rst iat=1959,1957,1955,1952, &end
#
#  trans-omega constraint for residue 130
 &rst iat=1973,1971,1969,1959, &end
#
#  trans-omega constraint for residue 131
 &rst iat=1997,1995,1993,1973, &end
#
#  trans-omega constraint for residue 132
 &rst iat=2016,2014,2012,1997, &end
#
#  trans-omega constraint for residue 133
 &rst iat=2038,2036,2034,2016, &end
#
#  trans-omega constraint for residue 134
 &rst iat=2053,2051,2049,2038, &end
#
#  trans-omega constraint for residue 135
 &rst iat=2073,2071,2069,2053, &end
#
#  trans-omega constraint for residue 136
 &rst iat=2083,2081,2079,2073, &end
#
#  trans-omega constraint for residue 137
 &rst iat=2098,2096,2094,2083, &end
#
#  trans-omega constraint for residue 138
 &rst iat=2112,2110,2108,2098, &end
#
#  trans-omega constraint for residue 139
 &rst iat=2119,2117,2115,2112, &end
# 2139 atoms read from pdb file amb_01.pdb.
# 4 LYS PHI:  (3 ASN C)-(4 LYS N)-(4 LYS CA)-(4 LYS C) -142.0 -62.0
 &rst     iat =    47,    49,    51,    69,
   r1 = -143.0, r2 = -142.0, r3 = -62.0, r4 = -61.0,
   rk2 =   30.0, rk3 =   30.0,    &end

# 4 LYS PSI:  (4 LYS N)-(4 LYS CA)-(4 LYS C)-(5 ILE N)  92.0 172.0
 &rst     iat =    49,    51,    69,    71,
   r1 =  91.0, r2 =  92.0, r3 = 172.0, r4 = 173.0,
 &end

# 5 ILE PHI:  (4 LYS C)-(5 ILE N)-(5 ILE CA)-(5 ILE C) -156.0 -76.0
 &rst     iat =    69,    71,    73,    88,
   r1 = -157.0, r2 = -156.0, r3 = -76.0, r4 = -75.0,
 &end

# 5 ILE PSI:  (5 ILE N)-(5 ILE CA)-(5 ILE C)-(6 ILE N)  93.0 173.0
 &rst     iat =    71,    73,    88,    90,
   r1 =  92.0, r2 =  93.0, r3 = 173.0, r4 = 174.0,
 &end

# 5 ILE CHI1:  (5 ILE N)-(5 ILE CA)-(5 ILE CB)-(5 ILE CG1) -90.0 -30.0
 &rst     iat =    71,    73,    75,    81,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 6 ILE PHI:  (5 ILE C)-(6 ILE N)-(6 ILE CA)-(6 ILE C) -164.0 -84.0
 &rst     iat =    88,    90,    92,   107,
   r1 = -165.0, r2 = -164.0, r3 = -84.0, r4 = -83.0,
 &end

# 6 ILE PSI:  (6 ILE N)-(6 ILE CA)-(6 ILE C)-(7 TYR N)  85.0 165.0
 &rst     iat =    90,    92,   107,   109,
   r1 =  84.0, r2 =  85.0, r3 = 165.0, r4 = 166.0,
 &end

# 6 ILE CHI1:  (6 ILE N)-(6 ILE CA)-(6 ILE CB)-(6 ILE CG1) 150.0 210.0
 &rst     iat =    90,    92,    94,   100,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 7 TYR PHI:  (6 ILE C)-(7 TYR N)-(7 TYR CA)-(7 TYR C) -161.0 -81.0
 &rst     iat =   107,   109,   111,   128,
   r1 = -162.0, r2 = -161.0, r3 = -81.0, r4 = -80.0,
 &end

# 7 TYR PSI:  (7 TYR N)-(7 TYR CA)-(7 TYR C)-(8 PHE N)  94.0 174.0
 &rst     iat =   109,   111,   128,   130,
   r1 =  93.0, r2 =  94.0, r3 = 174.0, r4 = 175.0,
 &end

# 7 TYR CHI1:  (7 TYR N)-(7 TYR CA)-(7 TYR CB)-(7 TYR CG) 150.0 210.0
 &rst     iat =   109,   111,   113,   116,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 8 PHE PHI:  (7 TYR C)-(8 PHE N)-(8 PHE CA)-(8 PHE C) -140.0 -60.0
 &rst     iat =   128,   130,   132,   148,
   r1 = -141.0, r2 = -140.0, r3 = -60.0, r4 = -59.0,
 &end

# 8 PHE PSI:  (8 PHE N)-(8 PHE CA)-(8 PHE C)-(9 LEU N)  90.0 170.0
 &rst     iat =   130,   132,   148,   150,
   r1 =  89.0, r2 =  90.0, r3 = 170.0, r4 = 171.0,
 &end

# 9 LEU PHI:  (8 PHE C)-(9 LEU N)-(9 LEU CA)-(9 LEU C) -164.0 -84.0
 &rst     iat =   148,   150,   152,   167,
   r1 = -165.0, r2 = -164.0, r3 = -84.0, r4 = -83.0,
 &end

# 9 LEU PSI:  (9 LEU N)-(9 LEU CA)-(9 LEU C)-(10 CYS N) 106.0 186.0
 &rst     iat =   150,   152,   167,   169,
   r1 = 105.0, r2 = 106.0, r3 = 186.0, r4 = 187.0,
 &end

# 10 CYS PHI:  (9 LEU C)-(10 CYS N)-(10 CYS CA)-(10 CYS C) -156.0 -76.0
 &rst     iat =   167,   169,   171,   178,
   r1 = -157.0, r2 = -156.0, r3 = -76.0, r4 = -75.0,
 &end

# 10 CYS PSI:  (10 CYS N)-(10 CYS CA)-(10 CYS C)-(11 THR N) 101.0 181.0
 &rst     iat =   169,   171,   178,   180,
   r1 = 100.0, r2 = 101.0, r3 = 181.0, r4 = 182.0,
 &end

# 16 ARG PHI:  (15 CYS C)-(16 ARG N)-(16 ARG CA)-(16 ARG C) -104.0 -24.0
 &rst     iat =   235,   237,   239,   259,
   r1 = -105.0, r2 = -104.0, r3 = -24.0, r4 = -23.0,
 &end

# 16 ARG PSI:  (16 ARG N)-(16 ARG CA)-(16 ARG C)-(17 SER N) -84.0  -4.0
 &rst     iat =   237,   239,   259,   261,
   r1 = -85.0, r2 = -84.0, r3 =  -4.0, r4 =  -3.0,
 &end

# 17 SER PHI:  (16 ARG C)-(17 SER N)-(17 SER CA)-(17 SER C) -107.0 -27.0
 &rst     iat =   259,   261,   263,   270,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 17 SER PSI:  (17 SER N)-(17 SER CA)-(17 SER C)-(18 GLN N) -81.0  -1.0
 &rst     iat =   261,   263,   270,   272,
   r1 = -82.0, r2 = -81.0, r3 =  -1.0, r4 =   0.0,
 &end

# 18 GLN PHI:  (17 SER C)-(18 GLN N)-(18 GLN CA)-(18 GLN C) -106.0 -26.0
 &rst     iat =   270,   272,   274,   287,
   r1 = -107.0, r2 = -106.0, r3 = -26.0, r4 = -25.0,
 &end

# 18 GLN PSI:  (18 GLN N)-(18 GLN CA)-(18 GLN C)-(19 MET N) -80.0   0.0
 &rst     iat =   272,   274,   287,   289,
   r1 = -81.0, r2 = -80.0, r3 =   0.0, r4 =   1.0,
 &end

# 18 GLN CHI1:  (18 GLN N)-(18 GLN CA)-(18 GLN CB)-(18 GLN CG) -90.0 -30.0
 &rst     iat =   272,   274,   276,   279,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 19 MET PHI:  (18 GLN C)-(19 MET N)-(19 MET CA)-(19 MET C) -110.0 -30.0
 &rst     iat =   287,   289,   291,   304,
   r1 = -111.0, r2 = -110.0, r3 = -30.0, r4 = -29.0,
 &end

# 19 MET PSI:  (19 MET N)-(19 MET CA)-(19 MET C)-(20 ALA N) -76.0   4.0
 &rst     iat =   289,   291,   304,   306,
   r1 = -77.0, r2 = -76.0, r3 =   4.0, r4 =   5.0,
 &end

# 19 MET CHI1:  (19 MET N)-(19 MET CA)-(19 MET CB)-(19 MET CG) -90.0 -30.0
 &rst     iat =   289,   291,   293,   296,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 20 ALA PHI:  (19 MET C)-(20 ALA N)-(20 ALA CA)-(20 ALA C) -112.0 -32.0
 &rst     iat =   304,   306,   308,   314,
   r1 = -113.0, r2 = -112.0, r3 = -32.0, r4 = -31.0,
 &end

# 20 ALA PSI:  (20 ALA N)-(20 ALA CA)-(20 ALA C)-(21 GLU N) -80.0   0.0
 &rst     iat =   306,   308,   314,   316,
   r1 = -81.0, r2 = -80.0, r3 =   0.0, r4 =   1.0,
 &end

# 21 GLU PHI:  (20 ALA C)-(21 GLU N)-(21 GLU CA)-(21 GLU C) -104.0 -24.0
 &rst     iat =   314,   316,   318,   329,
   r1 = -105.0, r2 = -104.0, r3 = -24.0, r4 = -23.0,
 &end

# 21 GLU PSI:  (21 GLU N)-(21 GLU CA)-(21 GLU C)-(22 GLY N) -80.0   0.0
 &rst     iat =   316,   318,   329,   331,
   r1 = -81.0, r2 = -80.0, r3 =   0.0, r4 =   1.0,
 &end

# 22 GLY PHI:  (21 GLU C)-(22 GLY N)-(22 GLY CA)-(22 GLY C) -113.0 -33.0
 &rst     iat =   329,   331,   333,   336,
   r1 = -114.0, r2 = -113.0, r3 = -33.0, r4 = -32.0,
 &end

# 22 GLY PSI:  (22 GLY N)-(22 GLY CA)-(22 GLY C)-(23 TRP N) -73.0   7.0
 &rst     iat =   331,   333,   336,   338,
   r1 = -74.0, r2 = -73.0, r3 =   7.0, r4 =   8.0,
 &end

# 23 TRP PHI:  (22 GLY C)-(23 TRP N)-(23 TRP CA)-(23 TRP C) -124.0 -44.0
 &rst     iat =   336,   338,   340,   360,
   r1 = -125.0, r2 = -124.0, r3 = -44.0, r4 = -43.0,
 &end

# 23 TRP PSI:  (23 TRP N)-(23 TRP CA)-(23 TRP C)-(24 ALA N) -65.0  15.0
 &rst     iat =   338,   340,   360,   362,
   r1 = -66.0, r2 = -65.0, r3 =  15.0, r4 =  16.0,
 &end

# 24 ALA PHI:  (23 TRP C)-(24 ALA N)-(24 ALA CA)-(24 ALA C) -102.0 -22.0
 &rst     iat =   360,   362,   364,   370,
   r1 = -103.0, r2 = -102.0, r3 = -22.0, r4 = -21.0,
 &end

# 24 ALA PSI:  (24 ALA N)-(24 ALA CA)-(24 ALA C)-(25 LYS N) -79.0   1.0
 &rst     iat =   362,   364,   370,   372,
   r1 = -80.0, r2 = -79.0, r3 =   1.0, r4 =   2.0,
 &end

# 25 LYS PHI:  (24 ALA C)-(25 LYS N)-(25 LYS CA)-(25 LYS C) -106.0 -26.0
 &rst     iat =   370,   372,   374,   392,
   r1 = -107.0, r2 = -106.0, r3 = -26.0, r4 = -25.0,
 &end

# 25 LYS PSI:  (25 LYS N)-(25 LYS CA)-(25 LYS C)-(26 GLN N) -78.0   2.0
 &rst     iat =   372,   374,   392,   394,
   r1 = -79.0, r2 = -78.0, r3 =   2.0, r4 =   3.0,
 &end

# 26 GLN PHI:  (25 LYS C)-(26 GLN N)-(26 GLN CA)-(26 GLN C) -124.0 -44.0
 &rst     iat =   392,   394,   396,   409,
   r1 = -125.0, r2 = -124.0, r3 = -44.0, r4 = -43.0,
 &end

# 26 GLN PSI:  (26 GLN N)-(26 GLN CA)-(26 GLN C)-(27 TYR N) -62.0  18.0
 &rst     iat =   394,   396,   409,   411,
   r1 = -63.0, r2 = -62.0, r3 =  18.0, r4 =  19.0,
 &end

# 27 TYR PHI:  (26 GLN C)-(27 TYR N)-(27 TYR CA)-(27 TYR C) -129.0 -49.0
 &rst     iat =   409,   411,   413,   430,
   r1 = -130.0, r2 = -129.0, r3 = -49.0, r4 = -48.0,
 &end

# 27 TYR PSI:  (27 TYR N)-(27 TYR CA)-(27 TYR C)-(28 LEU N) -69.0  11.0
 &rst     iat =   411,   413,   430,   432,
   r1 = -70.0, r2 = -69.0, r3 =  11.0, r4 =  12.0,
 &end

# 27 TYR CHI1:  (27 TYR N)-(27 TYR CA)-(27 TYR CB)-(27 TYR CG) -90.0 -30.0
 &rst     iat =   411,   413,   415,   418,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 28 LEU PHI:  (27 TYR C)-(28 LEU N)-(28 LEU CA)-(28 LEU C) -137.0 -57.0
 &rst     iat =   430,   432,   434,   449,
   r1 = -138.0, r2 = -137.0, r3 = -57.0, r4 = -56.0,
 &end

# 28 LEU PSI:  (28 LEU N)-(28 LEU CA)-(28 LEU C)-(29 GLY N) -32.0  48.0
 &rst     iat =   432,   434,   449,   451,
   r1 = -33.0, r2 = -32.0, r3 =  48.0, r4 =  49.0,
 &end

# 32 TRP PHI:  (31 GLU C)-(32 TRP N)-(32 TRP CA)-(32 TRP C) -146.0 -66.0
 &rst     iat =   483,   485,   487,   507,
   r1 = -147.0, r2 = -146.0, r3 = -66.0, r4 = -65.0,
 &end

# 32 TRP PSI:  (32 TRP N)-(32 TRP CA)-(32 TRP C)-(33 LYS N)  94.0 174.0
 &rst     iat =   485,   487,   507,   509,
   r1 =  93.0, r2 =  94.0, r3 = 174.0, r4 = 175.0,
 &end

# 33 LYS PHI:  (32 TRP C)-(33 LYS N)-(33 LYS CA)-(33 LYS C) -148.0 -68.0
 &rst     iat =   507,   509,   511,   529,
   r1 = -149.0, r2 = -148.0, r3 = -68.0, r4 = -67.0,
 &end

# 33 LYS PSI:  (33 LYS N)-(33 LYS CA)-(33 LYS C)-(34 VAL N)  88.0 168.0
 &rst     iat =   509,   511,   529,   531,
   r1 =  87.0, r2 =  88.0, r3 = 168.0, r4 = 169.0,
 &end

# 34 VAL PHI:  (33 LYS C)-(34 VAL N)-(34 VAL CA)-(34 VAL C) -149.0 -69.0
 &rst     iat =   529,   531,   533,   545,
   r1 = -150.0, r2 = -149.0, r3 = -69.0, r4 = -68.0,
 &end

# 34 VAL PSI:  (34 VAL N)-(34 VAL CA)-(34 VAL C)-(35 TYR N)  89.0 169.0
 &rst     iat =   531,   533,   545,   547,
   r1 =  88.0, r2 =  89.0, r3 = 169.0, r4 = 170.0,
 &end

# 35 TYR PHI:  (34 VAL C)-(35 TYR N)-(35 TYR CA)-(35 TYR C) -166.0 -86.0
 &rst     iat =   545,   547,   549,   566,
   r1 = -167.0, r2 = -166.0, r3 = -86.0, r4 = -85.0,
 &end

# 35 TYR PSI:  (35 TYR N)-(35 TYR CA)-(35 TYR C)-(36 SER N) 104.0 184.0
 &rst     iat =   547,   549,   566,   568,
   r1 = 103.0, r2 = 104.0, r3 = 184.0, r4 = 185.0,
 &end

# 36 SER PHI:  (35 TYR C)-(36 SER N)-(36 SER CA)-(36 SER C) -161.0 -81.0
 &rst     iat =   566,   568,   570,   577,
   r1 = -162.0, r2 = -161.0, r3 = -81.0, r4 = -80.0,
 &end

# 36 SER PSI:  (36 SER N)-(36 SER CA)-(36 SER C)-(37 ALA N) 106.0 186.0
 &rst     iat =   568,   570,   577,   579,
   r1 = 105.0, r2 = 106.0, r3 = 186.0, r4 = 187.0,
 &end

# 37 ALA PHI:  (36 SER C)-(37 ALA N)-(37 ALA CA)-(37 ALA C) -185.0 -105.0
 &rst     iat =   577,   579,   581,   587,
   r1 = -186.0, r2 = -185.0, r3 = -105.0, r4 = -104.0,
 &end

# 37 ALA PSI:  (37 ALA N)-(37 ALA CA)-(37 ALA C)-(38 GLY N) 113.0 193.0
 &rst     iat =   579,   581,   587,   589,
   r1 = 112.0, r2 = 113.0, r3 = 193.0, r4 = 194.0,
 &end

# 47 ASN PHI:  (46 PRO C)-(47 ASN N)-(47 ASN CA)-(47 ASN C) -117.0 -27.0
 &rst     iat =   709,   711,   713,   723,
   r1 = -118.0, r2 = -117.0, r3 = -27.0, r4 = -26.0,
 &end

# 47 ASN PSI:  (47 ASN N)-(47 ASN CA)-(47 ASN C)-(48 ALA N) -78.0   2.0
 &rst     iat =   711,   713,   723,   725,
   r1 = -79.0, r2 = -78.0, r3 =   2.0, r4 =   3.0,
 &end

# 48 ALA PHI:  (47 ASN C)-(48 ALA N)-(48 ALA CA)-(48 ALA C) -105.0 -25.0
 &rst     iat =   723,   725,   727,   733,
   r1 = -106.0, r2 = -105.0, r3 = -25.0, r4 = -24.0,
 &end

# 48 ALA PSI:  (48 ALA N)-(48 ALA CA)-(48 ALA C)-(49 VAL N) -79.0   1.0
 &rst     iat =   725,   727,   733,   735,
   r1 = -80.0, r2 = -79.0, r3 =   1.0, r4 =   2.0,
 &end

# 49 VAL PHI:  (48 ALA C)-(49 VAL N)-(49 VAL CA)-(49 VAL C) -105.0 -25.0
 &rst     iat =   733,   735,   737,   749,
   r1 = -106.0, r2 = -105.0, r3 = -25.0, r4 = -24.0,
 &end

# 49 VAL PSI:  (49 VAL N)-(49 VAL CA)-(49 VAL C)-(50 LYS N) -83.0  -3.0
 &rst     iat =   735,   737,   749,   751,
   r1 = -84.0, r2 = -83.0, r3 =  -3.0, r4 =  -2.0,
 &end

# 49 VAL CHI1:  (49 VAL N)-(49 VAL CA)-(49 VAL CB)-(49 VAL CG1) 150.0 210.0
 &rst     iat =   735,   737,   739,   741,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 50 LYS PHI:  (49 VAL C)-(50 LYS N)-(50 LYS CA)-(50 LYS C) -107.0 -27.0
 &rst     iat =   749,   751,   753,   771,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 50 LYS PSI:  (50 LYS N)-(50 LYS CA)-(50 LYS C)-(51 ALA N) -76.0   4.0
 &rst     iat =   751,   753,   771,   773,
   r1 = -77.0, r2 = -76.0, r3 =   4.0, r4 =   5.0,
 &end

# 51 ALA PHI:  (50 LYS C)-(51 ALA N)-(51 ALA CA)-(51 ALA C) -104.0 -24.0
 &rst     iat =   771,   773,   775,   781,
   r1 = -105.0, r2 = -104.0, r3 = -24.0, r4 = -23.0,
 &end

# 51 ALA PSI:  (51 ALA N)-(51 ALA CA)-(51 ALA C)-(52 MET N) -83.0  -3.0
 &rst     iat =   773,   775,   781,   783,
   r1 = -84.0, r2 = -83.0, r3 =  -3.0, r4 =  -2.0,
 &end

# 52 MET PHI:  (51 ALA C)-(52 MET N)-(52 MET CA)-(52 MET C) -107.0 -27.0
 &rst     iat =   781,   783,   785,   798,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 52 MET PSI:  (52 MET N)-(52 MET CA)-(52 MET C)-(53 LYS N) -79.0   1.0
 &rst     iat =   783,   785,   798,   800,
   r1 = -80.0, r2 = -79.0, r3 =   1.0, r4 =   2.0,
 &end

# 53 LYS PHI:  (52 MET C)-(53 LYS N)-(53 LYS CA)-(53 LYS C) -104.0 -24.0
 &rst     iat =   798,   800,   802,   820,
   r1 = -105.0, r2 = -104.0, r3 = -24.0, r4 = -23.0,
 &end

# 53 LYS PSI:  (53 LYS N)-(53 LYS CA)-(53 LYS C)-(54 GLU N) -77.0   3.0
 &rst     iat =   800,   802,   820,   822,
   r1 = -78.0, r2 = -77.0, r3 =   3.0, r4 =   4.0,
 &end

# 54 GLU PHI:  (53 LYS C)-(54 GLU N)-(54 GLU CA)-(54 GLU C) -111.0 -31.0
 &rst     iat =   820,   822,   824,   835,
   r1 = -112.0, r2 = -111.0, r3 = -31.0, r4 = -30.0,
 &end

# 54 GLU PSI:  (54 GLU N)-(54 GLU CA)-(54 GLU C)-(55 VAL N) -65.0  15.0
 &rst     iat =   822,   824,   835,   837,
   r1 = -66.0, r2 = -65.0, r3 =  15.0, r4 =  16.0,
 &end

# 55 VAL PHI:  (54 GLU C)-(55 VAL N)-(55 VAL CA)-(55 VAL C) -146.0 -66.0
 &rst     iat =   835,   837,   839,   851,
   r1 = -147.0, r2 = -146.0, r3 = -66.0, r4 = -65.0,
 &end

# 55 VAL PSI:  (55 VAL N)-(55 VAL CA)-(55 VAL C)-(56 GLY N) -34.0  46.0
 &rst     iat =   837,   839,   851,   853,
   r1 = -35.0, r2 = -34.0, r3 =  46.0, r4 =  47.0,
 &end

# 57 ILE PHI:  (56 GLY C)-(57 ILE N)-(57 ILE CA)-(57 ILE C) -150.0 -50.0
 &rst     iat =   858,   860,   862,   877,
   r1 = -151.0, r2 = -150.0, r3 = -50.0, r4 = -49.0,
 &end

# 57 ILE PSI:  (57 ILE N)-(57 ILE CA)-(57 ILE C)-(58 ASP N)  76.0 176.0
 &rst     iat =   860,   862,   877,   879,
   r1 =  75.0, r2 =  76.0, r3 = 176.0, r4 = 177.0,
 &end

# 57 ILE CHI1:  (57 ILE N)-(57 ILE CA)-(57 ILE CB)-(57 ILE CG1) -90.0 -30.0
 &rst     iat =   860,   862,   864,   870,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 58 ASP PHI:  (57 ILE C)-(58 ASP N)-(58 ASP CA)-(58 ASP C) -142.0 -42.0
 &rst     iat =   877,   879,   881,   889,
   r1 = -143.0, r2 = -142.0, r3 = -42.0, r4 = -41.0,
 &end

# 58 ASP PSI:  (58 ASP N)-(58 ASP CA)-(58 ASP C)-(59 ILE N)  76.0 176.0
 &rst     iat =   879,   881,   889,   891,
   r1 =  75.0, r2 =  76.0, r3 = 176.0, r4 = 177.0,
 &end

# 58 ASP CHI1:  (58 ASP N)-(58 ASP CA)-(58 ASP CB)-(58 ASP CG) 150.0 210.0
 &rst     iat =   879,   881,   883,   886,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 59 ILE CHI1:  (59 ILE N)-(59 ILE CA)-(59 ILE CB)-(59 ILE CG1)  30.0  90.0
 &rst     iat =   891,   893,   895,   901,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 63 THR CHI1:  (63 THR N)-(63 THR CA)-(63 THR CB)-(63 THR OG1)  30.0  90.0
 &rst     iat =   952,   954,   956,   962,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 64 SER CHI1:  (64 SER N)-(64 SER CA)-(64 SER CB)-(64 SER OG) -90.0 -30.0
 &rst     iat =   966,   968,   970,   973,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 65 ASP CHI1:  (65 ASP N)-(65 ASP CA)-(65 ASP CB)-(65 ASP CG) 150.0 210.0
 &rst     iat =   977,   979,   981,   984,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 66 ILE CHI1:  (66 ILE N)-(66 ILE CA)-(66 ILE CB)-(66 ILE CG1)  30.0  90.0
 &rst     iat =   989,   991,   993,   999,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 67 ILE CHI1:  (67 ILE N)-(67 ILE CA)-(67 ILE CB)-(67 ILE CG1) -90.0 -30.0
 &rst     iat =  1008,  1010,  1012,  1018,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 68 ASP CHI1:  (68 ASP N)-(68 ASP CA)-(68 ASP CB)-(68 ASP CG) 150.0 210.0
 &rst     iat =  1027,  1029,  1031,  1034,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 69 SER PHI:  (68 ASP C)-(69 SER N)-(69 SER CA)-(69 SER C) -106.0 -26.0
 &rst     iat =  1037,  1039,  1041,  1048,
   r1 = -107.0, r2 = -106.0, r3 = -26.0, r4 = -25.0,
 &end

# 69 SER PSI:  (69 SER N)-(69 SER CA)-(69 SER C)-(70 ASP N) -72.0   8.0
 &rst     iat =  1039,  1041,  1048,  1050,
   r1 = -73.0, r2 = -72.0, r3 =   8.0, r4 =   9.0,
 &end

# 70 ASP PHI:  (69 SER C)-(70 ASP N)-(70 ASP CA)-(70 ASP C) -104.0 -24.0
 &rst     iat =  1048,  1050,  1052,  1060,
   r1 = -105.0, r2 = -104.0, r3 = -24.0, r4 = -23.0,
 &end

# 70 ASP PSI:  (70 ASP N)-(70 ASP CA)-(70 ASP C)-(71 ILE N) -80.0   0.0
 &rst     iat =  1050,  1052,  1060,  1062,
   r1 = -81.0, r2 = -80.0, r3 =   0.0, r4 =   1.0,
 &end

# 70 ASP CHI1:  (70 ASP N)-(70 ASP CA)-(70 ASP CB)-(70 ASP CG) 150.0 210.0
 &rst     iat =  1050,  1052,  1054,  1057,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 71 ILE PHI:  (70 ASP C)-(71 ILE N)-(71 ILE CA)-(71 ILE C) -107.0 -27.0
 &rst     iat =  1060,  1062,  1064,  1079,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 71 ILE PSI:  (71 ILE N)-(71 ILE CA)-(71 ILE C)-(72 LEU N) -83.0  -3.0
 &rst     iat =  1062,  1064,  1079,  1081,
   r1 = -84.0, r2 = -83.0, r3 =  -3.0, r4 =  -2.0,
 &end

# 71 ILE CHI1:  (71 ILE N)-(71 ILE CA)-(71 ILE CB)-(71 ILE CG1) -90.0 -30.0
 &rst     iat =  1062,  1064,  1066,  1072,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 72 LEU PHI:  (71 ILE C)-(72 LEU N)-(72 LEU CA)-(72 LEU C) -101.0 -21.0
 &rst     iat =  1079,  1081,  1083,  1098,
   r1 = -102.0, r2 = -101.0, r3 = -21.0, r4 = -20.0,
 &end

# 72 LEU PSI:  (72 LEU N)-(72 LEU CA)-(72 LEU C)-(73 ASN N) -83.0  -3.0
 &rst     iat =  1081,  1083,  1098,  1100,
   r1 = -84.0, r2 = -83.0, r3 =  -3.0, r4 =  -2.0,
 &end

# 74 ASN CHI1:  (74 ASN N)-(74 ASN CA)-(74 ASN CB)-(74 ASN CG) 150.0 210.0
 &rst     iat =  1114,  1116,  1118,  1121,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 76 ASP CHI1:  (76 ASP N)-(76 ASP CA)-(76 ASP CB)-(76 ASP CG) 150.0 210.0
 &rst     iat =  1138,  1140,  1142,  1145,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 77 LEU PHI:  (76 ASP C)-(77 LEU N)-(77 LEU CA)-(77 LEU C) -182.0 -102.0
 &rst     iat =  1148,  1150,  1152,  1167,
   r1 = -183.0, r2 = -182.0, r3 = -102.0, r4 = -101.0,
 &end

# 77 LEU PSI:  (77 LEU N)-(77 LEU CA)-(77 LEU C)-(78 VAL N) 107.0 187.0
 &rst     iat =  1150,  1152,  1167,  1169,
   r1 = 106.0, r2 = 107.0, r3 = 187.0, r4 = 188.0,
 &end

# 78 VAL PHI:  (77 LEU C)-(78 VAL N)-(78 VAL CA)-(78 VAL C) -153.0 -73.0
 &rst     iat =  1167,  1169,  1171,  1183,
   r1 = -154.0, r2 = -153.0, r3 = -73.0, r4 = -72.0,
 &end

# 78 VAL PSI:  (78 VAL N)-(78 VAL CA)-(78 VAL C)-(79 VAL N)  84.0 164.0
 &rst     iat =  1169,  1171,  1183,  1185,
   r1 =  83.0, r2 =  84.0, r3 = 164.0, r4 = 165.0,
 &end

# 79 VAL PHI:  (78 VAL C)-(79 VAL N)-(79 VAL CA)-(79 VAL C) -152.0 -72.0
 &rst     iat =  1183,  1185,  1187,  1199,
   r1 = -153.0, r2 = -152.0, r3 = -72.0, r4 = -71.0,
 &end

# 79 VAL PSI:  (79 VAL N)-(79 VAL CA)-(79 VAL C)-(80 THR N)  90.0 170.0
 &rst     iat =  1185,  1187,  1199,  1201,
   r1 =  89.0, r2 =  90.0, r3 = 170.0, r4 = 171.0,
 &end

# 79 VAL CHI1:  (79 VAL N)-(79 VAL CA)-(79 VAL CB)-(79 VAL CG1) 150.0 210.0
 &rst     iat =  1185,  1187,  1189,  1191,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 80 THR PHI:  (79 VAL C)-(80 THR N)-(80 THR CA)-(80 THR C) -147.0 -67.0
 &rst     iat =  1199,  1201,  1203,  1213,
   r1 = -148.0, r2 = -147.0, r3 = -67.0, r4 = -66.0,
 &end

# 80 THR PSI:  (80 THR N)-(80 THR CA)-(80 THR C)-(81 LEU N) 102.0 182.0
 &rst     iat =  1201,  1203,  1213,  1215,
   r1 = 101.0, r2 = 102.0, r3 = 182.0, r4 = 183.0,
 &end

# 81 LEU CHI1:  (81 LEU N)-(81 LEU CA)-(81 LEU CB)-(81 LEU CG) -90.0 -30.0
 &rst     iat =  1215,  1217,  1219,  1222,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 82 CYS CHI1:  (82 CYX N)-(82 CYX CA)-(82 CYX CB)-(82 CYX SG)  30.0  90.0
 &rst     iat =  1234,  1236,  1238,  1241,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 84 ASP PHI:  (83 GLY C)-(84 ASP N)-(84 ASP CA)-(84 ASP C) -142.0 -42.0
 &rst     iat =  1249,  1251,  1253,  1261,
   r1 = -143.0, r2 = -142.0, r3 = -42.0, r4 = -41.0,
 &end

# 84 ASP PSI:  (84 ASP N)-(84 ASP CA)-(84 ASP C)-(85 ALA N)  82.0 182.0
 &rst     iat =  1251,  1253,  1261,  1263,
   r1 =  81.0, r2 =  82.0, r3 = 182.0, r4 = 183.0,
 &end

# 86 ALA PHI:  (85 ALA C)-(86 ALA N)-(86 ALA CA)-(86 ALA C) -143.0 -43.0
 &rst     iat =  1271,  1273,  1275,  1281,
   r1 = -144.0, r2 = -143.0, r3 = -43.0, r4 = -42.0,
 &end

# 86 ALA PSI:  (86 ALA N)-(86 ALA CA)-(86 ALA C)-(87 ASP N) -52.0  48.0
 &rst     iat =  1273,  1275,  1281,  1283,
   r1 = -53.0, r2 = -52.0, r3 =  48.0, r4 =  49.0,
 &end

# 92 THR PHI:  (91 MET C)-(92 THR N)-(92 THR CA)-(92 THR C) -150.0 -50.0
 &rst     iat =  1356,  1358,  1360,  1370,
   r1 = -151.0, r2 = -150.0, r3 = -50.0, r4 = -49.0,
 &end

# 92 THR PSI:  (92 THR N)-(92 THR CA)-(92 THR C)-(93 PRO N)  70.0 170.0
 &rst     iat =  1358,  1360,  1370,  1372,
   r1 =  69.0, r2 =  70.0, r3 = 170.0, r4 = 171.0,
 &end

# 92 THR CHI1:  (92 THR N)-(92 THR CA)-(92 THR CB)-(92 THR OG1)  30.0  90.0
 &rst     iat =  1358,  1360,  1362,  1368,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 96 VAL PHI:  (95 HID C)-(96 VAL N)-(96 VAL CA)-(96 VAL C) -140.0 -60.0
 &rst     iat =  1415,  1417,  1419,  1431,
   r1 = -141.0, r2 = -140.0, r3 = -60.0, r4 = -59.0,
 &end

# 96 VAL PSI:  (96 VAL N)-(96 VAL CA)-(96 VAL C)-(97 LYS N)  85.0 165.0
 &rst     iat =  1417,  1419,  1431,  1433,
   r1 =  84.0, r2 =  85.0, r3 = 165.0, r4 = 166.0,
 &end

# 97 LYS PHI:  (96 VAL C)-(97 LYS N)-(97 LYS CA)-(97 LYS C) -126.0 -46.0
 &rst     iat =  1431,  1433,  1435,  1453,
   r1 = -127.0, r2 = -126.0, r3 = -46.0, r4 = -45.0,
 &end

# 97 LYS PSI:  (97 LYS N)-(97 LYS CA)-(97 LYS C)-(98 ARG N)  85.0 165.0
 &rst     iat =  1433,  1435,  1453,  1455,
   r1 =  84.0, r2 =  85.0, r3 = 165.0, r4 = 166.0,
 &end

# 98 ARG PHI:  (97 LYS C)-(98 ARG N)-(98 ARG CA)-(98 ARG C) -150.0 -70.0
 &rst     iat =  1453,  1455,  1457,  1477,
   r1 = -151.0, r2 = -150.0, r3 = -70.0, r4 = -69.0,
 &end

# 98 ARG PSI:  (98 ARG N)-(98 ARG CA)-(98 ARG C)-(99 GLU N)  99.0 179.0
 &rst     iat =  1455,  1457,  1477,  1479,
   r1 =  98.0, r2 =  99.0, r3 = 179.0, r4 = 180.0,
 &end

# 99 GLU PHI:  (98 ARG C)-(99 GLU N)-(99 GLU CA)-(99 GLU C) -159.0 -79.0
 &rst     iat =  1477,  1479,  1481,  1492,
   r1 = -160.0, r2 = -159.0, r3 = -79.0, r4 = -78.0,
 &end

# 99 GLU PSI:  (99 GLU N)-(99 GLU CA)-(99 GLU C)-(100 HID N) 101.0 181.0
 &rst     iat =  1479,  1481,  1492,  1494,
   r1 = 100.0, r2 = 101.0, r3 = 181.0, r4 = 182.0,
 &end

# 100 HIS PHI:  (99 GLU C)-(100 HID N)-(100 HID CA)-(100 HID C) -149.0 -69.0
 &rst     iat =  1492,  1494,  1496,  1509,
   r1 = -150.0, r2 = -149.0, r3 = -69.0, r4 = -68.0,
 &end

# 100 HIS PSI:  (100 HID N)-(100 HID CA)-(100 HID C)-(101 TRP N)  83.0 163.0
 &rst     iat =  1494,  1496,  1509,  1511,
   r1 =  82.0, r2 =  83.0, r3 = 163.0, r4 = 164.0,
 &end

# 101 TRP CHI1:  (101 TRP N)-(101 TRP CA)-(101 TRP CB)-(101 TRP CG) -90.0 -30.0
 &rst     iat =  1511,  1513,  1515,  1518,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 104 ASP CHI1:  (104 ASP N)-(104 ASP CA)-(104 ASP CB)-(104 ASP CG) 150.0 210.0
 &rst     iat =  1562,  1564,  1566,  1569,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 105 ASP PHI:  (104 ASP C)-(105 ASP N)-(105 ASP CA)-(105 ASP C) -151.0 -51.0
 &rst     iat =  1572,  1574,  1576,  1584,
   r1 = -152.0, r2 = -151.0, r3 = -51.0, r4 = -50.0,
 &end

# 105 ASP PSI:  (105 ASP N)-(105 ASP CA)-(105 ASP C)-(106 PRO N)  71.0 171.0
 &rst     iat =  1574,  1576,  1584,  1586,
   r1 =  70.0, r2 =  71.0, r3 = 171.0, r4 = 172.0,
 &end

# 107 ALA PHI:  (106 PRO C)-(107 ALA N)-(107 ALA CA)-(107 ALA C) -125.0 -25.0
 &rst     iat =  1598,  1600,  1602,  1608,
   r1 = -126.0, r2 = -125.0, r3 = -25.0, r4 = -24.0,
 &end

# 107 ALA PSI:  (107 ALA N)-(107 ALA CA)-(107 ALA C)-(108 ARG N) -73.0  27.0
 &rst     iat =  1600,  1602,  1608,  1610,
   r1 = -74.0, r2 = -73.0, r3 =  27.0, r4 =  28.0,
 &end

# 108 ARG PHI:  (107 ALA C)-(108 ARG N)-(108 ARG CA)-(108 ARG C) -154.0 -54.0
 &rst     iat =  1608,  1610,  1612,  1632,
   r1 = -155.0, r2 = -154.0, r3 = -54.0, r4 = -53.0,
 &end

# 108 ARG PSI:  (108 ARG N)-(108 ARG CA)-(108 ARG C)-(109 ALA N) -47.0  53.0
 &rst     iat =  1610,  1612,  1632,  1634,
   r1 = -48.0, r2 = -47.0, r3 =  53.0, r4 =  54.0,
 &end

# 110 GLN PHI:  (109 ALA C)-(110 GLN N)-(110 GLN CA)-(110 GLN C) -163.0 -63.0
 &rst     iat =  1642,  1644,  1646,  1659,
   r1 = -164.0, r2 = -163.0, r3 = -63.0, r4 = -62.0,
 &end

# 110 GLN PSI:  (110 GLN N)-(110 GLN CA)-(110 GLN C)-(111 GLY N) 102.0 202.0
 &rst     iat =  1644,  1646,  1659,  1661,
   r1 = 101.0, r2 = 102.0, r3 = 202.0, r4 = 203.0,
 &end

# 113 GLU PHI:  (112 THR C)-(113 GLU N)-(113 GLU CA)-(113 GLU C) -102.0 -22.0
 &rst     iat =  1680,  1682,  1684,  1695,
   r1 = -103.0, r2 = -102.0, r3 = -22.0, r4 = -21.0,
 &end

# 113 GLU PSI:  (113 GLU N)-(113 GLU CA)-(113 GLU C)-(114 GLU N) -75.0   5.0
 &rst     iat =  1682,  1684,  1695,  1697,
   r1 = -76.0, r2 = -75.0, r3 =   5.0, r4 =   6.0,
 &end

# 114 GLU PHI:  (113 GLU C)-(114 GLU N)-(114 GLU CA)-(114 GLU C) -106.0 -26.0
 &rst     iat =  1695,  1697,  1699,  1710,
   r1 = -107.0, r2 = -106.0, r3 = -26.0, r4 = -25.0,
 &end

# 114 GLU PSI:  (114 GLU N)-(114 GLU CA)-(114 GLU C)-(115 GLU N) -74.0   6.0
 &rst     iat =  1697,  1699,  1710,  1712,
   r1 = -75.0, r2 = -74.0, r3 =   6.0, r4 =   7.0,
 &end

# 115 GLU PHI:  (114 GLU C)-(115 GLU N)-(115 GLU CA)-(115 GLU C) -107.0 -27.0
 &rst     iat =  1710,  1712,  1714,  1725,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 115 GLU PSI:  (115 GLU N)-(115 GLU CA)-(115 GLU C)-(116 LYS N) -78.0   2.0
 &rst     iat =  1712,  1714,  1725,  1727,
   r1 = -79.0, r2 = -78.0, r3 =   2.0, r4 =   3.0,
 &end

# 116 LYS PHI:  (115 GLU C)-(116 LYS N)-(116 LYS CA)-(116 LYS C) -112.0 -32.0
 &rst     iat =  1725,  1727,  1729,  1747,
   r1 = -113.0, r2 = -112.0, r3 = -32.0, r4 = -31.0,
 &end

# 116 LYS PSI:  (116 LYS N)-(116 LYS CA)-(116 LYS C)-(117 TRP N) -75.0   5.0
 &rst     iat =  1727,  1729,  1747,  1749,
   r1 = -76.0, r2 = -75.0, r3 =   5.0, r4 =   6.0,
 &end

# 117 TRP PHI:  (116 LYS C)-(117 TRP N)-(117 TRP CA)-(117 TRP C) -113.0 -33.0
 &rst     iat =  1747,  1749,  1751,  1771,
   r1 = -114.0, r2 = -113.0, r3 = -33.0, r4 = -32.0,
 &end

# 117 TRP PSI:  (117 TRP N)-(117 TRP CA)-(117 TRP C)-(118 ALA N) -72.0   8.0
 &rst     iat =  1749,  1751,  1771,  1773,
   r1 = -73.0, r2 = -72.0, r3 =   8.0, r4 =   9.0,
 &end

# 117 TRP CHI1:  (117 TRP N)-(117 TRP CA)-(117 TRP CB)-(117 TRP CG) 150.0 210.0
 &rst     iat =  1749,  1751,  1753,  1756,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 118 ALA PHI:  (117 TRP C)-(118 ALA N)-(118 ALA CA)-(118 ALA C) -109.0 -29.0
 &rst     iat =  1771,  1773,  1775,  1781,
   r1 = -110.0, r2 = -109.0, r3 = -29.0, r4 = -28.0,
 &end

# 118 ALA PSI:  (118 ALA N)-(118 ALA CA)-(118 ALA C)-(119 PHE N) -77.0   3.0
 &rst     iat =  1773,  1775,  1781,  1783,
   r1 = -78.0, r2 = -77.0, r3 =   3.0, r4 =   4.0,
 &end

# 119 PHE PHI:  (118 ALA C)-(119 PHE N)-(119 PHE CA)-(119 PHE C) -107.0 -27.0
 &rst     iat =  1781,  1783,  1785,  1801,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 119 PHE PSI:  (119 PHE N)-(119 PHE CA)-(119 PHE C)-(120 PHE N) -83.0  -3.0
 &rst     iat =  1783,  1785,  1801,  1803,
   r1 = -84.0, r2 = -83.0, r3 =  -3.0, r4 =  -2.0,
 &end

# 120 PHE PHI:  (119 PHE C)-(120 PHE N)-(120 PHE CA)-(120 PHE C) -107.0 -27.0
 &rst     iat =  1801,  1803,  1805,  1821,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 120 PHE PSI:  (120 PHE N)-(120 PHE CA)-(120 PHE C)-(121 GLN N) -82.0  -2.0
 &rst     iat =  1803,  1805,  1821,  1823,
   r1 = -83.0, r2 = -82.0, r3 =  -2.0, r4 =  -1.0,
 &end

# 121 GLN PHI:  (120 PHE C)-(121 GLN N)-(121 GLN CA)-(121 GLN C) -107.0 -27.0
 &rst     iat =  1821,  1823,  1825,  1838,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 121 GLN PSI:  (121 GLN N)-(121 GLN CA)-(121 GLN C)-(122 ARG N) -78.0   2.0
 &rst     iat =  1823,  1825,  1838,  1840,
   r1 = -79.0, r2 = -78.0, r3 =   2.0, r4 =   3.0,
 &end

# 122 ARG PHI:  (121 GLN C)-(122 ARG N)-(122 ARG CA)-(122 ARG C) -105.0 -25.0
 &rst     iat =  1838,  1840,  1842,  1862,
   r1 = -106.0, r2 = -105.0, r3 = -25.0, r4 = -24.0,
 &end

# 122 ARG PSI:  (122 ARG N)-(122 ARG CA)-(122 ARG C)-(123 VAL N) -77.0   3.0
 &rst     iat =  1840,  1842,  1862,  1864,
   r1 = -78.0, r2 = -77.0, r3 =   3.0, r4 =   4.0,
 &end

# 123 VAL PHI:  (122 ARG C)-(123 VAL N)-(123 VAL CA)-(123 VAL C) -107.0 -27.0
 &rst     iat =  1862,  1864,  1866,  1878,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 123 VAL PSI:  (123 VAL N)-(123 VAL CA)-(123 VAL C)-(124 ARG N) -83.0  -3.0
 &rst     iat =  1864,  1866,  1878,  1880,
   r1 = -84.0, r2 = -83.0, r3 =  -3.0, r4 =  -2.0,
 &end

# 123 VAL CHI1:  (123 VAL N)-(123 VAL CA)-(123 VAL CB)-(123 VAL CG1) 150.0 210.0
 &rst     iat =  1864,  1866,  1868,  1870,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 124 ARG PHI:  (123 VAL C)-(124 ARG N)-(124 ARG CA)-(124 ARG C) -103.0 -23.0
 &rst     iat =  1878,  1880,  1882,  1902,
   r1 = -104.0, r2 = -103.0, r3 = -23.0, r4 = -22.0,
 &end

# 124 ARG PSI:  (124 ARG N)-(124 ARG CA)-(124 ARG C)-(125 ASP N) -77.0   3.0
 &rst     iat =  1880,  1882,  1902,  1904,
   r1 = -78.0, r2 = -77.0, r3 =   3.0, r4 =   4.0,
 &end

# 125 ASP PHI:  (124 ARG C)-(125 ASP N)-(125 ASP CA)-(125 ASP C) -104.0 -24.0
 &rst     iat =  1902,  1904,  1906,  1914,
   r1 = -105.0, r2 = -104.0, r3 = -24.0, r4 = -23.0,
 &end

# 125 ASP PSI:  (125 ASP N)-(125 ASP CA)-(125 ASP C)-(126 GLU N) -84.0  -4.0
 &rst     iat =  1904,  1906,  1914,  1916,
   r1 = -85.0, r2 = -84.0, r3 =  -4.0, r4 =  -3.0,
 &end

# 125 ASP CHI1:  (125 ASP N)-(125 ASP CA)-(125 ASP CB)-(125 ASP CG) 150.0 210.0
 &rst     iat =  1904,  1906,  1908,  1911,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 126 GLU PHI:  (125 ASP C)-(126 GLU N)-(126 GLU CA)-(126 GLU C) -103.0 -23.0
 &rst     iat =  1914,  1916,  1918,  1929,
   r1 = -104.0, r2 = -103.0, r3 = -23.0, r4 = -22.0,
 &end

# 126 GLU PSI:  (126 GLU N)-(126 GLU CA)-(126 GLU C)-(127 ILE N) -83.0  -3.0
 &rst     iat =  1916,  1918,  1929,  1931,
   r1 = -84.0, r2 = -83.0, r3 =  -3.0, r4 =  -2.0,
 &end

# 127 ILE PHI:  (126 GLU C)-(127 ILE N)-(127 ILE CA)-(127 ILE C) -109.0 -29.0
 &rst     iat =  1929,  1931,  1933,  1948,
   r1 = -110.0, r2 = -109.0, r3 = -29.0, r4 = -28.0,
 &end

# 127 ILE PSI:  (127 ILE N)-(127 ILE CA)-(127 ILE C)-(128 GLY N) -75.0   5.0
 &rst     iat =  1931,  1933,  1948,  1950,
   r1 = -76.0, r2 = -75.0, r3 =   5.0, r4 =   6.0,
 &end

# 127 ILE CHI1:  (127 ILE N)-(127 ILE CA)-(127 ILE CB)-(127 ILE CG1) -90.0 -30.0
 &rst     iat =  1931,  1933,  1935,  1941,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 128 GLY PHI:  (127 ILE C)-(128 GLY N)-(128 GLY CA)-(128 GLY C) -106.0 -26.0
 &rst     iat =  1948,  1950,  1952,  1955,
   r1 = -107.0, r2 = -106.0, r3 = -26.0, r4 = -25.0,
 &end

# 128 GLY PSI:  (128 GLY N)-(128 GLY CA)-(128 GLY C)-(129 ASN N) -78.0   2.0
 &rst     iat =  1950,  1952,  1955,  1957,
   r1 = -79.0, r2 = -78.0, r3 =   2.0, r4 =   3.0,
 &end

# 132 LYS PHI:  (131 LEU C)-(132 LYS N)-(132 LYS CA)-(132 LYS C) -109.0 -29.0
 &rst     iat =  2012,  2014,  2016,  2034,
   r1 = -110.0, r2 = -109.0, r3 = -29.0, r4 = -28.0,
 &end

# 132 LYS PSI:  (132 LYS N)-(132 LYS CA)-(132 LYS C)-(133 GLU N) -74.0   6.0
 &rst     iat =  2014,  2016,  2034,  2036,
   r1 = -75.0, r2 = -74.0, r3 =   6.0, r4 =   7.0,
 &end

# 133 GLU PHI:  (132 LYS C)-(133 GLU N)-(133 GLU CA)-(133 GLU C) -104.0 -24.0
 &rst     iat =  2034,  2036,  2038,  2049,
   r1 = -105.0, r2 = -104.0, r3 = -24.0, r4 = -23.0,
 &end

# 133 GLU PSI:  (133 GLU N)-(133 GLU CA)-(133 GLU C)-(134 PHE N) -78.0   2.0
 &rst     iat =  2036,  2038,  2049,  2051,
   r1 = -79.0, r2 = -78.0, r3 =   2.0, r4 =   3.0,
 &end

# 134 PHE PHI:  (133 GLU C)-(134 PHE N)-(134 PHE CA)-(134 PHE C) -107.0 -27.0
 &rst     iat =  2049,  2051,  2053,  2069,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 134 PHE PSI:  (134 PHE N)-(134 PHE CA)-(134 PHE C)-(135 ALA N) -80.0   0.0
 &rst     iat =  2051,  2053,  2069,  2071,
   r1 = -81.0, r2 = -80.0, r3 =   0.0, r4 =   1.0,
 &end

# 135 ALA PHI:  (134 PHE C)-(135 ALA N)-(135 ALA CA)-(135 ALA C) -104.0 -24.0
 &rst     iat =  2069,  2071,  2073,  2079,
   r1 = -105.0, r2 = -104.0, r3 = -24.0, r4 = -23.0,
 &end

# 135 ALA PSI:  (135 ALA N)-(135 ALA CA)-(135 ALA C)-(136 GLU N) -78.0   2.0
 &rst     iat =  2071,  2073,  2079,  2081,
   r1 = -79.0, r2 = -78.0, r3 =   2.0, r4 =   3.0,
 &end

# 139 LYS CHI1:  (139 LYS N)-(139 LYS CA)-(139 LYS CB)-(139 LYS CG) -90.0 -30.0
 &rst     iat =  2117,  2119,  2121,  2124,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

#
# 33 LYS+ HN 4 LYS+ O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  70, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80, 
      rk2=40.0, rk3=40.0, ir6=1, ialtd=0,
 &end
#
# 6 ILE HN 33 LYS+ O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=  91, 530, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 35 TYR HN 6 ILE O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 108, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 8 PHE HN 35 TYR O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 131, 567, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 37 ALA HN 8 PHE O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 149, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 10 CYS HN 37 ALA O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 588, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 7 TYR HN 77 LEU O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 110,1168, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 79 VAL HN 7 TYR O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1186, 129, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 9 LEU HN 79 VAL O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 151,1200, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 78 VAL HN 97 LYS+ O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1170,1454, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 99 GLU- HN 78 VAL O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1480,1184, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 80 THR HN 99 GLU- O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1493, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 21 GLU- HN 17 SER O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 271, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 22 GLY HN 18 GLN O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 332, 288, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 23 TRP HN 19 MET O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 305, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 24 ALA HN 20 ALA O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 315, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 25 LYS+ HN 21 GLU- O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 373, 330, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 51 ALA HN 47 ASN O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 774, 724, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 52 MET HN 48 ALA O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 784, 734, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 53 LYS+ HN 49 VAL O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 801, 750, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 118 ALA HN 114 GLU- O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1774,1711, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 119 PHE HN 115 GLU- O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1784,1726, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 120 PHE HN 116 LYS+ O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1804,1748, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 121 GLN HN 117 TRP O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1824,1772, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 122 ARG+ HN 118 ALA O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1841,1782, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 123 VAL HN 119 PHE O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1865,1802, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 124 ARG+ HN 120 PHE O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1881,1822, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 125 ASP- HN 121 GLN O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1905,1839, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 126 GLU- HN 122 ARG+ O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1917,1863, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 127 ILE HN 123 VAL O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1932,1879, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 128 GLY HN 124 ARG+ O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1951,1903, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 129 ASN HN 125 ASP- O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1958,1915, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 130 ARG+ HN 126 GLU- O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1972,1930, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 131 LEU HN 127 ILE O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1996,1949, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 132 LYS+ HN 128 GLY O 1.5 2.3  
 &rst
  ixpk= 0, nxpk= 0, iat=2015,1956, r1= 1.00, r2= 1.50, r3= 2.30, r4= 2.80,  &end
#
# 33 LYS+ N 4 LYS+ O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 509,  70, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 6 ILE N 33 LYS+ O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=  90, 530, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 35 TYR N 6 ILE O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 547, 108, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 8 PHE N 35 TYR O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 130, 567, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 37 ALA N 8 PHE O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 579, 149, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 10 CYS N 37 ALA O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 588, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 7 TYR N 77 LEU O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 109,1168, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 79 VAL N 7 TYR O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1185, 129, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 9 LEU N 79 VAL O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 150,1200, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 78 VAL N 97 LYS+ O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1169,1454, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 99 GLU- N 78 VAL O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1479,1184, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 80 THR N 99 GLU- O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1201,1493, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 21 GLU- N 17 SER O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 271, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 22 GLY N 18 GLN O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 331, 288, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 23 TRP N 19 MET O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 305, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 24 ALA N 20 ALA O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 362, 315, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 25 LYS+ N 21 GLU- O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 372, 330, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 51 ALA N 47 ASN O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 773, 724, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 52 MET N 48 ALA O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 783, 734, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 53 LYS+ N 49 VAL O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat= 800, 750, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 118 ALA N 114 GLU- O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1773,1711, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 119 PHE N 115 GLU- O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1783,1726, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 120 PHE N 116 LYS+ O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1803,1748, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 121 GLN N 117 TRP O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1823,1772, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 122 ARG+ N 118 ALA O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1840,1782, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 123 VAL N 119 PHE O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1864,1802, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 124 ARG+ N 120 PHE O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1880,1822, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 125 ASP- N 121 GLN O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1904,1839, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 126 GLU- N 122 ARG+ O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1916,1863, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 127 ILE N 123 VAL O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1931,1879, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 128 GLY N 124 ARG+ O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1950,1903, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 129 ASN N 125 ASP- O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1957,1915, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 130 ARG+ N 126 GLU- O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1971,1930, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 131 LEU N 127 ILE O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=1995,1949, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 132 LYS+ N 128 GLY O 2.5 3.3  
 &rst
  ixpk= 0, nxpk= 0, iat=2014,1956, r1= 2.00, r2= 2.50, r3= 3.30, r4= 3.80,  &end
#
# 10 CYS HA 10 CYS HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 170, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
# 10 CYS HA 10 CYS QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 174, 175,
 &end
#
# 11 THR HN 10 CYS HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 181, 172, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 10 CYS HA 12 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 195, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 80 THR QG2 10 CYS HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1208,1209,1210,
 &end
#
# 10 CYS HA 81 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 172,1216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10 CYS HA 82 CYX HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 172,1235, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10 CYS QB 10 CYS HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 170, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 174, 175,
 &end
#
# 10 CYS HN 11 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 181, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 37 ALA HN 10 CYS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 170, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 37 ALA QB 10 CYS HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 170, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 584, 585, 586,
 &end
#
# 10 CYS HN 38 GLY QA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 170,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 592, 593,
 &end
#
# 10 CYS HN 39 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 597, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10 CYS HN 9 LEU HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 153, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 9 LEU HG 10 CYS HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158, 170, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 9 LEU HN 10 CYS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 151, 170, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9 LEU QB 10 CYS HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 170, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 155, 156,
 &end
#
# 9 LEU QQD 10 CYS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 170, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 10 CYS QB 11 THR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 181, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 174, 175,
 &end
#
# 10 CYS QB 12 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 195, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 174, 175,
 &end
#
# 10 CYS QB 17 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 174, 175,
 &end
#
# 17 SER QB 10 CYS QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 266, 267,
 igr2= 174, 175,
 &end
#
# 10 CYS QB 81 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 174, 175,
 &end
#
# 81 LEU QB 10 CYS QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1220,1221,
 igr2= 174, 175,
 &end
#
# 81 LEU QQD 10 CYS QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1225,1226,1227,1229,1230,1231,
 igr2= 174, 175,
 &end
#
# 100 HIS HA 100 HIS HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1497,1495, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 100 HIS QB 100 HIS HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1497, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1499,1500,
 &end
#
# 101 TRP HN 100 HIS HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1512,1497, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 100 HIS HA 102 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1497,1536, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100 HIS HA 79 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1497,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 80 THR HN 100 HIS HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1497, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 100 HIS HA 82 CYX HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1497,1235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100 HIS HA 99 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1497,1480, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100 HIS HE1 101 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1505,1512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100 HIS HE1 102 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1505,1536, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 100 HIS HE1 83 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1505,1245, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100 HIS QB 100 HIS HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1495, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1499,1500,
 &end
#
# 101 TRP HD1 100 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1520,1495, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 100 HIS HN 101 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1495,1522, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 101 TRP HN 100 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1512,1495, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 79 VAL QQG 100 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1495, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 99 GLU- HA 100 HIS HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1482,1495, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 99 GLU- QB 100 HIS HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1495, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1484,1485,
 &end
#
# 99 GLU- QG 100 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1495, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1487,1488,
 &end
#
# 100 HIS QB 101 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1499,1500,
 &end
#
# 100 HIS QB 80 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1499,1500,
 &end
#
# 101 TRP HA 101 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1514,1512, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 101 TRP HA 102 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1514,1536, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 101 TRP HD1 101 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1520,1512, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 101 TRP HD1 102 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1520,1536, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 TRP HZ2 101 TRP HE1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1525,1522, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 101 TRP QB 101 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1522, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1516,1517,
 &end
#
# 134 PHE QB 101 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1522, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2056,2057,
 &end
#
# 77 LEU QQD 101 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1522, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1160,1161,1162,1164,1165,1166,
 &end
#
# 79 VAL QQG 101 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1522, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 101 TRP HE1 99 GLU- HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=1522,1480, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 101 TRP HE1 99 GLU- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1522,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1484,1485,
 &end
#
# 99 GLU- QG 101 TRP HE1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1522, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1487,1488,
 &end
#
# 101 TRP HH2 131 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1527,1996, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 101 TRP HH2 131 LEU QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1527,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2000,2001,
 &end
#
# 101 TRP HH2 131 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1527,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2005,2006,2007,2009,2010,2011,
 &end
#
# 101 TRP HH2 132 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1527,2015, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 TRP HH2 134 PHE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1527,2054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 TRP QB 101 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1516,1517,
 &end
#
# 101 TRP HN 102 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1512,1536, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 102 GLY QA 101 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1538,1539,
 &end
#
# 79 VAL QQG 101 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 80 THR HA 101 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1204,1512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 80 THR HN 101 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1512, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 81 LEU HA 101 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1218,1512, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 81 LEU HG 101 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1223,1512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 99 GLU- QB 101 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1484,1485,
 &end
#
# 101 TRP HZ2 134 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1525,2052, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 TRP HZ2 77 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1525,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1160,1161,1162,1164,1165,1166,
 &end
#
# 101 TRP HZ2 99 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1525,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1487,1488,
 &end
#
# 101 TRP HZ3 130 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1529,1972, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 101 TRP QB 102 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1536, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1516,1517,
 &end
#
# 103 PHE HZ 101 TRP QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1555,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1516,1517,
 &end
#
# 101 TRP QB 79 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1516,1517,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 101 TRP QB 81 LEU HG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1223, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1516,1517,
 &end
#
# 101 TRP QB 81 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1516,1517,
 &end
#
# 102 GLY QA 102 GLY HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1536, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1538,1539,
 &end
#
# 81 LEU HA 102 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1218,1536, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 83 GLY QA 102 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1536, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1247,1248,
 &end
#
# 102 GLY QA 103 PHE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1538,1539,
 &end
#
# 102 GLY QA 83 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1538,1539,
 &end
#
# 102 GLY QA 83 GLY QA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1538,1539,
 igr2=1247,1248,
 &end
#
# 103 PHE HA 103 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1543, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 103 PHE HA 104 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1563, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 103 PHE HA 83 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1245, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 103 PHE QB 103 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1547,1548,
 &end
#
# 103 PHE HN 104 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1563, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 127 ILE QD1 103 PHE HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1945,1946,1947,
 &end
#
# 16 ARG+ QD 103 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 248, 249,
 &end
#
# 81 LEU HA 103 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1218,1543, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 81 LEU QB 103 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1220,1221,
 &end
#
# 103 PHE HN 83 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1543,1245, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 83 GLY QA 103 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1543, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1247,1248,
 &end
#
# 84 ASP- HN 103 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1543, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 103 PHE HZ 123 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1555,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 103 PHE HZ 127 ILE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1555,1934, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 103 PHE HZ 81 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1555,1223, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 103 PHE QB 104 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1563, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1547,1548,
 &end
#
# 103 PHE QB 123 VAL HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1547,1548,
 &end
#
# 103 PHE QB 123 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1547,1548,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 103 PHE QE 123 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1553,1557,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 104 ASP- HN 104 ASP- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1563,1565, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 104 ASP- QB 104 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1565, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1567,1568,
 &end
#
# 105 ASP- HN 104 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1575,1565, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 108 ARG+ QG 104 ASP- HA 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1565, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1618,1619,
 &end
#
# 104 ASP- HA 84 ASP- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1565,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1256,1257,
 &end
#
# 104 ASP- HA 85 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1565,1264, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 104 ASP- HN 104 ASP- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1563,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1567,1568,
 &end
#
# 104 ASP- HN 105 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1563,1575, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 104 ASP- HN 123 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1563,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 16 ARG+ QD 104 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1563, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 248, 249,
 &end
#
# 83 GLY HN 104 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1245,1563, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 83 GLY QA 104 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1563, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1247,1248,
 &end
#
# 104 ASP- QB 105 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1575, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1567,1568,
 &end
#
# 104 ASP- QB 123 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1567,1568,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 105 ASP- HA 105 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1577,1575, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 105 ASP- HA 105 ASP- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1577,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1579,1580,
 &end
#
# 106 PRO QD 105 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1588,1589,
 &end
#
# 105 ASP- HA 106 PRO QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1577,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1591,1592,
 &end
#
# 105 ASP- HA 107 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1577,1601, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 105 ASP- HA 108 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1577,1611, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ARG+ QD 105 ASP- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 248, 249,
 &end
#
# 16 ARG+ QG 105 ASP- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 245, 246,
 &end
#
# 105 ASP- QB 105 ASP- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1575, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1579,1580,
 &end
#
# 106 PRO QD 105 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1575, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1588,1589,
 &end
#
# 107 ALA HN 105 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1575, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 108 ARG+ HN 105 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1611,1575, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 108 ARG+ QB 105 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1575, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1615,1616,
 &end
#
# 108 ARG+ QD 105 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1575, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1621,1622,
 &end
#
# 108 ARG+ QG 105 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1575, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1618,1619,
 &end
#
# 105 ASP- HN 83 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1575,1245, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 105 ASP- HN 84 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1575,1252, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 105 ASP- HN 84 ASP- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1575,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1256,1257,
 &end
#
# 105 ASP- QB 107 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1579,1580,
 &end
#
# 105 ASP- QB 108 ARG+ QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1579,1580,
 igr2=1618,1619,
 &end
#
# 105 ASP- QB 15 CYS HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 227, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1579,1580,
 &end
#
# 83 GLY HN 105 ASP- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1245,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1579,1580,
 &end
#
# 105 ASP- QB 84 ASP- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1579,1580,
 igr2=1256,1257,
 &end
#
# 106 PRO QB 106 PRO HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1597, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1594,1595,
 &end
#
# 106 PRO HA 107 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1597,1601, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 108 ARG+ HN 106 PRO HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1611,1597, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 109 ALA HN 106 PRO HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1635,1597, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 109 ALA QB 106 PRO HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1597, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1639,1640,1641,
 &end
#
# 106 PRO HA 123 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1597,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 106 PRO QG 106 PRO QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1591,1592,
 igr2=1594,1595,
 &end
#
# 106 PRO QB 107 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1594,1595,
 &end
#
# 108 ARG+ HN 106 PRO QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1611,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1594,1595,
 &end
#
# 106 PRO QB 109 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1594,1595,
 igr2=1639,1640,1641,
 &end
#
# 106 PRO QB 119 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1784, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1594,1595,
 &end
#
# 106 PRO QB 119 PHE QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1594,1595,
 igr2=1788,1789,
 &end
#
# 106 PRO QB 120 PHE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1806, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1594,1595,
 &end
#
# 106 PRO QB 120 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1804, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1594,1595,
 &end
#
# 106 PRO QB 122 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1841, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1594,1595,
 &end
#
# 106 PRO QB 123 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1594,1595,
 &end
#
# 47 ASN QD2 106 PRO QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 721, 722,
 igr2=1594,1595,
 &end
#
# 106 PRO QD 106 PRO QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1588,1589,
 igr2=1591,1592,
 &end
#
# 107 ALA HN 106 PRO QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1588,1589,
 &end
#
# 106 PRO QD 123 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1588,1589,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 106 PRO QG 107 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1591,1592,
 &end
#
# 106 PRO QG 120 PHE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1806, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1591,1592,
 &end
#
# 106 PRO QG 122 ARG+ HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1841, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1591,1592,
 &end
#
# 106 PRO QG 123 VAL HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1869, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1591,1592,
 &end
#
# 106 PRO QG 123 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1591,1592,
 &end
#
# 106 PRO QG 123 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1591,1592,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 106 PRO QG 16 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1591,1592,
 &end
#
# 19 MET QG 106 PRO QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 297, 298,
 igr2=1591,1592,
 &end
#
# 107 ALA HN 107 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1603, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 107 ALA HA 107 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1603,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1605,1606,1607,
 &end
#
# 108 ARG+ HN 107 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1611,1603, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 107 ALA HA 109 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1603,1635, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 107 ALA HA 116 LYS+ QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1603,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1735,1736,
 &end
#
# 120 PHE HZ 107 ALA HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1816,1603, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 107 ALA HA 45 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1603,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 693, 694,
 &end
#
# 47 ASN QD2 107 ALA HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1603, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 721, 722,
 &end
#
# 107 ALA HN 107 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1605,1606,1607,
 &end
#
# 107 ALA HN 108 ARG+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1611, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 107 ALA HN 109 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1635, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 109 ALA QB 107 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1601, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1639,1640,1641,
 &end
#
# 120 PHE HZ 107 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1816,1601, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 15 CYS QB 107 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 231, 232,
 &end
#
# 45 ASN QD2 107 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 693, 694,
 &end
#
# 107 ALA QB 108 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1611, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1605,1606,1607,
 &end
#
# 108 ARG+ QB 107 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1615,1616,
 igr2=1605,1606,1607,
 &end
#
# 109 ALA HN 107 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1605,1606,1607,
 &end
#
# 120 PHE HZ 107 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1816,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1605,1606,1607,
 &end
#
# 45 ASN QD2 107 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 693, 694,
 igr2=1605,1606,1607,
 &end
#
# 108 ARG+ HN 108 ARG+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1611,1613, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 108 ARG+ HA 108 ARG+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1613,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1615,1616,
 &end
#
# 108 ARG+ QD 108 ARG+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1613, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1621,1622,
 &end
#
# 108 ARG+ HA 108 ARG+ QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1613,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1618,1619,
 &end
#
# 109 ALA HN 108 ARG+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1635,1613, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 108 ARG+ HA 110 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1613,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1657,1658,
 &end
#
# 108 ARG+ QB 108 ARG+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1611, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1615,1616,
 &end
#
# 108 ARG+ HN 108 ARG+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1611,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1621,1622,
 &end
#
# 108 ARG+ QG 108 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1611, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1618,1619,
 &end
#
# 109 ALA HA 108 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1637,1611, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 108 ARG+ HN 109 ALA HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1611,1635, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 108 ARG+ HN 110 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1611,1645, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 116 LYS+ QE 108 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1611, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1741,1742,
 &end
#
# 108 ARG+ HN 119 PHE QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1611,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1788,1789,
 &end
#
# 108 ARG+ QB 108 ARG+ QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1615,1616,
 igr2=1621,1622,
 &end
#
# 108 ARG+ QB 108 ARG+ QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1615,1616,
 igr2=1618,1619,
 &end
#
# 108 ARG+ QB 109 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1635, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1615,1616,
 &end
#
# 108 ARG+ QB 110 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1615,1616,
 igr2=1657,1658,
 &end
#
# 108 ARG+ QD 108 ARG+ QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1621,1622,
 igr2=1618,1619,
 &end
#
# 108 ARG+ QD 86 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1621,1622,
 &end
#
# 108 ARG+ QD 86 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1621,1622,
 igr2=1278,1279,1280,
 &end
#
# 108 ARG+ QG 109 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1635, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1618,1619,
 &end
#
# 109 ALA QB 108 ARG+ QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1639,1640,1641,
 igr2=1618,1619,
 &end
#
# 109 ALA HN 109 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1635,1637, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 109 ALA HA 109 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1637,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1639,1640,1641,
 &end
#
# 110 GLN HN 109 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1645,1637, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 109 ALA HA 110 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1657,1658,
 &end
#
# 109 ALA HA 110 GLN QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1652,1653,
 &end
#
# 116 LYS+ HA 109 ALA HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1637, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 109 ALA HN 109 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1639,1640,1641,
 &end
#
# 109 ALA HN 110 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1635,1645, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 LYS+ HA 109 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1635, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 LYS+ QG 109 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1735,1736,
 &end
#
# 119 PHE QB 109 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1788,1789,
 &end
#
# 110 GLN HN 109 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1645,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1639,1640,1641,
 &end
#
# 109 ALA QB 116 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1730, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1639,1640,1641,
 &end
#
# 109 ALA QB 116 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1728, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1639,1640,1641,
 &end
#
# 109 ALA QB 116 LYS+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1639,1640,1641,
 igr2=1738,1739,
 &end
#
# 116 LYS+ QG 109 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1735,1736,
 igr2=1639,1640,1641,
 &end
#
# 109 ALA QB 118 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1774, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1639,1640,1641,
 &end
#
# 109 ALA QB 119 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1784, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1639,1640,1641,
 &end
#
# 119 PHE QB 109 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1788,1789,
 igr2=1639,1640,1641,
 &end
#
# 109 ALA QB 120 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1804, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1639,1640,1641,
 &end
#
# 11 THR HA 11 THR HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 183, 181, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 11 THR QG2 11 THR HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 187, 188, 189,
 &end
#
# 12 GLY HN 11 THR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 183, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 39 ILE HB 11 THR HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 183, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 11 THR HA 39 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 183, 597, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 11 THR HA 39 ILE QD1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 610, 611, 612,
 &end
#
# 11 THR HA 39 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 603, 604, 605,
 &end
#
# 11 THR HA 40 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 183, 616, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 THR HA 88 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 183,1296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 89 CYX HA 11 THR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1320, 183, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 11 THR HB 11 THR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 185, 181, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 11 THR HB 11 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 185,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 187, 188, 189,
 &end
#
# 12 GLY HN 11 THR HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 185, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 11 THR HB 40 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 185,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 623, 624,
 &end
#
# 11 THR HN 11 THR QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 187, 188, 189,
 &end
#
# 11 THR HN 12 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 181, 195, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 17 SER HG 11 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 181, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 GLY QA 11 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 181, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 592, 593,
 &end
#
# 39 ILE HN 11 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 597, 181, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 82 CYX QB 11 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 181, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1239,1240,
 &end
#
# 90 PRO QD 11 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 181, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1329,1330,
 &end
#
# 11 THR QG2 12 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 195, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 187, 188, 189,
 &end
#
# 12 GLY QA 11 THR QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 197, 198,
 igr2= 187, 188, 189,
 &end
#
# 11 THR QG2 39 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 187, 188, 189,
 &end
#
# 39 ILE QD1 11 THR QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 610, 611, 612,
 igr2= 187, 188, 189,
 &end
#
# 11 THR QG2 39 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 187, 188, 189,
 igr2= 603, 604, 605,
 &end
#
# 11 THR QG2 82 CYX QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 187, 188, 189,
 igr2=1239,1240,
 &end
#
# 11 THR QG2 87 ASP- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1286, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 187, 188, 189,
 &end
#
# 11 THR QG2 87 ASP- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 187, 188, 189,
 igr2=1288,1289,
 &end
#
# 88 LYS+ HA 11 THR QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1298,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 187, 188, 189,
 &end
#
# 88 LYS+ HN 11 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 187, 188, 189,
 &end
#
# 88 LYS+ QB 11 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1300,1301,
 igr2= 187, 188, 189,
 &end
#
# 89 CYX HA 11 THR QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1320,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 187, 188, 189,
 &end
#
# 110 GLN HN 110 GLN HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1645,1647, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 110 GLN HA 110 GLN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1647,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1649,1650,
 &end
#
# 110 GLN HA 110 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1647,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1657,1658,
 &end
#
# 110 GLN HA 110 GLN QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1647,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1652,1653,
 &end
#
# 110 GLN HA 111 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1647,1662, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 110 GLN HA 112 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1647,1669, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 116 LYS+ QE 110 GLN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1647, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1741,1742,
 &end
#
# 116 LYS+ QG 110 GLN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1647, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1735,1736,
 &end
#
# 110 GLN HN 110 GLN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1645,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1649,1650,
 &end
#
# 110 GLN HN 110 GLN QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1645,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1652,1653,
 &end
#
# 110 GLN HN 111 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1645,1662, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 110 GLN QB 110 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1649,1650,
 igr2=1657,1658,
 &end
#
# 110 GLN QB 110 GLN QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1649,1650,
 igr2=1652,1653,
 &end
#
# 111 GLY HN 110 GLN QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1649,1650,
 &end
#
# 110 GLN QG 110 GLN QE2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1652,1653,
 igr2=1657,1658,
 &end
#
# 111 GLY HN 110 GLN QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1652,1653,
 &end
#
# 111 GLY HN 111 GLY QA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1664,1665,
 &end
#
# 111 GLY HN 112 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1662,1669, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 LYS+ QD 111 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1662, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1738,1739,
 &end
#
# 116 LYS+ QE 111 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1662, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1741,1742,
 &end
#
# 112 THR HN 111 GLY QA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1664,1665,
 &end
#
# 111 GLY QA 112 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1664,1665,
 igr2=1675,1676,1677,
 &end
#
# 115 GLU- QB 111 GLY QA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1717,1718,
 igr2=1664,1665,
 &end
#
# 112 THR HA 112 THR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1671,1669, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 112 THR HA 112 THR QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1671,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1675,1676,1677,
 &end
#
# 113 GLU- HN 112 THR HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1683,1671, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 112 THR HA 113 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1671,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1690,1691,
 &end
#
# 112 THR HA 114 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1671,1698, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 112 THR HA 115 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1671,1713, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 112 THR HA 116 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1671,1728, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 112 THR HA 116 LYS+ QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1671,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1732,1733,
 &end
#
# 112 THR HB 112 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1673,1669, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 112 THR HB 113 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1673,1683, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 112 THR HN 112 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1675,1676,1677,
 &end
#
# 113 GLU- HN 112 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1683,1669, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 115 GLU- HA 112 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1715,1669, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 115 GLU- HN 112 THR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1713,1669, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 115 GLU- QB 112 THR HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1669, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1717,1718,
 &end
#
# 112 THR HN 115 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1669,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1720,1721,
 &end
#
# 116 LYS+ HN 112 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1728,1669, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 113 GLU- HN 112 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1683,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1675,1676,1677,
 &end
#
# 115 GLU- HN 112 THR QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1713,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1675,1676,1677,
 &end
#
# 113 GLU- HN 113 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1683,1685, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 113 GLU- HA 113 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1685,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1687,1688,
 &end
#
# 113 GLU- HA 113 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1685,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1690,1691,
 &end
#
# 113 GLU- HA 114 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1685,1698, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 113 GLU- HA 115 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1685,1713, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 113 GLU- HA 116 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1685,1728, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 113 GLU- HA 116 LYS+ QD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1685,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1738,1739,
 &end
#
# 116 LYS+ QE 113 GLU- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1741,1742,
 &end
#
# 117 TRP HN 113 GLU- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1750,1685, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 113 GLU- HN 113 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1683,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1687,1688,
 &end
#
# 113 GLU- HN 113 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1683,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1690,1691,
 &end
#
# 113 GLU- HN 114 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1683,1698, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 115 GLU- HN 113 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1713,1683, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 LYS+ HN 113 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1728,1683, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 116 LYS+ QB 113 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1683, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1732,1733,
 &end
#
# 113 GLU- QB 113 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1687,1688,
 igr2=1690,1691,
 &end
#
# 116 LYS+ QD 113 GLU- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1738,1739,
 igr2=1687,1688,
 &end
#
# 113 GLU- QB 117 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1687,1688,
 &end
#
# 114 GLU- HN 113 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1690,1691,
 &end
#
# 114 GLU- HN 114 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1698,1700, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 114 GLU- HA 114 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1702,1703,
 &end
#
# 114 GLU- QG 114 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1705,1706,
 &end
#
# 114 GLU- HA 115 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1700,1713, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 117 TRP HD1 114 GLU- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1758,1700, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 117 TRP HN 114 GLU- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1750,1700, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 117 TRP QB 114 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1754,1755,
 &end
#
# 114 GLU- HN 114 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1702,1703,
 &end
#
# 115 GLU- HA 114 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1715,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 115 GLU- HN 114 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1713,1698, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 116 LYS+ HN 114 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1728,1698, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 LYS+ QB 114 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1732,1733,
 &end
#
# 117 TRP HN 114 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1750,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP QB 114 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1754,1755,
 &end
#
# 115 GLU- HN 114 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1713,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1702,1703,
 &end
#
# 115 GLU- HA 115 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1715,1713, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 115 GLU- QB 115 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1717,1718,
 &end
#
# 115 GLU- HA 115 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1720,1721,
 &end
#
# 115 GLU- HA 116 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1715,1728, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 115 GLU- HA 117 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1715,1750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 115 GLU- HA 118 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1715,1774, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 115 GLU- HA 118 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1778,1779,1780,
 &end
#
# 115 GLU- QB 115 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1713, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1717,1718,
 &end
#
# 115 GLU- HN 115 GLU- QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1713,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1720,1721,
 &end
#
# 116 LYS+ HN 115 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1728,1713, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 117 TRP HN 115 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1750,1713, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 117 TRP QB 115 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1713, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1754,1755,
 &end
#
# 115 GLU- QB 116 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1728, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1717,1718,
 &end
#
# 115 GLU- QB 117 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1717,1718,
 &end
#
# 115 GLU- QG 116 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1728, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1720,1721,
 &end
#
# 116 LYS+ HA 116 LYS+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1728, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 116 LYS+ QG 116 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1730, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1735,1736,
 &end
#
# 116 LYS+ HA 117 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1750, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 LYS+ HA 118 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1774, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 119 PHE HN 116 LYS+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1784,1730, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 LYS+ HA 119 PHE QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1730,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1788,1789,
 &end
#
# 116 LYS+ HA 120 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1730,1804, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 116 LYS+ QB 116 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1728, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1732,1733,
 &end
#
# 116 LYS+ HN 116 LYS+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1728,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1738,1739,
 &end
#
# 116 LYS+ QE 116 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1728, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1741,1742,
 &end
#
# 116 LYS+ QG 116 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1728, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1735,1736,
 &end
#
# 117 TRP HA 116 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1752,1728, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 116 LYS+ HN 117 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1728,1750, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 116 LYS+ HN 118 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1728,1774, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 119 PHE QB 116 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1728, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1788,1789,
 &end
#
# 116 LYS+ QE 116 LYS+ QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1741,1742,
 igr2=1732,1733,
 &end
#
# 117 TRP HN 116 LYS+ QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1732,1733,
 &end
#
# 116 LYS+ QB 118 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1774, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1732,1733,
 &end
#
# 116 LYS+ QE 116 LYS+ QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1741,1742,
 igr2=1738,1739,
 &end
#
# 117 TRP HE3 117 TRP HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1769,1752, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 117 TRP HA 117 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1752,1750, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 117 TRP QB 117 TRP HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1752, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1754,1755,
 &end
#
# 117 TRP HA 118 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1752,1774, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 117 TRP HA 119 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1752,1784, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 117 TRP HA 120 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1752,1804, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 117 TRP HA 120 PHE QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1808,1809,
 &end
#
# 117 TRP HA 121 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1752,1824, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 47 ASN QB 117 TRP HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1752, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 716, 717,
 &end
#
# 47 ASN QD2 117 TRP HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1752, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 721, 722,
 &end
#
# 117 TRP HD1 117 TRP HE1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1758,1760, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 117 TRP HD1 117 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1758,1750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP HD1 118 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1758,1774, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 117 TRP QB 117 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1760, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1754,1755,
 &end
#
# 118 ALA HA 117 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1776,1760, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP HE1 118 ALA HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=1760,1774, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 118 ALA QB 117 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1760, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1778,1779,1780,
 &end
#
# 117 TRP HE3 120 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1769,1804, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP HE3 121 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1769,1824, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP HH2 51 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1765, 774, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP HN 117 TRP QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1754,1755,
 &end
#
# 118 ALA HA 117 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1776,1750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP HN 118 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1750,1774, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 117 TRP HN 119 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1750,1784, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 120 PHE HN 117 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1804,1750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP HZ3 121 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1767,1824, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP HZ3 50 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1767, 752, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 117 TRP HZ3 51 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1767, 776, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 117 TRP HZ3 51 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1767, 774, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 117 TRP HZ3 51 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1767,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 778, 779, 780,
 &end
#
# 117 TRP HZ3 52 MET HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1767, 784, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 TRP QB 118 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1774, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1754,1755,
 &end
#
# 117 TRP QB 118 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1754,1755,
 igr2=1778,1779,1780,
 &end
#
# 117 TRP QB 119 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1784, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1754,1755,
 &end
#
# 118 ALA HN 118 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1774,1776, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 118 ALA HA 118 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1776,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1778,1779,1780,
 &end
#
# 118 ALA HA 119 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1776,1784, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 120 PHE HN 118 ALA HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1804,1776, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 121 GLN QB 118 ALA HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1776, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1828,1829,
 &end
#
# 118 ALA HA 122 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1776,1841, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 118 ALA HA 122 ARG+ QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1776,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1848,1849,
 &end
#
# 118 ALA HN 118 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1774,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1778,1779,1780,
 &end
#
# 119 PHE HN 118 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1784,1774, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 118 ALA HN 120 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1774,1804, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 118 ALA QB 119 PHE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1784, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1778,1779,1780,
 &end
#
# 121 GLN QE2 118 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1836,1837,
 igr2=1778,1779,1780,
 &end
#
# 119 PHE HA 119 PHE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1786,1784, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 119 PHE HA 119 PHE QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1788,1789,
 &end
#
# 119 PHE HA 120 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1786,1804, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 119 PHE HA 122 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1786,1841, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 122 ARG+ QB 119 PHE HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1845,1846,
 &end
#
# 122 ARG+ QG 119 PHE HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1848,1849,
 &end
#
# 119 PHE HA 123 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1786,1865, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 119 PHE HN 119 PHE QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1784,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1788,1789,
 &end
#
# 120 PHE HA 119 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1784, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 119 PHE HN 120 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1784,1804, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 120 PHE HN 119 PHE QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1804,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1788,1789,
 &end
#
# 119 PHE QB 123 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1788,1789,
 &end
#
# 12 GLY QA 12 GLY HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 195, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 197, 198,
 &end
#
# 13 ASN HN 12 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 195, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17 SER HG 12 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 195, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 GLY QA 12 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 195, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 592, 593,
 &end
#
# 39 ILE HN 12 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 597, 195, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 40 GLU- HN 12 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 616, 195, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 12 GLY QA 13 ASN HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 197, 198,
 &end
#
# 12 GLY QA 39 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 197, 198,
 &end
#
# 12 GLY QA 40 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 197, 198,
 &end
#
# 120 PHE HA 120 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1804, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 120 PHE HA 120 PHE QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1806,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1808,1809,
 &end
#
# 120 PHE HA 121 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1824, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 120 PHE HA 122 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 123 VAL HB 120 PHE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1869,1806, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 120 PHE HA 123 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1865, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 120 PHE HA 124 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1806,1881, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 120 PHE QB 120 PHE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1804, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1808,1809,
 &end
#
# 121 GLN HN 120 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1824,1804, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 120 PHE HZ 45 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1816,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 693, 694,
 &end
#
# 120 PHE HZ 47 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1816, 712, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 120 PHE HZ 47 ASN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1816,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 716, 717,
 &end
#
# 120 PHE HZ 48 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1816, 726, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 120 PHE HZ 48 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1816,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 730, 731, 732,
 &end
#
# 120 PHE QB 121 GLN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1808,1809,
 &end
#
# 121 GLN QB 120 PHE QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1828,1829,
 igr2=1808,1809,
 &end
#
# 120 PHE QB 121 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1808,1809,
 igr2=1836,1837,
 &end
#
# 120 PHE QB 51 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1808,1809,
 igr2= 778, 779, 780,
 &end
#
# 120 PHE QE 47 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1814,1818,
 &end
#
# 120 PHE QE 48 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 726, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1814,1818,
 &end
#
# 121 GLN HN 121 GLN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1824,1826, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 121 GLN QB 121 GLN HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1826, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1828,1829,
 &end
#
# 121 GLN HA 121 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1826,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1836,1837,
 &end
#
# 121 GLN HA 122 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1826,1841, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 121 GLN HA 124 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1826,1881, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 124 ARG+ QD 121 GLN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1826, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QG 121 GLN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1826, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1888,1889,
 &end
#
# 121 GLN HA 125 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1826,1905, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23 TRP HZ2 121 GLN HA 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 352,1826, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 51 ALA QB 121 GLN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1826, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 778, 779, 780,
 &end
#
# 121 GLN QB 121 GLN HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1828,1829,
 &end
#
# 121 GLN HN 121 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1836,1837,
 &end
#
# 121 GLN HN 122 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1824,1841, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 121 GLN HN 123 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1824,1865, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 121 GLN QB 121 GLN QE2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1828,1829,
 igr2=1836,1837,
 &end
#
# 121 GLN QB 122 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1841, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1828,1829,
 &end
#
# 121 GLN QB 125 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1905, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1828,1829,
 &end
#
# 121 GLN QG 121 GLN QE2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1831,1832,
 igr2=1836,1837,
 &end
#
# 50 LYS+ QB 121 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 756, 757,
 igr2=1836,1837,
 &end
#
# 54 GLU- QB 121 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 827, 828,
 igr2=1836,1837,
 &end
#
# 121 GLN QG 125 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1905, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1831,1832,
 &end
#
# 122 ARG+ HA 122 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1843,1841, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 122 ARG+ QB 122 ARG+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1843, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1845,1846,
 &end
#
# 122 ARG+ HA 122 ARG+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1843,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1851,1852,
 &end
#
# 122 ARG+ HA 122 ARG+ QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1843,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1848,1849,
 &end
#
# 122 ARG+ HA 123 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1843,1865, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 122 ARG+ HA 124 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1843,1881, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 122 ARG+ HA 125 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1843,1905, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 122 ARG+ HA 125 ASP- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1843,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1909,1910,
 &end
#
# 122 ARG+ QD 122 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1841, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1851,1852,
 &end
#
# 122 ARG+ QG 122 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1841, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1848,1849,
 &end
#
# 123 VAL HN 122 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1865,1841, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 122 ARG+ HN 124 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1841,1881, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 125 ASP- HN 122 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1905,1841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 122 ARG+ QB 122 ARG+ QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1845,1846,
 igr2=1851,1852,
 &end
#
# 123 VAL HN 122 ARG+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1865,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1845,1846,
 &end
#
# 122 ARG+ QD 122 ARG+ QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1851,1852,
 igr2=1848,1849,
 &end
#
# 122 ARG+ QD 125 ASP- QB 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1851,1852,
 igr2=1909,1910,
 &end
#
# 123 VAL HN 122 ARG+ QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1865,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1848,1849,
 &end
#
# 123 VAL HA 123 VAL HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1867,1869, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 123 VAL HA 123 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1867,1865, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 123 VAL HA 123 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 123 VAL HA 124 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1867,1881, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 123 VAL HA 125 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1867,1905, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 126 GLU- HA 123 VAL HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1919,1867, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 123 VAL HA 126 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1867,1917, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 126 GLU- QB 123 VAL HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1921,1922,
 &end
#
# 123 VAL HA 126 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1924,1925,
 &end
#
# 123 VAL HA 127 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1867,1932, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 123 VAL HB 123 VAL HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1869,1865, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 123 VAL HB 123 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1869,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 123 VAL HB 124 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1869,1881, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 123 VAL HN 123 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1865,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 126 GLU- QB 123 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1921,1922,
 &end
#
# 125 ASP- HN 123 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1905,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 127 ILE QG1 123 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1942,1943,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 16 ARG+ QD 123 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 248, 249,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 19 MET QB 123 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 294, 295,
 igr2=1871,1872,1873,1875,1876,1877,
 &end
#
# 124 ARG+ HN 124 ARG+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1881,1883, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 124 ARG+ QB 124 ARG+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1883, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1885,1886,
 &end
#
# 124 ARG+ QD 124 ARG+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1883, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QG 124 ARG+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1883, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1888,1889,
 &end
#
# 124 ARG+ HA 125 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1883,1905, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 124 ARG+ HA 127 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1883,1932, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19 MET QB 124 ARG+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1883, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 294, 295,
 &end
#
# 124 ARG+ HA 23 TRP HE1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1883, 349, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 124 ARG+ QB 124 ARG+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1881, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1885,1886,
 &end
#
# 124 ARG+ QD 124 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1881, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QG 124 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1881, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1888,1889,
 &end
#
# 124 ARG+ HN 125 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1881,1905, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 126 GLU- HN 124 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1917,1881, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 MET QB 124 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1881, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 294, 295,
 &end
#
# 19 MET QE 124 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1881, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 301, 302, 303,
 &end
#
# 23 TRP HE1 124 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 349,1881, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 51 ALA QB 124 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1881, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 778, 779, 780,
 &end
#
# 124 ARG+ QB 125 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1905, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1885,1886,
 &end
#
# 124 ARG+ QB 51 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1885,1886,
 igr2= 778, 779, 780,
 &end
#
# 124 ARG+ QD 125 ASP- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1907, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QD 125 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1905, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QD 23 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QD 51 ALA HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 774, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QD 51 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1891,1892,
 igr2= 778, 779, 780,
 &end
#
# 124 ARG+ QD 52 MET HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 784, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QD 54 GLU- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QD 54 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 823, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1891,1892,
 &end
#
# 124 ARG+ QD 55 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1891,1892,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 124 ARG+ QG 125 ASP- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1907, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1888,1889,
 &end
#
# 124 ARG+ QG 125 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1905, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1888,1889,
 &end
#
# 124 ARG+ QG 23 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1888,1889,
 &end
#
# 124 ARG+ QG 55 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1888,1889,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 125 ASP- HN 125 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1905,1907, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 125 ASP- HA 125 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1907,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1909,1910,
 &end
#
# 126 GLU- HN 125 ASP- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1917,1907, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 125 ASP- HA 127 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1907,1932, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 125 ASP- HA 128 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1907,1951, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 128 GLY QA 125 ASP- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1907, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1953,1954,
 &end
#
# 125 ASP- HA 129 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1907,1958, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 125 ASP- HA 129 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1907,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1967,1968,
 &end
#
# 23 TRP HE1 125 ASP- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 349,1907, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 TRP HH2 125 ASP- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 354,1907, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23 TRP HZ2 125 ASP- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 352,1907, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 125 ASP- HN 125 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1905,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1909,1910,
 &end
#
# 126 GLU- HN 125 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1917,1905, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 128 GLY HN 125 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1951,1905, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 TRP HE1 125 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 349,1905, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 TRP HZ2 125 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 352,1905, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 51 ALA QB 125 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1905, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 778, 779, 780,
 &end
#
# 125 ASP- QB 126 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1917, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1909,1910,
 &end
#
# 126 GLU- QB 125 ASP- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1921,1922,
 igr2=1909,1910,
 &end
#
# 125 ASP- QB 129 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1958, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1909,1910,
 &end
#
# 125 ASP- QB 129 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1909,1910,
 igr2=1967,1968,
 &end
#
# 126 GLU- HN 126 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1917,1919, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 126 GLU- QB 126 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1919, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1921,1922,
 &end
#
# 126 GLU- HA 126 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1919,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1924,1925,
 &end
#
# 126 GLU- HA 127 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1919,1932, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 126 GLU- HA 128 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1919,1951, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 126 GLU- HA 129 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1919,1958, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 126 GLU- HA 129 ASN QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1919,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1962,1963,
 &end
#
# 129 ASN QD2 126 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1919, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1967,1968,
 &end
#
# 126 GLU- HA 130 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1919,1972, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 126 GLU- QB 126 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1917, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1921,1922,
 &end
#
# 126 GLU- HN 126 GLU- QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1924,1925,
 &end
#
# 127 ILE HA 126 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1934,1917, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 126 GLU- HN 127 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1917,1932, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 127 ILE QG1 126 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1917, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1942,1943,
 &end
#
# 128 GLY HN 126 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1951,1917, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 126 GLU- HN 129 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1917,1958, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 129 ASN QD2 126 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1917, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1967,1968,
 &end
#
# 126 GLU- QB 126 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1921,1922,
 igr2=1924,1925,
 &end
#
# 126 GLU- QB 127 ILE HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1921,1922,
 &end
#
# 126 GLU- QB 127 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1932, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1921,1922,
 &end
#
# 126 GLU- QB 128 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1921,1922,
 &end
#
# 127 ILE HN 126 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1924,1925,
 &end
#
# 127 ILE HB 127 ILE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1936,1934, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 127 ILE HA 127 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1934,1932, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 127 ILE QG1 127 ILE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1934, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1942,1943,
 &end
#
# 127 ILE HA 128 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1934,1951, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 127 ILE HA 129 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1934,1958, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 127 ILE HA 130 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1934,1972, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 130 ARG+ QB 127 ILE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1934, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1976,1977,
 &end
#
# 127 ILE HN 127 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1932,1936, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 127 ILE QG1 127 ILE HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1942,1943,
 &end
#
# 127 ILE HB 127 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1938,1939,1940,
 &end
#
# 128 GLY HN 127 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1951,1936, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 127 ILE HB 23 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1936, 349, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 127 ILE QG1 127 ILE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1932, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1942,1943,
 &end
#
# 127 ILE HN 127 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1938,1939,1940,
 &end
#
# 127 ILE HN 128 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1932,1951, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 130 ARG+ HN 127 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1972,1932, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 127 ILE HN 23 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1932, 349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 127 ILE QG1 127 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1942,1943,
 igr2=1945,1946,1947,
 &end
#
# 20 ALA HN 127 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1945,1946,1947,
 &end
#
# 127 ILE QD1 21 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1945,1946,1947,
 &end
#
# 127 ILE QD1 81 LEU HG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1223, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1945,1946,1947,
 &end
#
# 127 ILE QG1 128 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1942,1943,
 &end
#
# 128 GLY HN 127 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1938,1939,1940,
 &end
#
# 130 ARG+ HN 127 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1972,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1938,1939,1940,
 &end
#
# 19 MET QB 127 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295,
 igr2=1938,1939,1940,
 &end
#
# 20 ALA HA 127 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1938,1939,1940,
 &end
#
# 20 ALA HN 127 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1938,1939,1940,
 &end
#
# 23 TRP HD1 127 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1938,1939,1940,
 &end
#
# 23 TRP HE1 127 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1938,1939,1940,
 &end
#
# 81 LEU HG 127 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1223,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1938,1939,1940,
 &end
#
# 128 GLY QA 128 GLY HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1953,1954,
 &end
#
# 128 GLY HN 129 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1951,1958, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 128 GLY HN 130 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1951,1972, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19 MET QB 128 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 294, 295,
 &end
#
# 23 TRP HD1 128 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 347,1951, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23 TRP HE1 128 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 349,1951, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 23 TRP HZ2 128 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 352,1951, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 27 TYR QE 128 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 422, 427,
 &end
#
# 128 GLY QA 129 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1958, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1953,1954,
 &end
#
# 131 LEU QB 128 GLY QA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2000,2001,
 igr2=1953,1954,
 &end
#
# 128 GLY QA 132 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2015, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1953,1954,
 &end
#
# 132 LYS+ QB 128 GLY QA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2019,2020,
 igr2=1953,1954,
 &end
#
# 128 GLY QA 132 LYS+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1953,1954,
 igr2=2025,2026,
 &end
#
# 128 GLY QA 23 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1953,1954,
 &end
#
# 23 TRP QB 128 GLY QA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 343, 344,
 igr2=1953,1954,
 &end
#
# 129 ASN HN 129 ASN HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1958,1960, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 129 ASN HA 129 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1960,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1962,1963,
 &end
#
# 130 ARG+ HN 129 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1972,1960, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 132 LYS+ HN 129 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2015,1960, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 129 ASN HA 132 LYS+ QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1960,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2019,2020,
 &end
#
# 129 ASN HA 132 LYS+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1960,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2025,2026,
 &end
#
# 129 ASN QB 129 ASN HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1958, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1962,1963,
 &end
#
# 129 ASN QD2 129 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1958, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1967,1968,
 &end
#
# 130 ARG+ HN 129 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1972,1958, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 132 LYS+ QB 129 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1958, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2019,2020,
 &end
#
# 27 TYR QE 129 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1958, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 422, 427,
 &end
#
# 129 ASN QD2 129 ASN QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1967,1968,
 igr2=1962,1963,
 &end
#
# 129 ASN QB 130 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1972, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1962,1963,
 &end
#
# 132 LYS+ QD 129 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2025,2026,
 igr2=1967,1968,
 &end
#
# 13 ASN HA 13 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 204, 202, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13 ASN QB 13 ASN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 206, 207,
 &end
#
# 13 ASN QD2 13 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 211, 212,
 &end
#
# 13 ASN HA 14 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 204, 216, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 13 ASN HA 15 CYS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 204, 227, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17 SER HG 13 ASN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 204, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13 ASN HA 17 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 204, 262, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13 ASN HA 18 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 204, 273, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13 ASN HA 37 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 204, 580, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 13 ASN QB 13 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 206, 207,
 &end
#
# 13 ASN QD2 13 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 211, 212,
 &end
#
# 13 ASN HN 14 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 202, 216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17 SER HG 13 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 202, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 GLY QA 13 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 592, 593,
 &end
#
# 39 ILE HN 13 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 597, 202, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 13 ASN HN 40 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 623, 624,
 &end
#
# 41 ALA HA 13 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 202, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 41 ALA QB 13 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 635, 636, 637,
 &end
#
# 13 ASN QB 13 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 206, 207,
 igr2= 211, 212,
 &end
#
# 13 ASN QB 14 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 216, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 206, 207,
 &end
#
# 13 ASN QB 18 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 206, 207,
 igr2= 285, 286,
 &end
#
# 13 ASN QB 38 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 206, 207,
 &end
#
# 13 ASN QB 41 ALA HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 633, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 206, 207,
 &end
#
# 13 ASN QB 41 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 206, 207,
 igr2= 635, 636, 637,
 &end
#
# 42 HIS HN 13 ASN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 641,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 206, 207,
 &end
#
# 13 ASN QB 43 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 206, 207,
 &end
#
# 13 ASN QB 64 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 967, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 206, 207,
 &end
#
# 13 ASN QD2 14 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 216, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 211, 212,
 &end
#
# 15 CYS HN 13 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 227,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 211, 212,
 &end
#
# 13 ASN QD2 17 SER HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 211, 212,
 &end
#
# 17 SER HG 13 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 211, 212,
 &end
#
# 13 ASN QD2 17 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 211, 212,
 &end
#
# 13 ASN QD2 18 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 211, 212,
 &end
#
# 13 ASN QD2 18 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 211, 212,
 igr2= 285, 286,
 &end
#
# 18 GLN QG 13 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 280, 281,
 igr2= 211, 212,
 &end
#
# 36 SER HA 13 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 571,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 211, 212,
 &end
#
# 13 ASN QD2 36 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 211, 212,
 &end
#
# 36 SER QB 13 ASN QD2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 573, 574,
 igr2= 211, 212,
 &end
#
# 37 ALA HA 13 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 211, 212,
 &end
#
# 13 ASN QD2 37 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 580, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 211, 212,
 &end
#
# 37 ALA QB 13 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 584, 585, 586,
 igr2= 211, 212,
 &end
#
# 13 ASN QD2 65 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 211, 212,
 &end
#
# 13 ASN QD2 8 PHE HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 211, 212,
 &end
#
# 130 ARG+ HE 130 ARG+ HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1985,1974, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 130 ARG+ HN 130 ARG+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1972,1974, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 130 ARG+ HA 130 ARG+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1974,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1976,1977,
 &end
#
# 130 ARG+ QD 130 ARG+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1974, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1982,1983,
 &end
#
# 132 LYS+ HN 130 ARG+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2015,1974, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 133 GLU- HN 130 ARG+ HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2037,1974, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 133 GLU- QB 130 ARG+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1974, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2041,2042,
 &end
#
# 130 ARG+ HE 130 ARG+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1985,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1982,1983,
 &end
#
# 130 ARG+ QB 130 ARG+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1972, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1976,1977,
 &end
#
# 130 ARG+ QD 130 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1972, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1982,1983,
 &end
#
# 130 ARG+ QG 130 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1972, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1979,1980,
 &end
#
# 130 ARG+ HN 131 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1972,1996, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 130 ARG+ HN 132 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1972,2015, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 132 LYS+ QB 130 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1972, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2019,2020,
 &end
#
# 133 GLU- HN 130 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2037,1972, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 130 ARG+ QB 130 ARG+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1976,1977,
 igr2=1982,1983,
 &end
#
# 131 LEU HN 130 ARG+ QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1996,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1976,1977,
 &end
#
# 130 ARG+ QB 132 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2015, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1976,1977,
 &end
#
# 132 LYS+ QB 130 ARG+ QB 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=2019,2020,
 igr2=1976,1977,
 &end
#
# 130 ARG+ QD 131 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1996, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1982,1983,
 &end
#
# 130 ARG+ QD 133 GLU- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2039, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1982,1983,
 &end
#
# 130 ARG+ QD 139 LYS+ HA 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1982,1983,
 &end
#
# 130 ARG+ QD 139 LYS+ QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1982,1983,
 igr2=2125,2126,
 &end
#
# 131 LEU HG 131 LEU HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2003,1998, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 131 LEU QB 131 LEU HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1998, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2000,2001,
 &end
#
# 132 LYS+ HN 131 LEU HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2015,1998, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 134 PHE QB 131 LEU HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1998, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2056,2057,
 &end
#
# 131 LEU HA 135 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1998,2072, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 131 LEU HG 131 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2003,1996, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 131 LEU QB 131 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2003, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2000,2001,
 &end
#
# 131 LEU HG 131 LEU QQD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2003,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=2005,2006,2007,2009,2010,2011,
 &end
#
# 20 ALA QB 131 LEU HG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2003, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 311, 312, 313,
 &end
#
# 131 LEU HG 23 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2003, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 131 LEU HG 24 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2003, 365, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 24 ALA HN 131 LEU HG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 363,2003, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 ALA QB 131 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2003, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 367, 368, 369,
 &end
#
# 131 LEU HG 27 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2003, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 27 TYR QE 131 LEU HG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2003, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 422, 427,
 &end
#
# 131 LEU HG 28 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2003, 433, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 131 LEU HG 28 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2003,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 442, 443, 444, 446, 447, 448,
 &end
#
# 6 ILE QD1 131 LEU HG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2003, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 104, 105, 106,
 &end
#
# 131 LEU HN 131 LEU QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1996,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2000,2001,
 &end
#
# 131 LEU QQD 131 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1996, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2005,2006,2007,2009,2010,2011,
 &end
#
# 132 LYS+ HA 131 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2017,1996, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 131 LEU HN 132 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1996,2015, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 133 GLU- HN 131 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2037,1996, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 133 GLU- QG 131 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1996, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2044,2045,
 &end
#
# 27 TYR QE 131 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1996, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 422, 427,
 &end
#
# 131 LEU QB 132 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2015, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2000,2001,
 &end
#
# 24 ALA HN 131 LEU QQD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 363,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2005,2006,2007,2009,2010,2011,
 &end
#
# 132 LYS+ HN 132 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2015,2017, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 132 LYS+ QB 132 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2017, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2019,2020,
 &end
#
# 132 LYS+ HA 132 LYS+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2017,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2025,2026,
 &end
#
# 132 LYS+ HA 132 LYS+ QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2017,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2022,2023,
 &end
#
# 133 GLU- HN 132 LYS+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2037,2017, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 132 LYS+ HA 135 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2017,2072, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 132 LYS+ HA 135 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2017,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2076,2077,2078,
 &end
#
# 132 LYS+ HA 136 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2017,2082, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27 TYR QE 132 LYS+ HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2017, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 422, 427,
 &end
#
# 132 LYS+ HN 132 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2015,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2019,2020,
 &end
#
# 132 LYS+ HN 132 LYS+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2015,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2025,2026,
 &end
#
# 132 LYS+ HN 132 LYS+ QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2015,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2022,2023,
 &end
#
# 133 GLU- HA 132 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2039,2015, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 132 LYS+ HN 133 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2015,2037, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 133 GLU- QG 132 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2015, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2044,2045,
 &end
#
# 132 LYS+ HN 135 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2015,2072, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 27 TYR QB 132 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2015, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 416, 417,
 &end
#
# 27 TYR QE 132 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2015, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 422, 427,
 &end
#
# 132 LYS+ QG 132 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2022,2023,
 igr2=2019,2020,
 &end
#
# 132 LYS+ QB 133 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2037, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2019,2020,
 &end
#
# 132 LYS+ QB 134 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2052, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2019,2020,
 &end
#
# 132 LYS+ QE 132 LYS+ QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2028,2029,
 igr2=2025,2026,
 &end
#
# 132 LYS+ QG 132 LYS+ QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2022,2023,
 igr2=2025,2026,
 &end
#
# 132 LYS+ QG 132 LYS+ QE 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2022,2023,
 igr2=2028,2029,
 &end
#
# 132 LYS+ QG 133 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2039, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2022,2023,
 &end
#
# 132 LYS+ QG 133 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2037, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2022,2023,
 &end
#
# 132 LYS+ QG 134 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2052, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2022,2023,
 &end
#
# 132 LYS+ QG 136 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2082, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2022,2023,
 &end
#
# 133 GLU- HN 133 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2037,2039, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 133 GLU- QB 133 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2039, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2041,2042,
 &end
#
# 133 GLU- HA 133 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2039,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2044,2045,
 &end
#
# 133 GLU- HA 134 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2039,2052, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 133 GLU- HA 135 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2039,2072, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 136 GLU- HN 133 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2082,2039, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 133 GLU- HA 136 GLU- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2039,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2086,2087,
 &end
#
# 136 GLU- QG 133 GLU- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2039, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2089,2090,
 &end
#
# 137 THR HA 133 GLU- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2099,2039, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 133 GLU- HA 137 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2039,2097, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 133 GLU- HA 137 THR QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2039,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2103,2104,2105,
 &end
#
# 133 GLU- QB 133 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2037, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2041,2042,
 &end
#
# 133 GLU- HN 133 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2037,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2044,2045,
 &end
#
# 134 PHE HA 133 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2054,2037, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 133 GLU- HN 134 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2037,2052, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 133 GLU- HN 135 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2037,2072, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 133 GLU- HN 136 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2037,2082, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 136 GLU- QG 133 GLU- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2089,2090,
 igr2=2041,2042,
 &end
#
# 133 GLU- QB 137 THR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2099, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2041,2042,
 &end
#
# 137 THR HB 133 GLU- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2101,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2041,2042,
 &end
#
# 138 GLY HN 133 GLU- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2041,2042,
 &end
#
# 133 GLU- QB 139 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2118, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2041,2042,
 &end
#
# 139 LYS+ QG 133 GLU- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2125,2126,
 igr2=2041,2042,
 &end
#
# 133 GLU- QG 134 PHE HA 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2054, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=2044,2045,
 &end
#
# 134 PHE HN 133 GLU- QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2052,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2044,2045,
 &end
#
# 135 ALA HN 133 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2072,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2044,2045,
 &end
#
# 137 THR QG2 133 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2103,2104,2105,
 igr2=2044,2045,
 &end
#
# 133 GLU- QG 139 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2118, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2044,2045,
 &end
#
# 134 PHE HA 134 PHE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2054,2052, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 134 PHE QB 134 PHE HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2054, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2056,2057,
 &end
#
# 134 PHE QE 134 PHE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2054, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2062,2066,
 &end
#
# 134 PHE HA 135 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2054,2072, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 134 PHE HA 136 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2054,2082, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 138 GLY HN 134 PHE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2111,2054, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 134 PHE HA 139 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2054,2118, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 LEU QQD 134 PHE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2054, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 134 PHE QB 134 PHE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2052, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2056,2057,
 &end
#
# 135 ALA HA 134 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2074,2052, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 134 PHE HN 135 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2052,2072, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 136 GLU- HN 134 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2082,2052, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 137 THR QG2 134 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2052, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2103,2104,2105,
 &end
#
# 139 LYS+ HN 134 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2118,2052, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28 LEU QQD 134 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2052, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 135 ALA HN 134 PHE QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2072,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2056,2057,
 &end
#
# 134 PHE QB 138 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2056,2057,
 &end
#
# 134 PHE QB 139 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2118, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2056,2057,
 &end
#
# 134 PHE QE 24 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2062,2066,
 igr2= 367, 368, 369,
 &end
#
# 134 PHE QE 28 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2062,2066,
 igr2= 442, 443, 444, 446, 447, 448,
 &end
#
# 134 PHE QE 6 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2062,2066,
 igr2= 104, 105, 106,
 &end
#
# 134 PHE QE 6 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2062,2066,
 igr2=  97,  98,  99,
 &end
#
# 135 ALA HA 135 ALA HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2074,2072, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 135 ALA HA 135 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2074,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=2076,2077,2078,
 &end
#
# 136 GLU- HN 135 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2082,2074, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 135 ALA HA 137 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2074,2097, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 135 ALA HA 138 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2074,2111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27 TYR QB 135 ALA HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 416, 417,
 &end
#
# 28 LEU HA 135 ALA HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 435,2074, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 28 LEU QQD 135 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 135 ALA HA 32 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2074, 496, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 TRP HH2 135 ALA HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 501,2074, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 135 ALA HN 135 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2072,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=2076,2077,2078,
 &end
#
# 135 ALA HN 136 GLU- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2084, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 135 ALA HN 136 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2082, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 135 ALA HN 137 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2097, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 137 THR QG2 135 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2072, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2103,2104,2105,
 &end
#
# 138 GLY HN 135 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2111,2072, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 135 ALA HN 139 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2072,2118, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 28 LEU QQD 135 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2072, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 136 GLU- HN 135 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2082,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2076,2077,2078,
 &end
#
# 135 ALA QB 137 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2097, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2076,2077,2078,
 &end
#
# 27 TYR QB 135 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 416, 417,
 igr2=2076,2077,2078,
 &end
#
# 28 LEU HA 135 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 435,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2076,2077,2078,
 &end
#
# 135 ALA QB 28 LEU QQD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=2076,2077,2078,
 igr2= 442, 443, 444, 446, 447, 448,
 &end
#
# 135 ALA QB 29 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2076,2077,2078,
 &end
#
# 135 ALA QB 32 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2076,2077,2078,
 &end
#
# 136 GLU- HA 136 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2084,2082, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 136 GLU- HA 136 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2084,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2086,2087,
 &end
#
# 136 GLU- QG 136 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2084, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2089,2090,
 &end
#
# 137 THR HN 136 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2097,2084, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 137 THR QG2 136 GLU- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2084, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2103,2104,2105,
 &end
#
# 136 GLU- HA 138 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2084,2111, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 136 GLU- HN 136 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2082,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2086,2087,
 &end
#
# 136 GLU- HN 136 GLU- QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2082,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2089,2090,
 &end
#
# 136 GLU- HN 137 THR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2082,2099, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 137 THR HN 136 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2097,2082, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 136 GLU- HN 137 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2082,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2103,2104,2105,
 &end
#
# 136 GLU- HN 138 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2082,2111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28 LEU QQD 136 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2082, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 136 GLU- QG 136 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2089,2090,
 igr2=2086,2087,
 &end
#
# 137 THR HN 136 GLU- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2097,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2086,2087,
 &end
#
# 137 THR QG2 136 GLU- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2103,2104,2105,
 igr2=2086,2087,
 &end
#
# 136 GLU- QB 138 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2086,2087,
 &end
#
# 137 THR HA 136 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2099,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2089,2090,
 &end
#
# 137 THR HB 136 GLU- QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2101,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2089,2090,
 &end
#
# 136 GLU- QG 137 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2097, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2089,2090,
 &end
#
# 137 THR QG2 136 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=2103,2104,2105,
 igr2=2089,2090,
 &end
#
# 137 THR HA 137 THR HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2099,2101, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 137 THR HN 137 THR HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2097,2099, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 137 THR HA 137 THR QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2099,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2103,2104,2105,
 &end
#
# 137 THR HA 138 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2099,2111, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 139 LYS+ HN 137 THR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2118,2099, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 137 THR HN 137 THR HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2097,2101, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 137 THR HB 137 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2101,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=2103,2104,2105,
 &end
#
# 137 THR HB 138 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2101,2111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 137 THR HB 139 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2101,2118, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 137 THR HB 139 LYS+ QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2101,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2122,2123,
 &end
#
# 137 THR HB 139 LYS+ QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2101,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2125,2126,
 &end
#
# 137 THR HN 137 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2097,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=2103,2104,2105,
 &end
#
# 137 THR HN 138 GLY HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2097,2111, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 138 GLY QA 137 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2097, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2113,2114,
 &end
#
# 139 LYS+ HN 137 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2118,2097, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 138 GLY HN 137 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2103,2104,2105,
 &end
#
# 137 THR QG2 138 GLY QA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2103,2104,2105,
 igr2=2113,2114,
 &end
#
# 139 LYS+ HN 137 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=2118,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2103,2104,2105,
 &end
#
# 139 LYS+ QB 137 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2122,2123,
 igr2=2103,2104,2105,
 &end
#
# 139 LYS+ QE 137 THR QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2131,2132,
 igr2=2103,2104,2105,
 &end
#
# 138 GLY HN 138 GLY QA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2113,2114,
 &end
#
# 139 LYS+ HA 138 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=2120,2111, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 138 GLY HN 139 LYS+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2111,2118, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 139 LYS+ QD 138 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2128,2129,
 &end
#
# 139 LYS+ QG 138 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2111, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2125,2126,
 &end
#
# 139 LYS+ HN 138 GLY QA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=2118,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2113,2114,
 &end
#
# 138 GLY QA 139 LYS+ QD 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=2113,2114,
 igr2=2128,2129,
 &end
#
# 139 LYS+ HN 139 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2118,2120, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 139 LYS+ HA 139 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2120,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2122,2123,
 &end
#
# 139 LYS+ QE 139 LYS+ HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2131,2132,
 &end
#
# 139 LYS+ HA 139 LYS+ QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2120,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2125,2126,
 &end
#
# 139 LYS+ HN 139 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=2118,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2122,2123,
 &end
#
# 139 LYS+ QE 139 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2118, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2131,2132,
 &end
#
# 139 LYS+ QG 139 LYS+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,2118, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2125,2126,
 &end
#
# 139 LYS+ QE 139 LYS+ QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2131,2132,
 igr2=2122,2123,
 &end
#
# 139 LYS+ QG 139 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2125,2126,
 igr2=2122,2123,
 &end
#
# 139 LYS+ QE 139 LYS+ QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2131,2132,
 igr2=2125,2126,
 &end
#
# 14 SER HA 14 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 216, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 14 SER QB 14 SER HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 220, 221,
 &end
#
# 14 SER HA 15 CYS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 227, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14 SER HA 18 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 273, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 14 SER HA 18 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 285, 286,
 &end
#
# 18 GLN QG 14 SER HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 280, 281,
 &end
#
# 14 SER HA 43 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 658, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 14 SER HA 44 LEU HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 667, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14 SER HA 45 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 684, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 14 SER QB 14 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 216, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 220, 221,
 &end
#
# 14 SER HN 15 CYS HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 227, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 14 SER HN 16 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 238, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 17 SER HG 14 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14 SER HN 17 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 262, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14 SER HN 18 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 273, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 64 SER QB 14 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 216, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 971, 972,
 &end
#
# 14 SER QB 15 CYS HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 227, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 220, 221,
 &end
#
# 14 SER QB 45 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 220, 221,
 &end
#
# 14 SER QB 45 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 220, 221,
 igr2= 693, 694,
 &end
#
# 15 CYS QB 15 CYS HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 227, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 231, 232,
 &end
#
# 16 ARG+ HA 15 CYS HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 227, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 15 CYS HN 16 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 227, 238, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17 SER HG 15 CYS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 227, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15 CYS HN 17 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 227, 262, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15 CYS HN 18 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 227, 273, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18 GLN QG 15 CYS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 227, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 280, 281,
 &end
#
# 45 ASN HN 15 CYS HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 227, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ARG+ HN 15 CYS QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 231, 232,
 &end
#
# 15 CYS QB 17 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 231, 232,
 &end
#
# 15 CYS QB 45 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 231, 232,
 &end
#
# 15 CYS QB 45 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 231, 232,
 igr2= 693, 694,
 &end
#
# 15 CYS QB 48 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 231, 232,
 igr2= 730, 731, 732,
 &end
#
# 16 ARG+ HN 16 ARG+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 238, 240, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16 ARG+ QB 16 ARG+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 242, 243,
 &end
#
# 16 ARG+ QG 16 ARG+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 245, 246,
 &end
#
# 17 SER HN 16 ARG+ HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 240, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ARG+ HA 19 MET HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 290, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19 MET QB 16 ARG+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 294, 295,
 &end
#
# 81 LEU QQD 16 ARG+ HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 16 ARG+ HE 16 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 251, 238, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ARG+ HE 17 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 251, 262, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16 ARG+ HE 82 CYX HA 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 251,1237, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 16 ARG+ QB 16 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 242, 243,
 &end
#
# 16 ARG+ QG 16 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 245, 246,
 &end
#
# 17 SER HG 16 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 238, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 16 ARG+ HN 17 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 238, 262, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16 ARG+ HN 18 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 238, 273, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 MET QB 16 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 294, 295,
 &end
#
# 81 LEU QB 16 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1220,1221,
 &end
#
# 81 LEU QQD 16 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 238, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 16 ARG+ QB 17 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 242, 243,
 &end
#
# 16 ARG+ QB 18 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 242, 243,
 &end
#
# 16 ARG+ QD 83 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 248, 249,
 &end
#
# 16 ARG+ QD 84 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1252, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 248, 249,
 &end
#
# 16 ARG+ QG 17 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 245, 246,
 &end
#
# 81 LEU QQD 16 ARG+ QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1225,1226,1227,1229,1230,1231,
 igr2= 245, 246,
 &end
#
# 17 SER HG 17 SER HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 264, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 17 SER HA 17 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 262, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 17 SER HA 18 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 273, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 20 ALA HN 17 SER HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 264, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ALA QB 17 SER HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 311, 312, 313,
 &end
#
# 17 SER HA 37 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 264, 580, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 81 LEU QQD 17 SER HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 264, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 17 SER HG 17 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 262, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 17 SER HG 18 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 273, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17 SER HG 37 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 580, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 17 SER QB 17 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 266, 267,
 &end
#
# 17 SER HN 18 GLN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 273, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 17 SER HN 19 MET HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 262, 290, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 81 LEU QB 17 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1220,1221,
 &end
#
# 81 LEU QQD 17 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 262, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 17 SER QB 81 LEU QQD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 266, 267,
 igr2=1225,1226,1227,1229,1230,1231,
 &end
#
# 18 GLN HN 18 GLN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 275, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18 GLN QB 18 GLN HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 277, 278,
 &end
#
# 18 GLN HA 18 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 285, 286,
 &end
#
# 19 MET HN 18 GLN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 290, 275, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 21 GLU- HN 18 GLN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 275, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18 GLN HA 36 SER HA 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 571, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 18 GLN HA 36 SER QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 573, 574,
 &end
#
# 18 GLN QB 18 GLN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 277, 278,
 &end
#
# 18 GLN QE2 18 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 285, 286,
 &end
#
# 18 GLN QG 18 GLN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 280, 281,
 &end
#
# 18 GLN HN 19 MET HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 290, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 19 MET QG 18 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 297, 298,
 &end
#
# 18 GLN HN 20 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 307, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21 GLU- HN 18 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 273, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 44 LEU QQD 18 GLN HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 18 GLN QB 18 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 277, 278,
 igr2= 285, 286,
 &end
#
# 18 GLN QB 19 MET HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 277, 278,
 &end
#
# 18 GLN QB 44 LEU QQD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 277, 278,
 igr2= 674, 675, 676, 678, 679, 680,
 &end
#
# 18 GLN QB 45 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 277, 278,
 &end
#
# 18 GLN QB 59 ILE QD1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 277, 278,
 igr2= 905, 906, 907,
 &end
#
# 18 GLN QG 18 GLN QE2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 280, 281,
 igr2= 285, 286,
 &end
#
# 44 LEU HA 18 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 667,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 285, 286,
 &end
#
# 44 LEU QQD 18 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 674, 675, 676, 678, 679, 680,
 igr2= 285, 286,
 &end
#
# 62 GLN QB 18 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 940, 941,
 igr2= 285, 286,
 &end
#
# 63 THR HA 18 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 955,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 285, 286,
 &end
#
# 18 GLN QE2 63 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 953, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 285, 286,
 &end
#
# 18 GLN QE2 64 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 967, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 285, 286,
 &end
#
# 64 SER QB 18 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 971, 972,
 igr2= 285, 286,
 &end
#
# 18 GLN QE2 65 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 285, 286,
 &end
#
# 18 GLN QG 44 LEU QQD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 280, 281,
 igr2= 674, 675, 676, 678, 679, 680,
 &end
#
# 18 GLN QG 45 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 280, 281,
 &end
#
# 19 MET HA 19 MET HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 292, 290, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 19 MET QB 19 MET HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 294, 295,
 &end
#
# 19 MET QG 19 MET HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 297, 298,
 &end
#
# 19 MET HA 20 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 292, 307, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19 MET HA 22 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 292, 332, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19 MET HA 23 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 292, 349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 MET HA 23 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 292, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 MET HA 52 MET QE 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 795, 796, 797,
 &end
#
# 19 MET HA 52 MET QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 791, 792,
 &end
#
# 59 ILE QD1 19 MET HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 905, 906, 907,
 &end
#
# 59 ILE QG2 19 MET HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 898, 899, 900,
 &end
#
# 19 MET QB 19 MET HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 294, 295,
 &end
#
# 19 MET QG 19 MET HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 297, 298,
 &end
#
# 19 MET HN 20 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 290, 307, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 19 MET HN 21 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 290, 317, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 MET HN 22 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 290, 332, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 TRP HD1 19 MET HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 290, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 19 MET HN 44 LEU QQD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 674, 675, 676, 678, 679, 680,
 &end
#
# 19 MET HN 59 ILE HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 290, 896, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 MET HN 59 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 905, 906, 907,
 &end
#
# 19 MET QG 19 MET QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 297, 298,
 igr2= 294, 295,
 &end
#
# 19 MET QB 20 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 294, 295,
 &end
#
# 19 MET QB 21 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 294, 295,
 &end
#
# 19 MET QB 23 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 294, 295,
 &end
#
# 19 MET QB 48 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 294, 295,
 igr2= 730, 731, 732,
 &end
#
# 2 GLU- HA 2 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=  25,  26,
 &end
#
# 2 GLU- QG 2 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  28,  29,
 &end
#
# 3 ASN HN 2 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  36,  23, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 2 GLU- QG 2 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  28,  29,
 igr2=  25,  26,
 &end
#
# 3 ASN HN 2 GLU- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  36,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  25,  26,
 &end
#
# 3 ASN QB 2 GLU- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  40,  41,
 igr2=  25,  26,
 &end
#
# 2 GLU- QG 4 LYS+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  28,  29,
 igr2=  60,  61,
 &end
#
# 20 ALA HN 20 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 309, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 20 ALA HA 20 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 311, 312, 313,
 &end
#
# 20 ALA HA 21 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 317, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 20 ALA HA 22 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 332, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 TRP HD1 20 ALA HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 309, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 20 ALA HA 23 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 339, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 23 TRP QB 20 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 343, 344,
 &end
#
# 20 ALA HA 24 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 363, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 20 ALA HN 20 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 311, 312, 313,
 &end
#
# 20 ALA HN 21 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 317, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 20 ALA HN 22 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 332, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 TRP HD1 20 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 307, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 20 ALA HN 23 TRP HE1 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 349, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 23 TRP HN 20 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 307, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 81 LEU QQD 20 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 20 ALA QB 21 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 311, 312, 313,
 &end
#
# 8 PHE QE 20 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 141, 145,
 igr2= 311, 312, 313,
 &end
#
# 81 LEU HG 20 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1223,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 311, 312, 313,
 &end
#
# 20 ALA QB 81 LEU QQD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 311, 312, 313,
 igr2=1225,1226,1227,1229,1230,1231,
 &end
#
# 21 GLU- HN 21 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 319, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 21 GLU- HA 21 GLU- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 319,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 321, 322,
 &end
#
# 22 GLY HN 21 GLU- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 332, 319, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 ALA HN 21 GLU- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 319, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 ALA QB 21 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 319, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 367, 368, 369,
 &end
#
# 21 GLU- HA 34 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 319,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 21 GLU- HN 21 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 321, 322,
 &end
#
# 21 GLU- HN 22 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 332, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 22 GLY QA 21 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 334, 335,
 &end
#
# 21 GLU- HN 23 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 339, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21 GLU- HN 24 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 34 VAL QQG 21 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 538, 539, 540, 542, 543, 544,
 &end
#
# 59 ILE QG2 21 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 898, 899, 900,
 &end
#
# 21 GLU- HN 62 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 948, 949,
 &end
#
# 8 PHE QE 21 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 141, 145,
 &end
#
# 81 LEU QQD 21 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 317, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 21 GLU- QB 6 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 321, 322,
 igr2=  97,  98,  99,
 &end
#
# 34 VAL QQG 21 GLU- QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 538, 539, 540, 542, 543, 544,
 igr2= 324, 325,
 &end
#
# 22 GLY HN 22 GLY QA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 334, 335,
 &end
#
# 22 GLY HN 23 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 332, 339, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 22 GLY HN 24 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 332, 363, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25 LYS+ HN 22 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 373, 332, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 34 VAL QQG 22 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 538, 539, 540, 542, 543, 544,
 &end
#
# 22 GLY HN 52 MET QE 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 795, 796, 797,
 &end
#
# 57 ILE QG2 22 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 867, 868, 869,
 &end
#
# 22 GLY HN 59 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 898, 899, 900,
 &end
#
# 62 GLN QB 22 GLY HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 940, 941,
 &end
#
# 22 GLY QA 23 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 334, 335,
 &end
#
# 22 GLY QA 25 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 334, 335,
 &end
#
# 25 LYS+ QD 22 GLY QA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 383, 384,
 igr2= 334, 335,
 &end
#
# 22 GLY QA 26 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 395, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 334, 335,
 &end
#
# 22 GLY QA 26 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 334, 335,
 igr2= 407, 408,
 &end
#
# 22 GLY QA 52 MET QE 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 334, 335,
 igr2= 795, 796, 797,
 &end
#
# 22 GLY QA 57 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 334, 335,
 igr2= 867, 868, 869,
 &end
#
# 59 ILE QG2 22 GLY QA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 898, 899, 900,
 igr2= 334, 335,
 &end
#
# 22 GLY QA 62 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 334, 335,
 igr2= 948, 949,
 &end
#
# 23 TRP HA 23 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 341, 339, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 23 TRP QB 23 TRP HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 343, 344,
 &end
#
# 23 TRP HA 24 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 341, 363, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26 GLN HN 23 TRP HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 395, 341, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23 TRP HA 26 GLN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 341,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 399, 400,
 &end
#
# 23 TRP HA 26 GLN QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 341,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 402, 403,
 &end
#
# 23 TRP HA 27 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 341, 412, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 52 MET QE 23 TRP HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 795, 796, 797,
 &end
#
# 57 ILE QD1 23 TRP HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 874, 875, 876,
 &end
#
# 23 TRP HD1 23 TRP HE1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 349, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 23 TRP HD1 23 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 339, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 23 TRP HD1 52 MET QE 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 795, 796, 797,
 &end
#
# 23 TRP HD1 59 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 347,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 898, 899, 900,
 &end
#
# 23 TRP HN 23 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 TRP HZ2 23 TRP HE1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 349, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 51 ALA QB 23 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 778, 779, 780,
 &end
#
# 52 MET QE 23 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 795, 796, 797,
 &end
#
# 55 VAL QQG 23 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 844, 845, 846, 848, 849, 850,
 &end
#
# 57 ILE QD1 23 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 349, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 874, 875, 876,
 &end
#
# 23 TRP HH2 55 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 354,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 23 TRP QB 23 TRP HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 343, 344,
 &end
#
# 23 TRP HN 24 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 363, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 23 TRP HN 25 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 373, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23 TRP HN 26 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 395, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 TRP HN 52 MET QE 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 795, 796, 797,
 &end
#
# 57 ILE QD1 23 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 874, 875, 876,
 &end
#
# 57 ILE QG2 23 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 867, 868, 869,
 &end
#
# 23 TRP HZ2 51 ALA HA 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 776, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 23 TRP HZ2 51 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 778, 779, 780,
 &end
#
# 23 TRP HZ2 54 GLU- HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 823, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 23 TRP HZ2 55 VAL HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 842, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23 TRP HZ2 55 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 838, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 23 TRP HZ2 55 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 352,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 23 TRP QB 24 ALA HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 363, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 343, 344,
 &end
#
# 24 ALA HN 24 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 365, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 24 ALA HA 24 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 367, 368, 369,
 &end
#
# 24 ALA HA 25 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 373, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26 GLN HN 24 ALA HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 395, 365, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 24 ALA HA 27 TYR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 412, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 27 TYR QB 24 ALA HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 416, 417,
 &end
#
# 24 ALA HA 28 LEU HG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 440, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28 LEU HN 24 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 365, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 LEU QQD 24 ALA HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 24 ALA HN 24 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 363,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 367, 368, 369,
 &end
#
# 24 ALA HN 25 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 373, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 24 ALA HN 26 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 395, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 24 ALA HN 27 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 24 ALA QB 25 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 367, 368, 369,
 &end
#
# 28 LEU HN 24 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 367, 368, 369,
 &end
#
# 24 ALA QB 6 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 367, 368, 369,
 igr2= 104, 105, 106,
 &end
#
# 24 ALA QB 6 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 367, 368, 369,
 igr2=  97,  98,  99,
 &end
#
# 25 LYS+ HA 25 LYS+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 375, 373, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 25 LYS+ QB 25 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 375, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 377, 378,
 &end
#
# 25 LYS+ HA 25 LYS+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 375,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
# 25 LYS+ HA 25 LYS+ QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 375,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 380, 381,
 &end
#
# 26 GLN HN 25 LYS+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 395, 375, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 25 LYS+ HA 27 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 375, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 25 LYS+ HA 28 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 375, 433, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 25 LYS+ HA 34 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 375,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 25 LYS+ QB 25 LYS+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 377, 378,
 &end
#
# 25 LYS+ QG 25 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 380, 381,
 &end
#
# 26 GLN HN 25 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 395, 373, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 26 GLN QG 25 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 402, 403,
 &end
#
# 28 LEU QQD 25 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 373, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 25 LYS+ HN 34 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 373,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 26 GLN HN 25 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 377, 378,
 &end
#
# 26 GLN QE2 25 LYS+ QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 407, 408,
 igr2= 377, 378,
 &end
#
# 25 LYS+ QB 30 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 459, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 377, 378,
 &end
#
# 25 LYS+ QE 61 ASN QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 386, 387,
 igr2= 926, 927,
 &end
#
# 25 LYS+ QG 26 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 395, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 380, 381,
 &end
#
# 25 LYS+ QG 34 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 380, 381,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 26 GLN HA 26 GLN HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 395, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 26 GLN HA 26 GLN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 399, 400,
 &end
#
# 26 GLN HA 26 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 407, 408,
 &end
#
# 26 GLN HA 26 GLN QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 402, 403,
 &end
#
# 27 TYR HN 26 GLN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 397, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 30 ASP- HN 26 GLN HA 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 397, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 26 GLN HN 26 GLN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 399, 400,
 &end
#
# 26 GLN QE2 26 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 395, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 407, 408,
 &end
#
# 26 GLN HN 26 GLN QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 402, 403,
 &end
#
# 26 GLN HN 27 TYR HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 395, 412, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 28 LEU HN 26 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 395, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28 LEU QQD 26 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 395, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 34 VAL QQG 26 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 395, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 538, 539, 540, 542, 543, 544,
 &end
#
# 26 GLN HN 57 ILE QD1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 874, 875, 876,
 &end
#
# 57 ILE QG2 26 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 395, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 867, 868, 869,
 &end
#
# 26 GLN QE2 26 GLN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 407, 408,
 igr2= 399, 400,
 &end
#
# 27 TYR HN 26 GLN QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 399, 400,
 &end
#
# 57 ILE QD1 26 GLN QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 874, 875, 876,
 igr2= 399, 400,
 &end
#
# 26 GLN QE2 26 GLN QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 407, 408,
 igr2= 402, 403,
 &end
#
# 26 GLN QE2 27 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 407, 408,
 &end
#
# 52 MET QE 26 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 795, 796, 797,
 igr2= 407, 408,
 &end
#
# 57 ILE HA 26 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 863,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 407, 408,
 &end
#
# 26 GLN QE2 57 ILE QD1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 407, 408,
 igr2= 874, 875, 876,
 &end
#
# 57 ILE QG1 26 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 871, 872,
 igr2= 407, 408,
 &end
#
# 57 ILE QG2 26 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 867, 868, 869,
 igr2= 407, 408,
 &end
#
# 59 ILE QG2 26 GLN QE2 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 898, 899, 900,
 igr2= 407, 408,
 &end
#
# 27 TYR HN 26 GLN QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 402, 403,
 &end
#
# 57 ILE HA 26 GLN QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 863,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 402, 403,
 &end
#
# 57 ILE QD1 26 GLN QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 874, 875, 876,
 igr2= 402, 403,
 &end
#
# 27 TYR HN 27 TYR QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 416, 417,
 &end
#
# 27 TYR QE 27 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 422, 427,
 &end
#
# 28 LEU HA 27 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 435, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 28 LEU HG 27 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 412, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27 TYR HN 28 LEU HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 433, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 28 LEU QQD 27 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 29 GLY HN 27 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 452, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 57 ILE QD1 27 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 874, 875, 876,
 &end
#
# 28 LEU HN 27 TYR QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 416, 417,
 &end
#
# 27 TYR QB 29 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 416, 417,
 &end
#
# 28 LEU HG 28 LEU HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 435, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 LEU HN 28 LEU HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 435, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 LEU QB 28 LEU HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 435, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 437, 438,
 &end
#
# 28 LEU HA 28 LEU QQD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 435,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 442, 443, 444, 446, 447, 448,
 &end
#
# 29 GLY HN 28 LEU HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 452, 435, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 28 LEU HA 32 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 435, 496, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28 LEU HN 28 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 440, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 28 LEU HG 28 LEU QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 437, 438,
 &end
#
# 28 LEU QQD 28 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 28 LEU HN 28 LEU QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 437, 438,
 &end
#
# 28 LEU QQD 28 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 28 LEU HN 29 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 452, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 32 TRP QB 28 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 490, 491,
 &end
#
# 28 LEU QB 28 LEU QQD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 437, 438,
 igr2= 442, 443, 444, 446, 447, 448,
 &end
#
# 28 LEU QB 29 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 437, 438,
 &end
#
# 28 LEU QB 30 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 459, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 437, 438,
 &end
#
# 30 ASP- QB 28 LEU QB 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 463, 464,
 igr2= 437, 438,
 &end
#
# 28 LEU QB 32 TRP HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 437, 438,
 &end
#
# 32 TRP HD1 28 LEU QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 494,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 437, 438,
 &end
#
# 28 LEU QB 32 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 437, 438,
 &end
#
# 28 LEU QB 32 TRP QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 437, 438,
 igr2= 490, 491,
 &end
#
# 28 LEU QQD 29 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 32 TRP HD1 28 LEU QQD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 494,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 442, 443, 444, 446, 447, 448,
 &end
#
# 28 LEU QQD 32 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 28 LEU QQD 32 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 32 TRP QB 28 LEU QQD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 490, 491,
 igr2= 442, 443, 444, 446, 447, 448,
 &end
#
# 28 LEU QQD 33 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 28 LEU QQD 34 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 442, 443, 444, 446, 447, 448,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 28 LEU QQD 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 442, 443, 444, 446, 447, 448,
 &end
#
# 28 LEU QQD 6 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 442, 443, 444, 446, 447, 448,
 igr2= 104, 105, 106,
 &end
#
# 28 LEU QQD 6 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 442, 443, 444, 446, 447, 448,
 igr2=  97,  98,  99,
 &end
#
# 29 GLY HN 29 GLY QA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 452,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 454, 455,
 &end
#
# 29 GLY HN 30 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 452, 459, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 29 GLY HN 31 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 452, 471, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 32 TRP HD1 29 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 452, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 29 GLY HN 32 TRP HE1 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 452, 496, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 30 ASP- HN 29 GLY QA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 454, 455,
 &end
#
# 31 GLU- HN 29 GLY QA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 471,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 454, 455,
 &end
#
# 32 TRP HN 29 GLY QA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 454, 455,
 &end
#
# 3 ASN HN 3 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  36,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=  40,  41,
 &end
#
# 3 ASN QD2 3 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  36, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  45,  46,
 &end
#
# 4 LYS+ HA 3 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  36, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 4 LYS+ HN 3 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  36, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 3 ASN QD2 3 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  45,  46,
 igr2=  40,  41,
 &end
#
# 31 GLU- HA 3 ASN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 473,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  40,  41,
 &end
#
# 3 ASN QB 33 LYS+ HA 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  40,  41,
 &end
#
# 33 LYS+ HN 3 ASN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  40,  41,
 &end
#
# 3 ASN QB 33 LYS+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  40,  41,
 igr2= 520, 521,
 &end
#
# 33 LYS+ QG 3 ASN QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 517, 518,
 igr2=  40,  41,
 &end
#
# 4 LYS+ HN 3 ASN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  40,  41,
 &end
#
# 5 ILE QD1 3 ASN QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  85,  86,  87,
 igr2=  40,  41,
 &end
#
# 30 ASP- HA 3 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  45,  46,
 &end
#
# 3 ASN QD2 31 GLU- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 473, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  45,  46,
 &end
#
# 31 GLU- HN 3 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 471,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  45,  46,
 &end
#
# 31 GLU- QB 3 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 475, 476,
 igr2=  45,  46,
 &end
#
# 3 ASN QD2 32 TRP HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  45,  46,
 &end
#
# 3 ASN QD2 32 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  45,  46,
 &end
#
# 33 LYS+ HA 3 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 512,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  45,  46,
 &end
#
# 3 ASN QD2 33 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  45,  46,
 &end
#
# 33 LYS+ QB 3 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 514, 515,
 igr2=  45,  46,
 &end
#
# 33 LYS+ QD 3 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 520, 521,
 igr2=  45,  46,
 &end
#
# 33 LYS+ QE 3 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 523, 524,
 igr2=  45,  46,
 &end
#
# 33 LYS+ QG 3 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 517, 518,
 igr2=  45,  46,
 &end
#
# 3 ASN QD2 4 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  50, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  45,  46,
 &end
#
# 5 ILE HN 3 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  45,  46,
 &end
#
# 5 ILE QD1 3 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  85,  86,  87,
 igr2=  45,  46,
 &end
#
# 30 ASP- HN 30 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 461, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 30 ASP- HA 30 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 463, 464,
 &end
#
# 31 GLU- HN 30 ASP- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 471, 461, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 30 ASP- HA 31 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 478, 479,
 &end
#
# 32 TRP HN 30 ASP- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 461, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 30 ASP- HN 30 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 463, 464,
 &end
#
# 31 GLU- HN 30 ASP- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 471, 459, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 31 GLU- QG 30 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 459, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 478, 479,
 &end
#
# 32 TRP HD1 30 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 459, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 30 ASP- HN 32 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 486, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 30 ASP- QB 31 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 463, 464,
 &end
#
# 32 TRP HN 30 ASP- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 463, 464,
 &end
#
# 31 GLU- HN 31 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 471, 473, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 31 GLU- QB 31 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 473, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 475, 476,
 &end
#
# 31 GLU- HA 31 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 473,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 478, 479,
 &end
#
# 32 TRP HN 31 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 473, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 LYS+ HN 31 GLU- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  50, 473, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 31 GLU- HN 31 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 471,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 475, 476,
 &end
#
# 31 GLU- HN 31 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 471,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 478, 479,
 &end
#
# 32 TRP HA 31 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 488, 471, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 TRP HD1 31 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 471, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 31 GLU- HN 32 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 471, 496, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 31 GLU- HN 32 TRP HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 471, 486, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 31 GLU- QB 32 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 475, 476,
 &end
#
# 31 GLU- QB 32 TRP HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 475, 476,
 &end
#
# 32 TRP HE1 31 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 478, 479,
 &end
#
# 31 GLU- QG 32 TRP HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 478, 479,
 &end
#
# 32 TRP HA 32 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 488, 496, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 TRP HN 32 TRP HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 488, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 32 TRP QB 32 TRP HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 490, 491,
 &end
#
# 33 LYS+ HN 32 TRP HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 488, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 4 LYS+ HN 32 TRP HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  50, 488, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 LYS+ QB 32 TRP HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 488, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  54,  55,
 &end
#
# 32 TRP HA 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 488,  91, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 TRP HA 6 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  97,  98,  99,
 &end
#
# 32 TRP HD1 32 TRP HE1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 496, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 32 TRP HD1 32 TRP HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 486, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 32 TRP HD1 32 TRP QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 494,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 490, 491,
 &end
#
# 32 TRP HH2 32 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 501, 496, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 TRP HE1 32 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 496, 486, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 TRP HZ2 32 TRP HE1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 499, 496, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 32 TRP QB 32 TRP HE1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 490, 491,
 &end
#
# 4 LYS+ QB 32 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  54,  55,
 &end
#
# 4 LYS+ QD 32 TRP HE1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  60,  61,
 &end
#
# 32 TRP HN 32 TRP QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 490, 491,
 &end
#
# 32 TRP HN 33 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 510, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 4 LYS+ HN 32 TRP HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  50, 486, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 TRP HZ3 6 ILE HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 503,  95, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 32 TRP HZ3 77 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 503,1151, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 33 LYS+ HN 32 TRP QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 490, 491,
 &end
#
# 32 TRP QB 34 VAL HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 536, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 490, 491,
 &end
#
# 32 TRP QB 34 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 490, 491,
 &end
#
# 32 TRP QB 34 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 490, 491,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 32 TRP QB 6 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 490, 491,
 igr2=  97,  98,  99,
 &end
#
# 33 LYS+ HN 33 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 512, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 33 LYS+ HA 33 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 512,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 514, 515,
 &end
#
# 33 LYS+ QD 33 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 520, 521,
 &end
#
# 33 LYS+ QE 33 LYS+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 523, 524,
 &end
#
# 33 LYS+ HA 33 LYS+ QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 512,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 517, 518,
 &end
#
# 34 VAL HN 33 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 532, 512, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 34 VAL QQG 33 LYS+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 538, 539, 540, 542, 543, 544,
 &end
#
# 33 LYS+ HA 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 512,  91, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 33 LYS+ HN 33 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 514, 515,
 &end
#
# 33 LYS+ QD 33 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 520, 521,
 &end
#
# 33 LYS+ QG 33 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 517, 518,
 &end
#
# 34 VAL HA 33 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 534, 510, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 33 LYS+ HN 34 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 532, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 35 TYR QE 33 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 558, 563,
 &end
#
# 4 LYS+ HA 33 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  52, 510, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 33 LYS+ HN 4 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  50, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 4 LYS+ QB 33 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  54,  55,
 &end
#
# 5 ILE HA 33 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  74, 510, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 5 ILE QG1 33 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  82,  83,
 &end
#
# 5 ILE QG2 33 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  78,  79,  80,
 &end
#
# 33 LYS+ HN 6 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  91, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 33 LYS+ HN 6 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  97,  98,  99,
 &end
#
# 33 LYS+ QE 33 LYS+ QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 523, 524,
 igr2= 514, 515,
 &end
#
# 33 LYS+ QG 33 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 517, 518,
 igr2= 514, 515,
 &end
#
# 34 VAL HN 33 LYS+ QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 514, 515,
 &end
#
# 35 TYR QE 33 LYS+ QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 558, 563,
 igr2= 514, 515,
 &end
#
# 33 LYS+ QB 4 LYS+ HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  52, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 514, 515,
 &end
#
# 5 ILE HA 33 LYS+ QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 514, 515,
 &end
#
# 6 ILE HN 33 LYS+ QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 514, 515,
 &end
#
# 33 LYS+ QE 33 LYS+ QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 523, 524,
 igr2= 520, 521,
 &end
#
# 33 LYS+ QD 34 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 520, 521,
 &end
#
# 33 LYS+ QE 34 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 523, 524,
 &end
#
# 34 VAL HN 33 LYS+ QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 517, 518,
 &end
#
# 33 LYS+ QG 34 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 517, 518,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 33 LYS+ QG 5 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 517, 518,
 igr2=  82,  83,
 &end
#
# 34 VAL HB 34 VAL HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 536, 534, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 34 VAL HA 34 VAL HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 534, 532, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 34 VAL HA 34 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 35 TYR HN 34 VAL HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 534, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 34 VAL HA 5 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  78,  79,  80,
 &end
#
# 34 VAL HA 6 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 534,  91, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 34 VAL HA 6 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=  97,  98,  99,
 &end
#
# 34 VAL HB 34 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 536, 532, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 34 VAL HB 34 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 536,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 34 VAL HB 35 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 536, 548, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 34 VAL HN 34 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 35 TYR HN 34 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 532, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 35 TYR QE 34 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 558, 563,
 &end
#
# 5 ILE HA 34 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  74, 532, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 5 ILE QG2 34 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  78,  79,  80,
 &end
#
# 6 ILE HN 34 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  91, 532, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 34 VAL QQG 35 TYR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 550, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 538, 539, 540, 542, 543, 544,
 &end
#
# 35 TYR HN 34 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 34 VAL QQG 36 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 538, 539, 540, 542, 543, 544,
 &end
#
# 34 VAL QQG 6 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 538, 539, 540, 542, 543, 544,
 &end
#
# 34 VAL QQG 6 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 538, 539, 540, 542, 543, 544,
 igr2=  97,  98,  99,
 &end
#
# 8 PHE QB 34 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 135, 136,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 8 PHE QE 34 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 141, 145,
 igr2= 538, 539, 540, 542, 543, 544,
 &end
#
# 35 TYR HA 35 TYR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 548, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 35 TYR QB 35 TYR HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 550, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 552, 553,
 &end
#
# 36 SER HN 35 TYR HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 569, 550, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 35 TYR QB 35 TYR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 548, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 552, 553,
 &end
#
# 35 TYR QE 35 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 548, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 558, 563,
 &end
#
# 36 SER HN 35 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 569, 548, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 35 TYR HN 6 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  91, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6 ILE QD1 35 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 548, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 104, 105, 106,
 &end
#
# 35 TYR HN 6 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  97,  98,  99,
 &end
#
# 7 TYR HA 35 TYR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 548, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 35 TYR HN 7 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 110, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 71 ILE QG2 35 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 548, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1069,1070,1071,
 &end
#
# 35 TYR HN 8 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 131, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 8 PHE QE 35 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 548, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 141, 145,
 &end
#
# 35 TYR QE 35 TYR QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 558, 563,
 igr2= 552, 553,
 &end
#
# 35 TYR QB 36 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 552, 553,
 &end
#
# 35 TYR QB 71 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 552, 553,
 igr2=1076,1077,1078,
 &end
#
# 35 TYR QB 71 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 552, 553,
 igr2=1069,1070,1071,
 &end
#
# 35 TYR QB 8 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 552, 553,
 &end
#
# 35 TYR QE 5 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 558, 563,
 igr2=  85,  86,  87,
 &end
#
# 35 TYR QE 5 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 558, 563,
 igr2=  78,  79,  80,
 &end
#
# 35 TYR QE 6 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 558, 563,
 &end
#
# 35 TYR QE 71 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 558, 563,
 igr2=1076,1077,1078,
 &end
#
# 35 TYR QE 71 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 558, 563,
 igr2=1069,1070,1071,
 &end
#
# 36 SER HA 36 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 571, 569, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 36 SER HA 36 SER QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 571,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 573, 574,
 &end
#
# 37 ALA HN 36 SER HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 571, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 36 SER HA 7 TYR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 571, 112, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 PHE HN 36 SER HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 131, 571, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 8 PHE QB 36 SER HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 571, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 135, 136,
 &end
#
# 9 LEU QQD 36 SER HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 571, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 36 SER QB 36 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 573, 574,
 &end
#
# 36 SER HN 37 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 569, 580, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7 TYR HA 36 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 569, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 7 TYR QE 36 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 120, 125,
 &end
#
# 71 ILE QG2 36 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1069,1070,1071,
 &end
#
# 36 SER HN 8 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 569, 131, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 36 SER QB 37 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 580, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 573, 574,
 &end
#
# 36 SER QB 8 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 573, 574,
 &end
#
# 37 ALA HN 37 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 582, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 37 ALA HA 37 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 584, 585, 586,
 &end
#
# 38 GLY HN 37 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 590, 582, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 37 ALA HA 65 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 978, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 37 ALA HA 65 ASP- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 982, 983,
 &end
#
# 67 ILE HA 37 ALA HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1011, 582, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 37 ALA HA 67 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 582,1009, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 37 ALA HN 37 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 584, 585, 586,
 &end
#
# 38 GLY HN 37 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 590, 580, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 38 GLY QA 37 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 580, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 592, 593,
 &end
#
# 7 TYR HA 37 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 580, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 7 TYR QE 37 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 580, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 120, 125,
 &end
#
# 37 ALA HN 8 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 131, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9 LEU HA 37 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 580, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9 LEU HG 37 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158, 580, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 37 ALA HN 9 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 151, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 9 LEU QQD 37 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 580, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 38 GLY HN 37 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 590,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 584, 585, 586,
 &end
#
# 65 ASP- HN 37 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 584, 585, 586,
 &end
#
# 37 ALA QB 65 ASP- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 584, 585, 586,
 igr2= 982, 983,
 &end
#
# 37 ALA QB 66 ILE HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 992, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 584, 585, 586,
 &end
#
# 66 ILE HN 37 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 990,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 584, 585, 586,
 &end
#
# 37 ALA QB 67 ILE HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1011, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 584, 585, 586,
 &end
#
# 67 ILE HN 37 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1009,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 584, 585, 586,
 &end
#
# 67 ILE QD1 37 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1022,1023,1024,
 igr2= 584, 585, 586,
 &end
#
# 37 ALA QB 67 ILE QG1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 584, 585, 586,
 igr2=1019,1020,
 &end
#
# 7 TYR HH 37 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 584, 585, 586,
 &end
#
# 7 TYR QE 37 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 120, 125,
 igr2= 584, 585, 586,
 &end
#
# 9 LEU QQD 37 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 160, 161, 162, 164, 165, 166,
 igr2= 584, 585, 586,
 &end
#
# 38 GLY HN 38 GLY QA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 590,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 592, 593,
 &end
#
# 39 ILE HN 38 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 597, 590, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 40 GLU- HN 38 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 616, 590, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 GLY HN 41 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 590,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 635, 636, 637,
 &end
#
# 38 GLY HN 65 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 590, 978, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 GLY HN 66 ILE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 590, 992, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 38 GLY HN 66 ILE HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 590, 994, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 GLY HN 66 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 590, 990, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 GLY HN 66 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 590,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 996, 997, 998,
 &end
#
# 67 ILE HA 38 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1011, 590, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 67 ILE HB 38 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1013, 590, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 38 GLY HN 67 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 590,1009, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 67 ILE QD1 38 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1022,1023,1024,
 &end
#
# 67 ILE QG1 38 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1019,1020,
 &end
#
# 7 TYR QE 38 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 120, 125,
 &end
#
# 9 LEU QQD 38 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 39 ILE HN 38 GLY QA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 597,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 592, 593,
 &end
#
# 38 GLY QA 40 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 592, 593,
 &end
#
# 90 PRO HA 38 GLY QA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1338,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 592, 593,
 &end
#
# 39 ILE HB 39 ILE HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 599, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 39 ILE HA 39 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 599, 597, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 39 ILE QD1 39 ILE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 610, 611, 612,
 &end
#
# 39 ILE QG1 39 ILE HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 607, 608,
 &end
#
# 39 ILE HA 39 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 603, 604, 605,
 &end
#
# 39 ILE HA 40 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 599, 616, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 39 ILE HA 66 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 996, 997, 998,
 &end
#
# 39 ILE HA 67 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 599,1009, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 67 ILE QD1 39 ILE HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1022,1023,1024,
 &end
#
# 39 ILE HB 39 ILE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 597, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 39 ILE HB 39 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 610, 611, 612,
 &end
#
# 39 ILE HB 39 ILE QG1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 607, 608,
 &end
#
# 39 ILE HB 39 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 603, 604, 605,
 &end
#
# 40 GLU- HN 39 ILE HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 616, 601, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 39 ILE HB 67 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1022,1023,1024,
 &end
#
# 39 ILE QD1 39 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 610, 611, 612,
 &end
#
# 39 ILE QG1 39 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 607, 608,
 &end
#
# 39 ILE HN 39 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 597,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 603, 604, 605,
 &end
#
# 39 ILE HN 40 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 597, 616, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 67 ILE QD1 39 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1022,1023,1024,
 &end
#
# 9 LEU QQD 39 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 90 PRO QB 39 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1335,1336,
 &end
#
# 90 PRO QD 39 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1329,1330,
 &end
#
# 90 PRO QG 39 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1332,1333,
 &end
#
# 39 ILE QD1 39 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 610, 611, 612,
 igr2= 607, 608,
 &end
#
# 39 ILE QD1 40 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 610, 611, 612,
 &end
#
# 39 ILE QD1 40 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 610, 611, 612,
 igr2= 623, 624,
 &end
#
# 39 ILE QD1 88 LYS+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1298, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 610, 611, 612,
 &end
#
# 39 ILE QD1 88 LYS+ QE 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 610, 611, 612,
 igr2=1309,1310,
 &end
#
# 39 ILE QD1 89 CYX HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 610, 611, 612,
 &end
#
# 39 ILE QD1 89 CYX HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 610, 611, 612,
 &end
#
# 39 ILE QD1 90 PRO HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1338, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 610, 611, 612,
 &end
#
# 90 PRO QB 39 ILE QD1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1335,1336,
 igr2= 610, 611, 612,
 &end
#
# 67 ILE QD1 39 ILE QG1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1022,1023,1024,
 igr2= 607, 608,
 &end
#
# 90 PRO QB 39 ILE QG1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1335,1336,
 igr2= 607, 608,
 &end
#
# 40 GLU- HN 39 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 603, 604, 605,
 &end
#
# 39 ILE QG2 40 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 603, 604, 605,
 igr2= 623, 624,
 &end
#
# 4 LYS+ HN 4 LYS+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  52, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 4 LYS+ HA 4 LYS+ QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  54,  55,
 &end
#
# 4 LYS+ HA 4 LYS+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  60,  61,
 &end
#
# 4 LYS+ HA 5 ILE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  72, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 5 ILE QD1 4 LYS+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  52, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  85,  86,  87,
 &end
#
# 4 LYS+ QB 4 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  50, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  54,  55,
 &end
#
# 4 LYS+ HN 5 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  72, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5 ILE QG1 4 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  50, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  82,  83,
 &end
#
# 4 LYS+ QD 4 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  60,  61,
 igr2=  54,  55,
 &end
#
# 4 LYS+ QB 4 LYS+ QE 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  54,  55,
 igr2=  63,  64,
 &end
#
# 4 LYS+ QB 5 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  54,  55,
 &end
#
# 4 LYS+ QB 76 ASP- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  54,  55,
 igr2=1143,1144,
 &end
#
# 4 LYS+ QD 4 LYS+ QE 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  60,  61,
 igr2=  63,  64,
 &end
#
# 4 LYS+ QD 5 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  60,  61,
 &end
#
# 5 ILE QD1 4 LYS+ QE 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  85,  86,  87,
 igr2=  63,  64,
 &end
#
# 40 GLU- HA 40 GLU- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 618, 616, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 40 GLU- HA 40 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 620, 621,
 &end
#
# 40 GLU- HA 40 GLU- QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 623, 624,
 &end
#
# 41 ALA HN 40 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 631, 618, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 66 ILE HB 40 GLU- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 994, 618, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 40 GLU- HA 66 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1003,1004,1005,
 &end
#
# 40 GLU- HA 66 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 996, 997, 998,
 &end
#
# 40 GLU- QB 40 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 620, 621,
 &end
#
# 40 GLU- HN 40 GLU- QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 623, 624,
 &end
#
# 41 ALA HA 40 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 616, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 66 ILE HA 40 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 992, 616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 67 ILE QD1 40 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1022,1023,1024,
 &end
#
# 40 GLU- QB 40 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 620, 621,
 igr2= 623, 624,
 &end
#
# 41 ALA HN 40 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 620, 621,
 &end
#
# 40 GLU- QB 66 ILE QD1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 620, 621,
 igr2=1003,1004,1005,
 &end
#
# 41 ALA HN 40 GLU- QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 623, 624,
 &end
#
# 41 ALA HN 41 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 631, 633, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 ALA HA 41 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 633,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 635, 636, 637,
 &end
#
# 41 ALA HA 42 HIS HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 641, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 41 ALA HA 43 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 658, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 41 ALA HA 65 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 978, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 41 ALA HN 41 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 635, 636, 637,
 &end
#
# 42 HIS HE1 41 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 631, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 41 ALA HN 42 HIS HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 631, 641, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 41 ALA HN 65 ASP- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 631, 980, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 66 ILE HA 41 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 992, 631, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 66 ILE HB 41 ALA HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 994, 631, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 41 ALA HN 66 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1003,1004,1005,
 &end
#
# 66 ILE QG1 41 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1000,1001,
 &end
#
# 41 ALA HN 66 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 996, 997, 998,
 &end
#
# 41 ALA QB 42 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 641, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 635, 636, 637,
 &end
#
# 43 GLY HN 41 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 658,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 635, 636, 637,
 &end
#
# 41 ALA QB 64 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 967, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 635, 636, 637,
 &end
#
# 64 SER QB 41 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 971, 972,
 igr2= 635, 636, 637,
 &end
#
# 41 ALA QB 65 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 635, 636, 637,
 &end
#
# 42 HIS QB 42 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 641, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 645, 646,
 &end
#
# 43 GLY HN 42 HIS HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 641, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 44 LEU HA 42 HIS HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 667, 641, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 42 HIS QB 43 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 645, 646,
 &end
#
# 43 GLY QA 43 GLY HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 660, 661,
 &end
#
# 44 LEU HA 43 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 667, 658, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 43 GLY HN 44 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 665, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 64 SER HN 43 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 967, 658, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 64 SER QB 43 GLY HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 658, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 971, 972,
 &end
#
# 65 ASP- HN 43 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 978, 658, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 43 GLY QA 44 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 665, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 660, 661,
 &end
#
# 43 GLY QA 64 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 967, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 660, 661,
 &end
#
# 43 GLY QA 64 SER QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 660, 661,
 igr2= 971, 972,
 &end
#
# 44 LEU HA 44 LEU HG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 667, 672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 44 LEU HA 44 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 667, 665, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 44 LEU QB 44 LEU HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 667, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 669, 670,
 &end
#
# 44 LEU HA 44 LEU QQD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 667,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 674, 675, 676, 678, 679, 680,
 &end
#
# 45 ASN HN 44 LEU HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 667, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 44 LEU HA 48 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 667,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 730, 731, 732,
 &end
#
# 44 LEU HG 44 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 672, 665, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 44 LEU HG 44 LEU QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 669, 670,
 &end
#
# 44 LEU QQD 44 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU HG 45 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 672, 684, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 44 LEU QB 44 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 665, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 669, 670,
 &end
#
# 44 LEU QQD 44 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 665, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU HN 45 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 665, 684, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 49 VAL QQG 44 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 665, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 742, 743, 744, 746, 747, 748,
 &end
#
# 64 SER QB 44 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 665, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 971, 972,
 &end
#
# 44 LEU QB 44 LEU QQD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 669, 670,
 igr2= 674, 675, 676, 678, 679, 680,
 &end
#
# 45 ASN HN 44 LEU QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 669, 670,
 &end
#
# 44 LEU QB 49 VAL HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 669, 670,
 &end
#
# 44 LEU QB 49 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 669, 670,
 &end
#
# 44 LEU QB 49 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 669, 670,
 igr2= 742, 743, 744, 746, 747, 748,
 &end
#
# 44 LEU QB 59 ILE HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 896, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 669, 670,
 &end
#
# 44 LEU QB 59 ILE HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 892, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 669, 670,
 &end
#
# 44 LEU QB 59 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 669, 670,
 igr2= 905, 906, 907,
 &end
#
# 44 LEU QB 59 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 669, 670,
 igr2= 898, 899, 900,
 &end
#
# 44 LEU QB 60 SER HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 911, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 669, 670,
 &end
#
# 44 LEU QB 62 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 669, 670,
 igr2= 948, 949,
 &end
#
# 45 ASN HN 44 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 674, 675, 676, 678, 679, 680,
 &end
#
# 48 ALA QB 44 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 730, 731, 732,
 igr2= 674, 675, 676, 678, 679, 680,
 &end
#
# 49 VAL HB 44 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU QQD 49 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU QQD 60 SER HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 913, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU QQD 60 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 911, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU QQD 61 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU QQD 62 GLN HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 938, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU QQD 62 GLN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 936, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 62 GLN QB 44 LEU QQD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 940, 941,
 igr2= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU QQD 63 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 953, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 44 LEU QQD 64 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 967, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 674, 675, 676, 678, 679, 680,
 &end
#
# 45 ASN HA 45 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 684, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 45 ASN QB 45 ASN HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 688, 689,
 &end
#
# 45 ASN QD2 45 ASN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 686, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 693, 694,
 &end
#
# 45 ASN HA 46 PRO QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 686,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 699, 700,
 &end
#
# 45 ASN HA 46 PRO QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 686,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 702, 703,
 &end
#
# 45 ASN HA 47 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 712, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 45 ASN HA 48 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 726, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 45 ASN QB 45 ASN HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 688, 689,
 &end
#
# 47 ASN HN 45 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 712, 684, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 45 ASN HN 48 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 730, 731, 732,
 &end
#
# 49 VAL HN 45 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 736, 684, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 45 ASN QB 45 ASN QD2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 688, 689,
 igr2= 693, 694,
 &end
#
# 45 ASN QB 47 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 688, 689,
 &end
#
# 45 ASN QB 48 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 688, 689,
 igr2= 730, 731, 732,
 &end
#
# 45 ASN QB 49 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 688, 689,
 &end
#
# 46 PRO QD 45 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 699, 700,
 igr2= 693, 694,
 &end
#
# 45 ASN QD2 47 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 693, 694,
 &end
#
# 47 ASN QD2 45 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 721, 722,
 igr2= 693, 694,
 &end
#
# 48 ALA QB 45 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 730, 731, 732,
 igr2= 693, 694,
 &end
#
# 46 PRO HA 46 PRO QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 705, 706,
 &end
#
# 46 PRO HA 46 PRO QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 699, 700,
 &end
#
# 46 PRO HA 46 PRO QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 702, 703,
 &end
#
# 47 ASN HN 46 PRO HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 712, 708, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 46 PRO HA 49 VAL HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 708, 740, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 49 VAL HN 46 PRO HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 736, 708, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 46 PRO HA 49 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 742, 743, 744, 746, 747, 748,
 &end
#
# 46 PRO QD 46 PRO QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 699, 700,
 igr2= 705, 706,
 &end
#
# 46 PRO QB 46 PRO QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 705, 706,
 igr2= 702, 703,
 &end
#
# 47 ASN HN 46 PRO QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 705, 706,
 &end
#
# 46 PRO QD 46 PRO QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 699, 700,
 igr2= 702, 703,
 &end
#
# 46 PRO QD 47 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 699, 700,
 &end
#
# 46 PRO QD 47 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 699, 700,
 igr2= 721, 722,
 &end
#
# 46 PRO QD 48 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 726, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 699, 700,
 &end
#
# 47 ASN HN 46 PRO QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 702, 703,
 &end
#
# 47 ASN HN 47 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 712, 714, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 47 ASN QB 47 ASN HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 714, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 716, 717,
 &end
#
# 47 ASN HA 47 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 714,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 721, 722,
 &end
#
# 48 ALA HN 47 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 726, 714, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 49 VAL HN 47 ASN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 736, 714, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 50 LYS+ HN 47 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 752, 714, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 51 ALA HN 47 ASN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 774, 714, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 47 ASN HA 51 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 714,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 778, 779, 780,
 &end
#
# 47 ASN HN 47 ASN QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 716, 717,
 &end
#
# 47 ASN QD2 47 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 721, 722,
 &end
#
# 47 ASN HN 48 ALA HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 712, 726, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 49 VAL HB 47 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 740, 712, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 47 ASN HN 49 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 712, 736, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 47 ASN QB 47 ASN QD2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 716, 717,
 igr2= 721, 722,
 &end
#
# 47 ASN QB 48 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 726, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 716, 717,
 &end
#
# 47 ASN QB 51 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 774, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 716, 717,
 &end
#
# 47 ASN QD2 48 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 726, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 721, 722,
 &end
#
# 48 ALA HN 48 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 726, 728, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 48 ALA HA 48 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 728,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 730, 731, 732,
 &end
#
# 48 ALA HN 48 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 730, 731, 732,
 &end
#
# 48 ALA HN 49 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 726, 736, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 49 VAL HN 48 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 730, 731, 732,
 &end
#
# 49 VAL HA 49 VAL HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 49 VAL HA 49 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 736, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 49 VAL HA 49 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 742, 743, 744, 746, 747, 748,
 &end
#
# 50 LYS+ HN 49 VAL HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 752, 738, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 49 VAL HA 52 MET HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 784, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 49 VAL HA 59 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 738, 892, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 49 VAL HA 59 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 905, 906, 907,
 &end
#
# 49 VAL HA 59 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 898, 899, 900,
 &end
#
# 49 VAL HN 49 VAL HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 736, 740, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 49 VAL HB 49 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 742, 743, 744, 746, 747, 748,
 &end
#
# 50 LYS+ HN 49 VAL HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 752, 740, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 49 VAL HN 49 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 742, 743, 744, 746, 747, 748,
 &end
#
# 50 LYS+ HA 49 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 754, 736, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 49 VAL HN 50 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 736, 752, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 51 ALA HN 49 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 774, 736, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 49 VAL HN 51 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 778, 779, 780,
 &end
#
# 59 ILE QD1 49 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 905, 906, 907,
 &end
#
# 50 LYS+ HN 49 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 742, 743, 744, 746, 747, 748,
 &end
#
# 49 VAL QQG 53 LYS+ QD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 742, 743, 744, 746, 747, 748,
 igr2= 811, 812,
 &end
#
# 49 VAL QQG 53 LYS+ QE 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 742, 743, 744, 746, 747, 748,
 igr2= 814, 815,
 &end
#
# 49 VAL QQG 58 ASP- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 742, 743, 744, 746, 747, 748,
 igr2= 884, 885,
 &end
#
# 60 SER HA 49 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 913,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 742, 743, 744, 746, 747, 748,
 &end
#
# 60 SER HN 49 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 911,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 742, 743, 744, 746, 747, 748,
 &end
#
# 60 SER QB 49 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 915, 916,
 igr2= 742, 743, 744, 746, 747, 748,
 &end
#
# 49 VAL QQG 61 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 742, 743, 744, 746, 747, 748,
 &end
#
# 5 ILE HA 5 ILE HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  74,  76, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 5 ILE HA 5 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  74,  72, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 5 ILE HA 5 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  85,  86,  87,
 &end
#
# 5 ILE QG1 5 ILE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  74, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  82,  83,
 &end
#
# 5 ILE QG2 5 ILE HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  74, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  78,  79,  80,
 &end
#
# 6 ILE HN 5 ILE HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  74, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 5 ILE HA 6 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  97,  98,  99,
 &end
#
# 5 ILE HA 76 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  74,1139, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5 ILE HB 5 ILE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  76,  72, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 5 ILE QG1 5 ILE HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  82,  83,
 &end
#
# 5 ILE HB 74 ASN HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  76,1115, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 5 ILE HB 75 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  76,1131, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 5 ILE HB 75 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  76,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 75 ALA QB 5 ILE HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1133,1134,1135,
 &end
#
# 76 ASP- HN 5 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1139,  76, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 5 ILE HN 5 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  85,  86,  87,
 &end
#
# 5 ILE QG1 5 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  82,  83,
 &end
#
# 5 ILE QG2 5 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  78,  79,  80,
 &end
#
# 5 ILE HN 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  91, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 5 ILE HN 75 ALA HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  72,1131, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 75 ALA QB 5 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1133,1134,1135,
 &end
#
# 5 ILE HN 76 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  72,1139, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 76 ASP- QB 5 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1143,1144,
 &end
#
# 5 ILE HN 77 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  72,1151, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 71 ILE QG2 5 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1069,1070,1071,
 igr2=  85,  86,  87,
 &end
#
# 5 ILE QD1 74 ASN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  85,  86,  87,
 igr2=1119,1120,
 &end
#
# 5 ILE QD1 74 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  85,  86,  87,
 igr2=1124,1125,
 &end
#
# 75 ALA HA 5 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  85,  86,  87,
 &end
#
# 76 ASP- HN 5 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1139,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  85,  86,  87,
 &end
#
# 5 ILE QD1 77 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  85,  86,  87,
 &end
#
# 5 ILE QG1 6 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  82,  83,
 &end
#
# 5 ILE QG1 76 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  82,  83,
 &end
#
# 6 ILE HN 5 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=  78,  79,  80,
 &end
#
# 7 TYR QB 5 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 114, 115,
 igr2=  78,  79,  80,
 &end
#
# 5 ILE QG2 71 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=  78,  79,  80,
 igr2=1069,1070,1071,
 &end
#
# 5 ILE QG2 75 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1131, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  78,  79,  80,
 &end
#
# 75 ALA QB 5 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1133,1134,1135,
 igr2=  78,  79,  80,
 &end
#
# 5 ILE QG2 76 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  78,  79,  80,
 &end
#
# 50 LYS+ HA 50 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 754, 752, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 50 LYS+ HA 51 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 754, 774, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 50 LYS+ HA 52 MET HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 754, 784, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 50 LYS+ HA 53 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 754, 801, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 50 LYS+ HA 53 LYS+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 754,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 811, 812,
 &end
#
# 50 LYS+ HA 54 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 754, 823, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 50 LYS+ QB 50 LYS+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 756, 757,
 &end
#
# 50 LYS+ QG 50 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 759, 760,
 &end
#
# 50 LYS+ HN 51 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 752, 774, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 50 LYS+ HN 52 MET HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 752, 784, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 50 LYS+ QB 51 ALA HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 774, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 756, 757,
 &end
#
# 54 GLU- QB 50 LYS+ QE 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 827, 828,
 igr2= 765, 766,
 &end
#
# 54 GLU- QB 51 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 776, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 827, 828,
 &end
#
# 51 ALA HN 51 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 778, 779, 780,
 &end
#
# 51 ALA HN 52 MET HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 774, 784, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 52 MET QG 51 ALA HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 774, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 791, 792,
 &end
#
# 51 ALA HN 53 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 774, 801, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 51 ALA HN 54 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 774, 823, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 51 ALA HN 54 GLU- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 827, 828,
 &end
#
# 52 MET HN 51 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 778, 779, 780,
 &end
#
# 52 MET HA 52 MET HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 786, 784, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 52 MET QG 52 MET HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 791, 792,
 &end
#
# 52 MET HA 53 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 786, 801, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 52 MET HA 54 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 786, 823, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 52 MET HA 55 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 786, 838, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 52 MET HA 55 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 786,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 52 MET HA 56 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 786, 854, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 52 MET HA 57 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 786, 861, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 52 MET QB 52 MET HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 784, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 788, 789,
 &end
#
# 52 MET QE 52 MET HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 784, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 795, 796, 797,
 &end
#
# 52 MET HN 52 MET QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 791, 792,
 &end
#
# 52 MET HN 53 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 784, 801, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 55 VAL HN 52 MET HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 784, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 52 MET QB 52 MET QE 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 788, 789,
 igr2= 795, 796, 797,
 &end
#
# 52 MET QB 52 MET QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 788, 789,
 igr2= 791, 792,
 &end
#
# 52 MET QB 53 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 788, 789,
 &end
#
# 52 MET QB 55 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 788, 789,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 52 MET QB 57 ILE HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 865, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 788, 789,
 &end
#
# 52 MET QB 57 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 788, 789,
 &end
#
# 52 MET QB 57 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 788, 789,
 igr2= 867, 868, 869,
 &end
#
# 52 MET QB 59 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 892, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 788, 789,
 &end
#
# 52 MET QB 59 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 788, 789,
 igr2= 898, 899, 900,
 &end
#
# 52 MET QG 52 MET QE 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 791, 792,
 igr2= 795, 796, 797,
 &end
#
# 52 MET QE 55 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 838, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 795, 796, 797,
 &end
#
# 52 MET QE 56 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 854, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 795, 796, 797,
 &end
#
# 57 ILE HA 52 MET QE 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 863,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 795, 796, 797,
 &end
#
# 52 MET QE 57 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 795, 796, 797,
 &end
#
# 52 MET QE 57 ILE QD1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 795, 796, 797,
 igr2= 874, 875, 876,
 &end
#
# 52 MET QE 57 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 795, 796, 797,
 igr2= 867, 868, 869,
 &end
#
# 52 MET QE 58 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 795, 796, 797,
 &end
#
# 52 MET QG 53 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 791, 792,
 &end
#
# 52 MET QG 59 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 791, 792,
 igr2= 905, 906, 907,
 &end
#
# 59 ILE QG2 52 MET QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 898, 899, 900,
 igr2= 791, 792,
 &end
#
# 53 LYS+ HN 53 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 801, 803, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 53 LYS+ HA 53 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 803,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 805, 806,
 &end
#
# 53 LYS+ HA 53 LYS+ QD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 803,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 811, 812,
 &end
#
# 53 LYS+ QG 53 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 803, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 808, 809,
 &end
#
# 54 GLU- HN 53 LYS+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 823, 803, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 53 LYS+ HA 55 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 803, 838, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 53 LYS+ HA 56 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 803, 854, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 53 LYS+ HA 57 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 803, 861, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 53 LYS+ HA 58 ASP- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 803, 882, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 53 LYS+ HN 53 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 805, 806,
 &end
#
# 53 LYS+ QD 53 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 811, 812,
 &end
#
# 53 LYS+ QE 53 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 814, 815,
 &end
#
# 53 LYS+ QG 53 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 808, 809,
 &end
#
# 54 GLU- HA 53 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 825, 801, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 53 LYS+ HN 54 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 801, 823, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 53 LYS+ HN 55 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 801, 838, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 55 VAL QQG 53 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 844, 845, 846, 848, 849, 850,
 &end
#
# 53 LYS+ HN 56 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 801, 854, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 53 LYS+ HN 57 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 801, 861, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 58 ASP- HA 53 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 801, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 59 ILE QD1 53 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 905, 906, 907,
 &end
#
# 54 GLU- HN 53 LYS+ QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 823,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 805, 806,
 &end
#
# 53 LYS+ QD 53 LYS+ QE 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 811, 812,
 igr2= 814, 815,
 &end
#
# 53 LYS+ QG 53 LYS+ QE 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 808, 809,
 igr2= 814, 815,
 &end
#
# 53 LYS+ QE 57 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 814, 815,
 &end
#
# 58 ASP- HN 53 LYS+ QE 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 880,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 814, 815,
 &end
#
# 53 LYS+ QG 54 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 823, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 808, 809,
 &end
#
# 53 LYS+ QG 56 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 854, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 808, 809,
 &end
#
# 56 GLY QA 53 LYS+ QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 856, 857,
 igr2= 808, 809,
 &end
#
# 53 LYS+ QG 57 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 808, 809,
 &end
#
# 54 GLU- HN 54 GLU- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 823, 825, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 54 GLU- HA 54 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 825,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 827, 828,
 &end
#
# 54 GLU- HA 54 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 825,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 830, 831,
 &end
#
# 55 VAL HN 54 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 825, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 54 GLU- HA 55 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 825,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 56 GLY HN 54 GLU- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 854, 825, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 54 GLU- HN 54 GLU- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 823,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 827, 828,
 &end
#
# 54 GLU- HN 54 GLU- QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 823,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 830, 831,
 &end
#
# 55 VAL HA 54 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 840, 823, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 54 GLU- HN 55 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 823, 838, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 54 GLU- HN 55 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 823,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 54 GLU- HN 56 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 823, 854, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 54 GLU- QB 54 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 827, 828,
 igr2= 830, 831,
 &end
#
# 55 VAL HN 54 GLU- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 827, 828,
 &end
#
# 55 VAL QQG 54 GLU- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2= 827, 828,
 &end
#
# 55 VAL HN 54 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 830, 831,
 &end
#
# 55 VAL QQG 54 GLU- QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2= 830, 831,
 &end
#
# 55 VAL HA 55 VAL HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 840, 842, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 55 VAL HN 55 VAL HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 840, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 55 VAL HA 55 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 840,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 56 GLY HN 55 VAL HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 854, 840, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 55 VAL HA 57 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 840, 861, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 55 VAL HN 55 VAL HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 842, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 55 VAL QQG 55 VAL HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 842, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 844, 845, 846, 848, 849, 850,
 &end
#
# 56 GLY HN 55 VAL HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 854, 842, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 57 ILE QD1 55 VAL HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 842, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 874, 875, 876,
 &end
#
# 55 VAL HN 55 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 844, 845, 846, 848, 849, 850,
 &end
#
# 55 VAL HN 56 GLY HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 854, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 56 GLY QA 55 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 838, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 856, 857,
 &end
#
# 55 VAL HN 57 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 838, 861, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 57 ILE QD1 55 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 838, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 874, 875, 876,
 &end
#
# 55 VAL QQG 56 GLY HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 854, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 844, 845, 846, 848, 849, 850,
 &end
#
# 55 VAL QQG 56 GLY QA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2= 856, 857,
 &end
#
# 55 VAL QQG 57 ILE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 844, 845, 846, 848, 849, 850,
 &end
#
# 55 VAL QQG 57 ILE QD1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2= 874, 875, 876,
 &end
#
# 55 VAL QQG 58 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 844, 845, 846, 848, 849, 850,
 &end
#
# 56 GLY QA 56 GLY HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 854, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 856, 857,
 &end
#
# 57 ILE QD1 56 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 854, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 874, 875, 876,
 &end
#
# 57 ILE QG1 56 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 854, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 871, 872,
 &end
#
# 57 ILE QG2 56 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 854, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 867, 868, 869,
 &end
#
# 56 GLY QA 57 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 856, 857,
 &end
#
# 57 ILE HB 57 ILE HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 865, 863, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 57 ILE HN 57 ILE HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 861, 863, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 57 ILE HA 57 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 863,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 874, 875, 876,
 &end
#
# 57 ILE QG1 57 ILE HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 871, 872,
 &end
#
# 57 ILE HA 57 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 863,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 867, 868, 869,
 &end
#
# 57 ILE HA 58 ASP- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 863, 880, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 57 ILE HN 57 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 861, 865, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 57 ILE QD1 57 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 865, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 874, 875, 876,
 &end
#
# 57 ILE HB 57 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 865,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 871, 872,
 &end
#
# 57 ILE HB 57 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 865,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 867, 868, 869,
 &end
#
# 57 ILE QD1 57 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 874, 875, 876,
 &end
#
# 57 ILE QG1 57 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 871, 872,
 &end
#
# 57 ILE HN 57 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 867, 868, 869,
 &end
#
# 58 ASP- HA 57 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 861, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 57 ILE HN 58 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 861, 880, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 57 ILE QD1 57 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 874, 875, 876,
 igr2= 871, 872,
 &end
#
# 57 ILE QD1 57 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 874, 875, 876,
 igr2= 867, 868, 869,
 &end
#
# 57 ILE QD1 58 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 874, 875, 876,
 &end
#
# 57 ILE QG1 58 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 871, 872,
 &end
#
# 57 ILE QG2 58 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 867, 868, 869,
 &end
#
# 57 ILE QG2 59 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 892, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 867, 868, 869,
 &end
#
# 57 ILE QG2 59 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 867, 868, 869,
 igr2= 898, 899, 900,
 &end
#
# 57 ILE QG2 60 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 911, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 867, 868, 869,
 &end
#
# 58 ASP- HN 58 ASP- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 880, 882, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 58 ASP- HA 58 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 882,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 884, 885,
 &end
#
# 59 ILE HN 58 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 892, 882, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 59 ILE QG2 58 ASP- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 882, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 898, 899, 900,
 &end
#
# 58 ASP- HA 61 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 922, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 58 ASP- HN 58 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 880,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 884, 885,
 &end
#
# 59 ILE HN 58 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 892, 880, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 60 SER HN 58 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 911, 880, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 58 ASP- QB 59 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 892, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 884, 885,
 &end
#
# 58 ASP- QB 60 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 911, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 884, 885,
 &end
#
# 59 ILE HA 59 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 894, 896, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 59 ILE HA 59 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 894, 892, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 59 ILE QD1 59 ILE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 894, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 905, 906, 907,
 &end
#
# 59 ILE QG1 59 ILE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 894, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 902, 903,
 &end
#
# 59 ILE HA 59 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 894,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 898, 899, 900,
 &end
#
# 60 SER HN 59 ILE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 911, 894, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 59 ILE HA 61 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 894, 922, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 59 ILE HA 61 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 894,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 931, 932,
 &end
#
# 59 ILE HA 62 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 894, 936, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 59 ILE QD1 59 ILE HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 896, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 905, 906, 907,
 &end
#
# 59 ILE QG2 59 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 896, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 898, 899, 900,
 &end
#
# 59 ILE QD1 59 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 892, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 905, 906, 907,
 &end
#
# 59 ILE QG1 59 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 892, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 902, 903,
 &end
#
# 59 ILE HN 59 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 892,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 898, 899, 900,
 &end
#
# 60 SER HA 59 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 913, 892, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 60 SER HN 59 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 911, 892, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 59 ILE HN 61 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 892, 922, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 59 ILE QD1 60 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 911, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 905, 906, 907,
 &end
#
# 59 ILE QD1 62 GLN HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 936, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 905, 906, 907,
 &end
#
# 59 ILE QG1 62 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 902, 903,
 igr2= 948, 949,
 &end
#
# 59 ILE QG2 61 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 898, 899, 900,
 &end
#
# 6 ILE HA 6 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  95, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 6 ILE HA 6 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  91, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 6 ILE QD1 6 ILE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  93, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 104, 105, 106,
 &end
#
# 6 ILE QG1 6 ILE HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  93, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 101, 102,
 &end
#
# 7 TYR HN 6 ILE HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  93, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 6 ILE HA 75 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1133,1134,1135,
 &end
#
# 6 ILE HA 76 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  93,1139, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6 ILE HA 77 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  93,1151, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 6 ILE HA 77 LEU QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1155,1156,
 &end
#
# 6 ILE HN 6 ILE HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  95, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 6 ILE HB 6 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 104, 105, 106,
 &end
#
# 6 ILE QG1 6 ILE HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 101, 102,
 &end
#
# 6 ILE QG2 6 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  97,  98,  99,
 &end
#
# 7 TYR HN 6 ILE HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  95, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LEU QB 6 ILE HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  95, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
# 6 ILE QD1 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 104, 105, 106,
 &end
#
# 6 ILE QG1 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 101, 102,
 &end
#
# 6 ILE HN 6 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=  97,  98,  99,
 &end
#
# 71 ILE QG2 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1069,1070,1071,
 &end
#
# 75 ALA HA 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1131,  91, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 75 ALA QB 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1133,1134,1135,
 &end
#
# 6 ILE HN 76 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  91,1139, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 76 ASP- QB 6 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  91, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1143,1144,
 &end
#
# 6 ILE QD1 6 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 104, 105, 106,
 igr2= 101, 102,
 &end
#
# 6 ILE QD1 6 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 104, 105, 106,
 igr2=  97,  98,  99,
 &end
#
# 6 ILE QD1 7 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 104, 105, 106,
 &end
#
# 6 ILE QD1 77 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 104, 105, 106,
 &end
#
# 6 ILE QD1 77 LEU QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 104, 105, 106,
 igr2=1155,1156,
 &end
#
# 6 ILE QD1 77 LEU QQD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 104, 105, 106,
 igr2=1160,1161,1162,1164,1165,1166,
 &end
#
# 6 ILE QD1 79 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 104, 105, 106,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 6 ILE QG1 7 TYR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 101, 102,
 &end
#
# 6 ILE QG1 77 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 101, 102,
 &end
#
# 77 LEU QQD 6 ILE QG1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2= 101, 102,
 &end
#
# 6 ILE QG1 79 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 101, 102,
 &end
#
# 60 SER HA 60 SER HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 913, 911, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 60 SER HA 61 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 913, 922, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 60 SER HA 62 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 913, 936, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 60 SER QB 60 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 911, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 915, 916,
 &end
#
# 61 ASN HA 60 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 924, 911, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 60 SER HN 61 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 911, 922, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 60 SER HN 62 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 911, 936, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 60 SER QB 61 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 915, 916,
 &end
#
# 60 SER QB 61 ASN QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 915, 916,
 igr2= 926, 927,
 &end
#
# 60 SER QB 62 GLN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 936, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 915, 916,
 &end
#
# 61 ASN HN 61 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 922, 924, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 61 ASN HA 61 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 924,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 926, 927,
 &end
#
# 61 ASN HA 61 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 924,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 931, 932,
 &end
#
# 62 GLN HN 61 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 936, 924, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 61 ASN HA 63 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 924, 953, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 61 ASN HN 61 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 926, 927,
 &end
#
# 61 ASN QD2 61 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 931, 932,
 &end
#
# 62 GLN HA 61 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 922, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 61 ASN HN 62 GLN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 922, 936, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 61 ASN HN 63 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 922, 953, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 61 ASN QD2 61 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 931, 932,
 igr2= 926, 927,
 &end
#
# 62 GLN HN 61 ASN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 936,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 926, 927,
 &end
#
# 63 THR HN 61 ASN QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 953,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 926, 927,
 &end
#
# 62 GLN HN 62 GLN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 936, 938, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 62 GLN QB 62 GLN HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 938, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 940, 941,
 &end
#
# 62 GLN HA 62 GLN QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 938,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 943, 944,
 &end
#
# 63 THR HN 62 GLN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 953, 938, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 63 THR QG2 62 GLN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 938, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 959, 960, 961,
 &end
#
# 62 GLN QB 62 GLN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 936, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 940, 941,
 &end
#
# 62 GLN QG 62 GLN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 936, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 943, 944,
 &end
#
# 62 GLN HN 63 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 936, 953, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 62 GLN QB 63 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 953, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 940, 941,
 &end
#
# 62 GLN QB 63 THR QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 940, 941,
 igr2= 959, 960, 961,
 &end
#
# 62 GLN QG 62 GLN QE2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 943, 944,
 igr2= 948, 949,
 &end
#
# 63 THR HA 62 GLN QE2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 955,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 948, 949,
 &end
#
# 62 GLN QG 63 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 953, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 943, 944,
 &end
#
# 63 THR HA 63 THR HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 955, 953, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 63 THR QG2 63 THR HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 959, 960, 961,
 &end
#
# 64 SER HN 63 THR HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 967, 957, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 63 THR QG2 63 THR HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 953, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 959, 960, 961,
 &end
#
# 63 THR QG2 64 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 967, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 959, 960, 961,
 &end
#
# 64 SER QB 64 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 967, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 971, 972,
 &end
#
# 65 ASP- HA 64 SER HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 980, 967, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 65 ASP- HN 64 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 978, 967, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 64 SER QB 65 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 971, 972,
 &end
#
# 65 ASP- HN 65 ASP- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 978, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 65 ASP- HA 65 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 980,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 982, 983,
 &end
#
# 66 ILE HN 65 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 990, 980, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 66 ILE QG1 65 ASP- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 980, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1000,1001,
 &end
#
# 65 ASP- QB 65 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 978, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 982, 983,
 &end
#
# 66 ILE HN 65 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 990, 978, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 65 ASP- QB 66 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 990, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 982, 983,
 &end
#
# 66 ILE HA 66 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 992, 994, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 66 ILE HN 66 ILE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 990, 992, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 66 ILE HA 66 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 992,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 996, 997, 998,
 &end
#
# 67 ILE HN 66 ILE HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1009, 992, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 67 ILE QD1 66 ILE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 992, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1022,1023,1024,
 &end
#
# 66 ILE HB 66 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 994, 990, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 66 ILE HB 66 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1003,1004,1005,
 &end
#
# 66 ILE HB 66 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1000,1001,
 &end
#
# 66 ILE HB 66 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 996, 997, 998,
 &end
#
# 66 ILE HB 67 ILE HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 994,1013, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 67 ILE HN 66 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1009, 994, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 66 ILE HN 66 ILE QD1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 990,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1003,1004,1005,
 &end
#
# 66 ILE HN 66 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 990,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1000,1001,
 &end
#
# 66 ILE HN 66 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 990,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 996, 997, 998,
 &end
#
# 66 ILE HN 67 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 990,1009, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 66 ILE QD1 66 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1003,1004,1005,
 igr2=1000,1001,
 &end
#
# 67 ILE HN 66 ILE QD1 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1009,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1003,1004,1005,
 &end
#
# 67 ILE HN 66 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1009,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 996, 997, 998,
 &end
#
# 67 ILE HA 67 ILE HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1011,1013, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 67 ILE HA 67 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1011,1009, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 67 ILE HA 67 ILE QD1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1011,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1022,1023,1024,
 &end
#
# 67 ILE QG1 67 ILE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1011, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1019,1020,
 &end
#
# 67 ILE HA 67 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1011,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1015,1016,1017,
 &end
#
# 68 ASP- HN 67 ILE HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1028,1011, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 67 ILE HN 67 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1009,1013, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 67 ILE HB 67 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1022,1023,1024,
 &end
#
# 67 ILE HB 67 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1015,1016,1017,
 &end
#
# 67 ILE HB 68 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1013,1028, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 67 ILE HN 67 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1009,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1022,1023,1024,
 &end
#
# 67 ILE HN 67 ILE QG1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1009,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1019,1020,
 &end
#
# 68 ASP- HN 67 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1028,1009, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9 LEU QQD 67 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1009, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 67 ILE QD1 9 LEU HG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1022,1023,1024,
 &end
#
# 9 LEU QB 67 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 155, 156,
 igr2=1022,1023,1024,
 &end
#
# 9 LEU QQD 67 ILE QD1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 160, 161, 162, 164, 165, 166,
 igr2=1022,1023,1024,
 &end
#
# 67 ILE QD1 90 PRO QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1022,1023,1024,
 igr2=1335,1336,
 &end
#
# 67 ILE QD1 90 PRO QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1022,1023,1024,
 igr2=1332,1333,
 &end
#
# 67 ILE QD1 91 MET HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1022,1023,1024,
 &end
#
# 67 ILE QG1 68 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1028, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1019,1020,
 &end
#
# 68 ASP- HN 67 ILE QG2 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1028,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1015,1016,1017,
 &end
#
# 67 ILE QG2 69 SER HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1015,1016,1017,
 &end
#
# 67 ILE QG2 69 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1015,1016,1017,
 &end
#
# 7 TYR QE 67 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 120, 125,
 igr2=1015,1016,1017,
 &end
#
# 67 ILE QG2 70 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1015,1016,1017,
 &end
#
# 67 ILE QG2 71 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1063, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1015,1016,1017,
 &end
#
# 67 ILE QG2 72 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1082, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1015,1016,1017,
 &end
#
# 67 ILE QG2 72 LEU QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1015,1016,1017,
 igr2=1086,1087,
 &end
#
# 9 LEU HG 67 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1015,1016,1017,
 &end
#
# 9 LEU QQD 67 ILE QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 160, 161, 162, 164, 165, 166,
 igr2=1015,1016,1017,
 &end
#
# 68 ASP- QB 68 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1030, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1032,1033,
 &end
#
# 68 ASP- HA 70 ASP- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1030,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1055,1056,
 &end
#
# 68 ASP- HA 71 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1030,1063, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 68 ASP- HN 68 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1028,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1032,1033,
 &end
#
# 69 SER HN 68 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1028, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7 TYR HH 68 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 123,1028, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7 TYR QE 68 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1028, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 120, 125,
 &end
#
# 70 ASP- HN 68 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1028, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 71 ILE HB 68 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1067,1028, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 68 ASP- HN 71 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1028,1063, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 71 ILE QD1 68 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1028, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1076,1077,1078,
 &end
#
# 9 LEU QQD 68 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1028, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 68 ASP- QB 69 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1032,1033,
 &end
#
# 68 ASP- QB 71 ILE HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1067, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1032,1033,
 &end
#
# 68 ASP- QB 71 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1032,1033,
 igr2=1076,1077,1078,
 &end
#
# 71 ILE QG2 68 ASP- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1069,1070,1071,
 igr2=1032,1033,
 &end
#
# 72 LEU HN 68 ASP- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1082,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1032,1033,
 &end
#
# 69 SER HA 69 SER HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1042,1040, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 69 SER HA 70 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1042,1051, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 69 SER HA 71 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1042,1063, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 69 SER HA 72 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1042,1082, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 72 LEU QB 69 SER HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1086,1087,
 &end
#
# 72 LEU QQD 69 SER HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1091,1092,1093,1095,1096,1097,
 &end
#
# 69 SER HA 73 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1042,1101, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 69 SER HA 73 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1042,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1110,1111,
 &end
#
# 69 SER QB 69 SER HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1044,1045,
 &end
#
# 70 ASP- HA 69 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1053,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 69 SER HN 70 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1051, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 69 SER HN 71 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1063, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 72 LEU QB 69 SER HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1086,1087,
 &end
#
# 69 SER QB 70 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1044,1045,
 &end
#
# 69 SER QB 73 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1044,1045,
 igr2=1110,1111,
 &end
#
# 7 TYR HN 7 TYR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 112, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 7 TYR QB 7 TYR HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 112, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 114, 115,
 &end
#
# 8 PHE HN 7 TYR HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 131, 112, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 7 TYR HH 71 ILE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 123,1063, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 7 TYR QB 7 TYR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 114, 115,
 &end
#
# 75 ALA HN 7 TYR HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=1129, 110, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 7 TYR HN 75 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1133,1134,1135,
 &end
#
# 77 LEU HG 7 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1158, 110, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LEU HN 7 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1151, 110, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LEU QB 7 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
# 77 LEU QQD 7 TYR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1160,1161,1162,1164,1165,1166,
 &end
#
# 78 VAL QQG 7 TYR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1176,1177,1178,1180,1181,1182,
 &end
#
# 79 VAL QQG 7 TYR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 7 TYR QB 75 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 114, 115,
 &end
#
# 7 TYR QB 75 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 114, 115,
 igr2=1133,1134,1135,
 &end
#
# 7 TYR QB 77 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 114, 115,
 &end
#
# 78 VAL HA 7 TYR QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1172,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
# 7 TYR QB 78 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1170, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 114, 115,
 &end
#
# 7 TYR QB 78 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 114, 115,
 igr2=1176,1177,1178,1180,1181,1182,
 &end
#
# 7 TYR QB 79 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 114, 115,
 &end
#
# 7 TYR QB 8 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 114, 115,
 &end
#
# 7 TYR QE 71 ILE HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1067, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 120, 125,
 &end
#
# 7 TYR QE 71 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1063, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 120, 125,
 &end
#
# 7 TYR QE 72 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1082, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 120, 125,
 &end
#
# 7 TYR QE 72 LEU QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 120, 125,
 igr2=1086,1087,
 &end
#
# 70 ASP- HN 70 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1053, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 70 ASP- HA 70 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1053,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1055,1056,
 &end
#
# 70 ASP- HA 71 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1053,1063, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 70 ASP- HA 72 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1053,1082, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 73 ASN QD2 70 ASP- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1053, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1110,1111,
 &end
#
# 74 ASN QD2 70 ASP- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1053, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1124,1125,
 &end
#
# 70 ASP- QB 70 ASP- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1055,1056,
 &end
#
# 71 ILE HA 70 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1065,1051, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 70 ASP- HN 71 ILE HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1063, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 71 ILE QD1 70 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1076,1077,1078,
 &end
#
# 71 ILE QG1 70 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1073,1074,
 &end
#
# 71 ILE QG2 70 ASP- HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1069,1070,1071,
 &end
#
# 70 ASP- HN 72 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1082, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 72 LEU QB 70 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1086,1087,
 &end
#
# 70 ASP- HN 73 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1101, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 73 ASN QD2 70 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1051, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1110,1111,
 &end
#
# 71 ILE HN 70 ASP- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1063,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1055,1056,
 &end
#
# 71 ILE QG2 70 ASP- QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1069,1070,1071,
 igr2=1055,1056,
 &end
#
# 70 ASP- QB 72 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1082, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1055,1056,
 &end
#
# 71 ILE HA 71 ILE HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1065,1067, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 71 ILE HA 71 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1065,1063, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 71 ILE HA 71 ILE QD1 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1065,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1076,1077,1078,
 &end
#
# 71 ILE HA 71 ILE QG1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1065,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1073,1074,
 &end
#
# 71 ILE QG2 71 ILE HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1065, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1069,1070,1071,
 &end
#
# 71 ILE HA 72 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1065,1082, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 71 ILE HA 73 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1065,1101, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 71 ILE HA 74 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1065,1115, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 ASN QB 71 ILE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1065, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1119,1120,
 &end
#
# 71 ILE HA 74 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1065,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1124,1125,
 &end
#
# 71 ILE HN 71 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1063,1067, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 71 ILE HB 71 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1067,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1076,1077,1078,
 &end
#
# 71 ILE HB 71 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1067,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1073,1074,
 &end
#
# 71 ILE QG2 71 ILE HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1067, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1069,1070,1071,
 &end
#
# 71 ILE HB 72 LEU HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1067,1082, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 71 ILE HN 71 ILE QD1 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1063,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1076,1077,1078,
 &end
#
# 71 ILE QG1 71 ILE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1063, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1073,1074,
 &end
#
# 71 ILE QG2 71 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1063, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1069,1070,1071,
 &end
#
# 72 LEU HG 71 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1089,1063, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 71 ILE HN 72 LEU HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1063,1082, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 73 ASN HN 71 ILE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1101,1063, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 71 ILE HN 75 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1063,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1133,1134,1135,
 &end
#
# 71 ILE QD1 71 ILE QG1 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1076,1077,1078,
 igr2=1073,1074,
 &end
#
# 71 ILE QD1 71 ILE QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1076,1077,1078,
 igr2=1069,1070,1071,
 &end
#
# 71 ILE QD1 72 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1082, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1076,1077,1078,
 &end
#
# 71 ILE QG1 72 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1082, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1073,1074,
 &end
#
# 71 ILE QG2 72 LEU HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1084, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1069,1070,1071,
 &end
#
# 71 ILE QG2 72 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1082, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1069,1070,1071,
 &end
#
# 71 ILE QG2 73 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1101, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1069,1070,1071,
 &end
#
# 71 ILE QG2 74 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1115, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1069,1070,1071,
 &end
#
# 74 ASN QD2 71 ILE QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1124,1125,
 igr2=1069,1070,1071,
 &end
#
# 71 ILE QG2 75 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1069,1070,1071,
 &end
#
# 71 ILE QG2 75 ALA QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1069,1070,1071,
 igr2=1133,1134,1135,
 &end
#
# 72 LEU HA 72 LEU HG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1084,1089, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 72 LEU HN 72 LEU HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1082,1084, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 72 LEU QB 72 LEU HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1084, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1086,1087,
 &end
#
# 72 LEU HA 74 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1084,1115, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 72 LEU HA 75 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1084,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 75 ALA QB 72 LEU HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1084, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1133,1134,1135,
 &end
#
# 72 LEU HN 72 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1082,1089, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 72 LEU QB 72 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1089, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1086,1087,
 &end
#
# 73 ASN HN 72 LEU HG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1101,1089, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 93 PRO QD 72 LEU HG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1089, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1374,1375,
 &end
#
# 93 PRO QG 72 LEU HG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1089, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1377,1378,
 &end
#
# 72 LEU HN 72 LEU QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1082,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1086,1087,
 &end
#
# 72 LEU HN 73 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1082,1101, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 72 LEU HN 74 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1082,1115, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 74 ASN QB 72 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1082, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1119,1120,
 &end
#
# 72 LEU HN 75 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1082,1129, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 72 LEU QB 73 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1101, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1086,1087,
 &end
#
# 72 LEU QB 73 ASN QD2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1086,1087,
 igr2=1110,1111,
 &end
#
# 72 LEU QB 74 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1115, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1086,1087,
 &end
#
# 72 LEU QB 92 THR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1361, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1086,1087,
 &end
#
# 72 LEU QB 92 THR QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1086,1087,
 igr2=1365,1366,1367,
 &end
#
# 72 LEU QB 93 PRO QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1086,1087,
 igr2=1374,1375,
 &end
#
# 72 LEU QB 93 PRO QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1086,1087,
 igr2=1377,1378,
 &end
#
# 73 ASN HN 73 ASN HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1101,1103, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 73 ASN QB 73 ASN HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1105,1106,
 &end
#
# 74 ASN HN 73 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1115,1103, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 73 ASN HA 75 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1103,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 93 PRO QB 73 ASN HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1380,1381,
 &end
#
# 93 PRO QG 73 ASN HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1377,1378,
 &end
#
# 96 VAL QQG 73 ASN HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1424,1425,1426,1428,1429,1430,
 &end
#
# 73 ASN HN 73 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1105,1106,
 &end
#
# 73 ASN QD2 73 ASN HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1101, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1110,1111,
 &end
#
# 74 ASN HA 73 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1117,1101, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 73 ASN HN 74 ASN HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1101,1115, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 73 ASN HN 75 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1101,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 73 ASN HN 93 PRO QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1380,1381,
 &end
#
# 93 PRO QG 73 ASN HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1101, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1377,1378,
 &end
#
# 73 ASN QD2 73 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1110,1111,
 igr2=1105,1106,
 &end
#
# 74 ASN HN 73 ASN QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1105,1106,
 &end
#
# 74 ASN HA 74 ASN HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1117,1115, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 ASN HA 74 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1117,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1119,1120,
 &end
#
# 74 ASN HA 74 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1117,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1124,1125,
 &end
#
# 74 ASN HA 75 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1117,1129, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 74 ASN HN 74 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1119,1120,
 &end
#
# 74 ASN HN 74 ASN QD2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1124,1125,
 &end
#
# 74 ASN HN 75 ALA HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1115,1129, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 74 ASN QD2 74 ASN QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1124,1125,
 igr2=1119,1120,
 &end
#
# 74 ASN QB 75 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1119,1120,
 &end
#
# 74 ASN QD2 75 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1124,1125,
 &end
#
# 74 ASN QD2 75 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1124,1125,
 igr2=1133,1134,1135,
 &end
#
# 75 ALA HN 75 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1129,1131, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 75 ALA HA 75 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1133,1134,1135,
 &end
#
# 76 ASP- HN 75 ALA HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1139,1131, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 77 LEU HN 75 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1131, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 75 ALA HN 75 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1133,1134,1135,
 &end
#
# 75 ALA HN 76 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1129,1139, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LEU HN 75 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1129, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 96 VAL QQG 75 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1424,1425,1426,1428,1429,1430,
 &end
#
# 76 ASP- HN 75 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1139,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1133,1134,1135,
 &end
#
# 77 LEU HN 75 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1133,1134,1135,
 &end
#
# 78 VAL QQG 75 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1176,1177,1178,1180,1181,1182,
 igr2=1133,1134,1135,
 &end
#
# 75 ALA QB 96 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1133,1134,1135,
 igr2=1424,1425,1426,1428,1429,1430,
 &end
#
# 76 ASP- HN 76 ASP- HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1139,1141, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 76 ASP- HA 76 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1141,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1143,1144,
 &end
#
# 77 LEU HN 76 ASP- HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1141, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 96 VAL QQG 76 ASP- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1141, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1424,1425,1426,1428,1429,1430,
 &end
#
# 76 ASP- HN 76 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1139,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1143,1144,
 &end
#
# 76 ASP- HN 77 LEU HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1139,1151, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 77 LEU HN 76 ASP- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1143,1144,
 &end
#
# 77 LEU HN 77 LEU HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1153, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LEU HA 77 LEU QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1153,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1155,1156,
 &end
#
# 77 LEU HA 77 LEU QQD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1153,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1160,1161,1162,1164,1165,1166,
 &end
#
# 77 LEU HA 78 VAL HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1153,1170, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 78 VAL QQG 77 LEU HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1153, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1176,1177,1178,1180,1181,1182,
 &end
#
# 77 LEU HA 97 LYS+ QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1153,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1438,1439,
 &end
#
# 77 LEU HA 98 ARG+ HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1153,1458, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 77 LEU QB 77 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1158, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1155,1156,
 &end
#
# 77 LEU QQD 77 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1158, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1160,1161,1162,1164,1165,1166,
 &end
#
# 77 LEU HG 78 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1158,1170, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LEU HG 79 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1158,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 77 LEU QB 77 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1155,1156,
 &end
#
# 77 LEU QQD 77 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1160,1161,1162,1164,1165,1166,
 &end
#
# 77 LEU HN 78 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1151,1170, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 77 LEU HN 78 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1176,1177,1178,1180,1181,1182,
 &end
#
# 77 LEU QQD 77 LEU QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1155,1156,
 &end
#
# 78 VAL HN 77 LEU QQD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1160,1161,1162,1164,1165,1166,
 &end
#
# 77 LEU QQD 79 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 97 LYS+ QB 77 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1438,1439,
 igr2=1160,1161,1162,1164,1165,1166,
 &end
#
# 77 LEU QQD 97 LYS+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1444,1445,
 &end
#
# 77 LEU QQD 97 LYS+ QE 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1447,1448,
 &end
#
# 97 LYS+ QG 77 LEU QQD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1441,1442,
 igr2=1160,1161,1162,1164,1165,1166,
 &end
#
# 98 ARG+ HA 77 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1458,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1160,1161,1162,1164,1165,1166,
 &end
#
# 77 LEU QQD 99 GLU- HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1482, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1160,1161,1162,1164,1165,1166,
 &end
#
# 99 GLU- HN 77 LEU QQD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1160,1161,1162,1164,1165,1166,
 &end
#
# 77 LEU QQD 99 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1487,1488,
 &end
#
# 78 VAL HA 99 GLU- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1172,1480, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 78 VAL HN 78 VAL HB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1170,1174, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 78 VAL HB 78 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1176,1177,1178,1180,1181,1182,
 &end
#
# 78 VAL HB 79 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1174,1186, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 78 VAL HB 92 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1365,1366,1367,
 &end
#
# 78 VAL HB 98 ARG+ HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1174,1458, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 78 VAL HB 98 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1174,1456, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 78 VAL HN 78 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1176,1177,1178,1180,1181,1182,
 &end
#
# 79 VAL QQG 78 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1170, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 97 LYS+ QB 78 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1170, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1438,1439,
 &end
#
# 97 LYS+ QG 78 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1170, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1441,1442,
 &end
#
# 78 VAL HN 98 ARG+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1170,1458, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 98 ARG+ QG 78 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1170, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1463,1464,
 &end
#
# 99 GLU- HN 78 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1480,1170, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 99 GLU- QG 78 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1170, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1487,1488,
 &end
#
# 78 VAL QQG 79 VAL HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1188, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1176,1177,1178,1180,1181,1182,
 &end
#
# 78 VAL QQG 79 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1176,1177,1178,1180,1181,1182,
 &end
#
# 78 VAL QQG 80 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1176,1177,1178,1180,1181,1182,
 &end
#
# 9 LEU HG 78 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1176,1177,1178,1180,1181,1182,
 &end
#
# 78 VAL QQG 96 VAL HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1420, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1176,1177,1178,1180,1181,1182,
 &end
#
# 96 VAL QQG 78 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1424,1425,1426,1428,1429,1430,
 igr2=1176,1177,1178,1180,1181,1182,
 &end
#
# 78 VAL QQG 97 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1434, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1176,1177,1178,1180,1181,1182,
 &end
#
# 98 ARG+ HA 78 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1458,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1176,1177,1178,1180,1181,1182,
 &end
#
# 78 VAL QQG 98 ARG+ QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1176,1177,1178,1180,1181,1182,
 igr2=1463,1464,
 &end
#
# 99 GLU- HN 78 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1176,1177,1178,1180,1181,1182,
 &end
#
# 79 VAL HN 79 VAL HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1186,1188, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 79 VAL QQG 79 VAL HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1188, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 80 THR HN 79 VAL HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1188, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 99 GLU- HN 79 VAL HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1480,1188, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 79 VAL HN 79 VAL HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1186,1190, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 79 VAL HB 79 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1190,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 79 VAL HB 8 PHE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1190, 133, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 8 PHE QE 79 VAL HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1190, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 141, 145,
 &end
#
# 79 VAL HB 80 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1190,1202, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 79 VAL HB 9 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1190, 151, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 99 GLU- QB 79 VAL HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1190, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1484,1485,
 &end
#
# 79 VAL QQG 79 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 8 PHE HA 79 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 133,1186, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 8 PHE QB 79 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 135, 136,
 &end
#
# 79 VAL HN 9 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1186, 151, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9 LEU QB 79 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 155, 156,
 &end
#
# 99 GLU- HN 79 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1480,1186, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 99 GLU- QB 79 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1484,1485,
 &end
#
# 8 PHE HA 79 VAL QQG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 79 VAL QQG 8 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 8 PHE QE 79 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 141, 145,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 80 THR HN 79 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 79 VAL QQG 81 LEU HG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1223, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 79 VAL QQG 81 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 79 VAL QQG 9 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 151, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 79 VAL QQG 99 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1480, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1192,1193,1194,1196,1197,1198,
 &end
#
# 79 VAL QQG 99 GLU- QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1192,1193,1194,1196,1197,1198,
 igr2=1484,1485,
 &end
#
# 99 GLU- QG 79 VAL QQG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1487,1488,
 igr2=1192,1193,1194,1196,1197,1198,
 &end
#
# 8 PHE HA 8 PHE HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 133, 131, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 8 PHE QB 8 PHE HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 135, 136,
 &end
#
# 8 PHE QE 8 PHE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 141, 145,
 &end
#
# 8 PHE HA 80 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 133,1202, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 PHE HA 81 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 133,1216, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 8 PHE HA 9 LEU HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat= 133, 151, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 9 LEU QQD 8 PHE HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 8 PHE QB 8 PHE HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 135, 136,
 &end
#
# 8 PHE QE 8 PHE HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 141, 145,
 &end
#
# 8 PHE QB 81 LEU QQD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 135, 136,
 igr2=1225,1226,1227,1229,1230,1231,
 &end
#
# 8 PHE QB 9 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 151, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 135, 136,
 &end
#
# 80 THR HB 80 THR HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1206,1204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 80 THR HA 80 THR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1204,1202, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 80 THR HA 80 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1208,1209,1210,
 &end
#
# 81 LEU HN 80 THR HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1216,1204, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 81 LEU QQD 80 THR HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1204, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 80 THR HA 82 CYX HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1204,1235, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 80 THR HA 9 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1204, 151, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 9 LEU QB 80 THR HA 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1204, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 155, 156,
 &end
#
# 80 THR HB 80 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1206,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1208,1209,1210,
 &end
#
# 80 THR HB 81 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1206,1216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 80 THR HN 80 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1208,1209,1210,
 &end
#
# 81 LEU HN 80 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1216,1202, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 99 GLU- QB 80 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1484,1485,
 &end
#
# 99 GLU- QG 80 THR HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1487,1488,
 &end
#
# 80 THR QG2 81 LEU HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1208,1209,1210,
 &end
#
# 80 THR QG2 82 CYX HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1208,1209,1210,
 &end
#
# 9 LEU HG 80 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1208,1209,1210,
 &end
#
# 9 LEU HN 80 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 151,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1208,1209,1210,
 &end
#
# 9 LEU QQD 80 THR QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 160, 161, 162, 164, 165, 166,
 igr2=1208,1209,1210,
 &end
#
# 80 THR QG2 92 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1208,1209,1210,
 &end
#
# 98 ARG+ QB 80 THR QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1460,1461,
 igr2=1208,1209,1210,
 &end
#
# 80 THR QG2 98 ARG+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1208,1209,1210,
 igr2=1466,1467,
 &end
#
# 80 THR QG2 98 ARG+ QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1208,1209,1210,
 igr2=1463,1464,
 &end
#
# 81 LEU HA 81 LEU HG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1218,1223, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 81 LEU HA 81 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1218,1216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 81 LEU QB 81 LEU HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1220,1221,
 &end
#
# 81 LEU QQD 81 LEU HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 81 LEU HA 82 CYX HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1218,1235, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 81 LEU QB 81 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1223, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1220,1221,
 &end
#
# 81 LEU QQD 81 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1223, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 81 LEU QB 81 LEU HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1220,1221,
 &end
#
# 81 LEU QQD 81 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 81 LEU HN 9 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1216, 151, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 81 LEU QB 81 LEU QQD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1220,1221,
 igr2=1225,1226,1227,1229,1230,1231,
 &end
#
# 81 LEU QB 82 CYX HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1220,1221,
 &end
#
# 81 LEU QB 83 GLY HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1220,1221,
 &end
#
# 81 LEU QB 9 LEU HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 151, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1220,1221,
 &end
#
# 81 LEU QQD 82 CYX HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1225,1226,1227,1229,1230,1231,
 &end
#
# 9 LEU HN 81 LEU QQD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 151,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1225,1226,1227,1229,1230,1231,
 &end
#
# 82 CYX HA 82 CYX HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1237,1235, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 82 CYX HA 82 CYX QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1237,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1239,1240,
 &end
#
# 83 GLY HN 82 CYX HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1245,1237, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 82 CYX HA 84 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1237,1252, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 82 CYX HA 89 CYX HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1237,1318, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 82 CYX HN 82 CYX QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1239,1240,
 &end
#
# 82 CYX HN 83 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1235,1245, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 82 CYX HN 84 ASP- HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=1235,1252, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 89 CYX HA 82 CYX HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1320,1235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 89 CYX QB 82 CYX HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1322,1323,
 &end
#
# 90 PRO QD 82 CYX HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1329,1330,
 &end
#
# 82 CYX QB 83 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1239,1240,
 &end
#
# 82 CYX QB 84 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1252, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1239,1240,
 &end
#
# 87 ASP- HN 82 CYX QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1239,1240,
 &end
#
# 82 CYX QB 87 ASP- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1239,1240,
 igr2=1288,1289,
 &end
#
# 82 CYX QB 89 CYX HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1239,1240,
 &end
#
# 82 CYX QB 89 CYX QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1239,1240,
 igr2=1322,1323,
 &end
#
# 83 GLY QA 83 GLY HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1247,1248,
 &end
#
# 83 GLY HN 84 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1245,1252, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 87 ASP- QB 83 GLY HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1288,1289,
 &end
#
# 83 GLY QA 84 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1252, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1247,1248,
 &end
#
# 84 ASP- QB 84 ASP- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1252, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1256,1257,
 &end
#
# 84 ASP- HN 85 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1264, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 84 ASP- HN 86 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1274, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 86 ALA QB 84 ASP- HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1252, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1278,1279,1280,
 &end
#
# 84 ASP- HN 87 ASP- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1284, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 84 ASP- HN 87 ASP- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1252,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1288,1289,
 &end
#
# 84 ASP- QB 85 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1256,1257,
 &end
#
# 84 ASP- QB 86 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1274, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1256,1257,
 &end
#
# 84 ASP- QB 86 ALA QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1256,1257,
 igr2=1278,1279,1280,
 &end
#
# 85 ALA HN 85 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1264,1266, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 85 ALA HA 85 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1266,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1268,1269,1270,
 &end
#
# 85 ALA HA 86 ALA HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1266,1274, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 87 ASP- HN 85 ALA HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1266, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 85 ALA HN 85 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1264,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1268,1269,1270,
 &end
#
# 86 ALA HA 85 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1264, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 85 ALA HN 86 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1264,1274, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 87 ASP- HN 85 ALA HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1264, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 86 ALA HN 85 ALA QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1268,1269,1270,
 &end
#
# 86 ALA HN 86 ALA HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1274,1276, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 86 ALA HA 86 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1276,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1278,1279,1280,
 &end
#
# 86 ALA HA 87 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1276,1284, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 86 ALA HN 86 ALA QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1274,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1278,1279,1280,
 &end
#
# 87 ASP- HA 86 ALA HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1286,1274, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 86 ALA HN 87 ASP- HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1274,1284, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 86 ALA QB 87 ASP- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1284, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1278,1279,1280,
 &end
#
# 86 ALA QB 88 LYS+ HA 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1298, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1278,1279,1280,
 &end
#
# 86 ALA QB 88 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1296, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1278,1279,1280,
 &end
#
# 87 ASP- HN 87 ASP- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1286, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 87 ASP- HA 87 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1286,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1288,1289,
 &end
#
# 88 LYS+ HN 87 ASP- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1296,1286, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 87 ASP- HA 89 CYX HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1286,1318, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 87 ASP- HN 87 ASP- QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1288,1289,
 &end
#
# 87 ASP- HN 88 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1296, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 88 LYS+ QD 87 ASP- HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1284, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1306,1307,
 &end
#
# 88 LYS+ HN 87 ASP- QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1288,1289,
 &end
#
# 87 ASP- QB 89 CYX HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1288,1289,
 &end
#
# 88 LYS+ HN 88 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1296,1298, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 88 LYS+ QB 88 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1298, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1300,1301,
 &end
#
# 89 CYX HN 88 LYS+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1318,1298, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 88 LYS+ HN 88 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1300,1301,
 &end
#
# 88 LYS+ HN 88 LYS+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1306,1307,
 &end
#
# 88 LYS+ HN 88 LYS+ QE 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1309,1310,
 &end
#
# 89 CYX HA 88 LYS+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1320,1296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 88 LYS+ HN 89 CYX HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1296,1318, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 88 LYS+ QB 89 CYX HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1300,1301,
 &end
#
# 89 CYX HA 89 CYX HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1320,1318, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 89 CYX HA 89 CYX QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1320,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1322,1323,
 &end
#
# 89 CYX HA 90 PRO QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1320,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1329,1330,
 &end
#
# 89 CYX HA 90 PRO QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1320,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1332,1333,
 &end
#
# 89 CYX HN 89 CYX QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1322,1323,
 &end
#
# 9 LEU QB 89 CYX HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 155, 156,
 &end
#
# 9 LEU HA 9 LEU HG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 158, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 9 LEU HA 9 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 151, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9 LEU QB 9 LEU HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 153, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 155, 156,
 &end
#
# 9 LEU QQD 9 LEU HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 153, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 9 LEU HG 9 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158, 151, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9 LEU QB 9 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 155, 156,
 &end
#
# 9 LEU QQD 9 LEU HG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 9 LEU HG 90 PRO QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1335,1336,
 &end
#
# 9 LEU HG 90 PRO QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1332,1333,
 &end
#
# 9 LEU HG 92 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1365,1366,1367,
 &end
#
# 9 LEU QB 9 LEU HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 151, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 155, 156,
 &end
#
# 9 LEU QQD 9 LEU HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 151, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 160, 161, 162, 164, 165, 166,
 &end
#
# 9 LEU QQD 9 LEU QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 160, 161, 162, 164, 165, 166,
 igr2= 155, 156,
 &end
#
# 9 LEU QB 90 PRO QB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 155, 156,
 igr2=1335,1336,
 &end
#
# 90 PRO QB 90 PRO HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1338, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1335,1336,
 &end
#
# 90 PRO HA 90 PRO QG 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1338,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1332,1333,
 &end
#
# 91 MET HN 90 PRO HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1342,1338, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 91 MET HN 90 PRO QB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1335,1336,
 &end
#
# 90 PRO QB 92 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1335,1336,
 &end
#
# 92 THR QG2 90 PRO QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1365,1366,1367,
 igr2=1335,1336,
 &end
#
# 90 PRO QD 91 MET HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1329,1330,
 &end
#
# 91 MET HN 91 MET HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1342,1344, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 91 MET QB 91 MET HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1344, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1346,1347,
 &end
#
# 91 MET QG 91 MET HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1344, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1349,1350,
 &end
#
# 92 THR HN 91 MET HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1359,1344, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 91 MET HA 92 THR QG2 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1365,1366,1367,
 &end
#
# 91 MET HN 91 MET QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1346,1347,
 &end
#
# 91 MET HN 91 MET QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1349,1350,
 &end
#
# 91 MET HN 92 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1342,1359, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 91 MET QB 91 MET QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1346,1347,
 igr2=1349,1350,
 &end
#
# 91 MET QB 92 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1346,1347,
 &end
#
# 91 MET QG 92 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1349,1350,
 &end
#
# 92 THR HB 92 THR HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1363,1361, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 92 THR HA 92 THR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1361,1359, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 92 THR HA 92 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1365,1366,1367,
 &end
#
# 92 THR HA 93 PRO QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1374,1375,
 &end
#
# 92 THR HB 92 THR HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1363,1359, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 92 THR HB 92 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1365,1366,1367,
 &end
#
# 92 THR HB 93 PRO QD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1374,1375,
 &end
#
# 96 VAL QQG 92 THR HB 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1363, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1424,1425,1426,1428,1429,1430,
 &end
#
# 92 THR HN 92 THR QG2 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1365,1366,1367,
 &end
#
# 93 PRO QD 92 THR HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1374,1375,
 &end
#
# 98 ARG+ QD 92 THR HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1466,1467,
 &end
#
# 93 PRO QD 92 THR QG2 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1374,1375,
 igr2=1365,1366,1367,
 &end
#
# 92 THR QG2 98 ARG+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1365,1366,1367,
 igr2=1466,1467,
 &end
#
# 93 PRO QD 93 PRO QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1374,1375,
 igr2=1380,1381,
 &end
#
# 93 PRO QB 93 PRO QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1380,1381,
 igr2=1377,1378,
 &end
#
# 93 PRO QB 94 PRO QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1380,1381,
 igr2=1388,1389,
 &end
#
# 93 PRO QB 95 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1380,1381,
 &end
#
# 96 VAL QQG 93 PRO QB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1424,1425,1426,1428,1429,1430,
 igr2=1380,1381,
 &end
#
# 93 PRO QD 93 PRO QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1374,1375,
 igr2=1377,1378,
 &end
#
# 93 PRO QD 96 VAL HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1422, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1374,1375,
 &end
#
# 93 PRO QD 96 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1418, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1374,1375,
 &end
#
# 93 PRO QD 96 VAL QQG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1374,1375,
 igr2=1424,1425,1426,1428,1429,1430,
 &end
#
# 93 PRO QG 95 HIS HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1377,1378,
 &end
#
# 96 VAL HA 93 PRO QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1420,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1377,1378,
 &end
#
# 93 PRO QG 96 VAL HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1418, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1377,1378,
 &end
#
# 96 VAL QQG 93 PRO QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1424,1425,1426,1428,1429,1430,
 igr2=1377,1378,
 &end
#
# 94 PRO HA 94 PRO QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1397,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1394,1395,
 &end
#
# 94 PRO QD 94 PRO HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1397, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1388,1389,
 &end
#
# 94 PRO HA 94 PRO QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1397,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1391,1392,
 &end
#
# 94 PRO HA 95 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1397,1401, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 94 PRO HA 96 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1397,1418, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 94 PRO QB 94 PRO QD 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1394,1395,
 igr2=1388,1389,
 &end
#
# 94 PRO QB 95 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1394,1395,
 &end
#
# 94 PRO QB 96 VAL HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1418, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1394,1395,
 &end
#
# 94 PRO QD 94 PRO QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1388,1389,
 igr2=1391,1392,
 &end
#
# 94 PRO QD 95 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1388,1389,
 &end
#
# 94 PRO QD 96 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1418, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1388,1389,
 &end
#
# 94 PRO QG 95 HIS HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1391,1392,
 &end
#
# 95 HIS HA 95 HIS HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1403,1401, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 95 HIS HA 95 HIS QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1403,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1405,1406,
 &end
#
# 96 VAL HN 95 HIS HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1418,1403, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 95 HIS QB 95 HIS HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1405,1406,
 &end
#
# 95 HIS HN 96 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1401,1418, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 96 VAL QQG 95 HIS HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1424,1425,1426,1428,1429,1430,
 &end
#
# 95 HIS QB 96 VAL HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1418, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1405,1406,
 &end
#
# 96 VAL HA 96 VAL HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1420,1422, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 96 VAL HN 96 VAL HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1418,1420, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 96 VAL HA 96 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1420,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1424,1425,1426,1428,1429,1430,
 &end
#
# 97 LYS+ HN 96 VAL HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1434,1420, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 96 VAL HA 98 ARG+ QB 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=1420,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1460,1461,
 &end
#
# 96 VAL HN 96 VAL HB 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1418,1422, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 96 VAL HB 96 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1422,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1424,1425,1426,1428,1429,1430,
 &end
#
# 97 LYS+ HN 96 VAL HB 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1434,1422, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 96 VAL HN 96 VAL QQG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1418,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1424,1425,1426,1428,1429,1430,
 &end
#
# 96 VAL HN 97 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1418,1434, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 96 VAL QQG 97 LYS+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1434, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1424,1425,1426,1428,1429,1430,
 &end
#
# 96 VAL QQG 98 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1456, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1424,1425,1426,1428,1429,1430,
 &end
#
# 97 LYS+ HN 97 LYS+ HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1434,1436, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 97 LYS+ HA 97 LYS+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1436,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1438,1439,
 &end
#
# 97 LYS+ HA 97 LYS+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1436,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1444,1445,
 &end
#
# 97 LYS+ HA 97 LYS+ QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1436,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1441,1442,
 &end
#
# 98 ARG+ HN 97 LYS+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1456,1436, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 97 LYS+ QB 97 LYS+ HN 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1434, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1438,1439,
 &end
#
# 97 LYS+ QE 97 LYS+ HN 1.8 7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1434, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1447,1448,
 &end
#
# 97 LYS+ HN 97 LYS+ QG 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1434,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1441,1442,
 &end
#
# 98 ARG+ HN 97 LYS+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1456,1434, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 97 LYS+ QB 97 LYS+ QE 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1438,1439,
 igr2=1447,1448,
 &end
#
# 97 LYS+ QB 98 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1456, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1438,1439,
 &end
#
# 97 LYS+ QD 97 LYS+ QE 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1444,1445,
 igr2=1447,1448,
 &end
#
# 97 LYS+ QG 97 LYS+ QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1441,1442,
 igr2=1444,1445,
 &end
#
# 97 LYS+ QD 98 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1456, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1444,1445,
 &end
#
# 97 LYS+ QG 97 LYS+ QE 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1441,1442,
 igr2=1447,1448,
 &end
#
# 98 ARG+ HN 97 LYS+ QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1456,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1441,1442,
 &end
#
# 98 ARG+ HA 98 ARG+ HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1458,1456, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 98 ARG+ QB 98 ARG+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1460,1461,
 &end
#
# 98 ARG+ HA 98 ARG+ QD 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1458,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1466,1467,
 &end
#
# 98 ARG+ QG 98 ARG+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1458, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1463,1464,
 &end
#
# 99 GLU- HN 98 ARG+ HA 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1480,1458, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 98 ARG+ HN 98 ARG+ QB 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=1456,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1460,1461,
 &end
#
# 98 ARG+ QD 98 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1456, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1466,1467,
 &end
#
# 98 ARG+ QG 98 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1456, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1463,1464,
 &end
#
# 99 GLU- HN 98 ARG+ HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1480,1456, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 99 GLU- QG 98 ARG+ HN 1.8 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1456, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1487,1488,
 &end
#
# 98 ARG+ QB 98 ARG+ QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1460,1461,
 igr2=1466,1467,
 &end
#
# 98 ARG+ QB 99 GLU- HN 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1480, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1460,1461,
 &end
#
# 98 ARG+ QG 98 ARG+ QD 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1463,1464,
 igr2=1466,1467,
 &end
#
# 99 GLU- HN 98 ARG+ QD 1.8 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1466,1467,
 &end
#
# 99 GLU- HN 98 ARG+ QG 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1463,1464,
 &end
#
# 99 GLU- HA 99 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1482,1480, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 99 GLU- QB 99 GLU- HA 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1482, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1484,1485,
 &end
#
# 99 GLU- QB 99 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1480, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1484,1485,
 &end
#
# 99 GLU- QG 99 GLU- HN 1.8 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1480, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1487,1488,
 &end
#
# 99 GLU- QB 99 GLU- QG 1.8 2.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1484,1485,
 igr2=1487,1488,
 &end
#
# 5 ILE HN 0 AMBIG 0  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr2=  45,  46,1129,
 &end
#
# 6 ILE HN 0 AMBIG 1  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 110, 532,
 &end
#
# 6 ILE HN 0 AMBIG 2  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1151, 486,
 &end
#
# 8 PHE HN 0 AMBIG 3  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 110,1186,
 &end
#
# 10 CYS HN 0 AMBIG 4  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 170,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 590, 195,
 &end
#
# 13 ASN HN 0 AMBIG 5  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 616, 658,
 &end
#
# 21 GLU- HN 0 AMBIG 6  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 363, 131,
 &end
#
# 25 LYS+ HN 0 AMBIG 7  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 373,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 433, 948, 949,
 &end
#
# 45 ASN HN 0 AMBIG 8  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 726, 693, 694,
 &end
#
# 48 ALA HN 0 AMBIG 9  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 752, 684,
 &end
#
# 48 ALA HN 0 AMBIG 10  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 774, 693, 694,
 &end
#
# 52 MET HN 0 AMBIG 11  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 823, 736,
 &end
#
# 77 LEU HN 0 AMBIG 12  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1170,1434,
 &end
#
# 78 VAL HN 0 AMBIG 13  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1186,1456, 110,
 &end
#
# 79 VAL HN 0 AMBIG 14  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1202,1170,
 &end
#
# 82 CYX HN 0 AMBIG 15  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1202,1252,
 &end
#
# 84 ASP- HN 0 AMBIG 16  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1252,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1274,1563,
 &end
#
# 117 TRP HN 0 AMBIG 17  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1713,1784,
 &end
#
# 127 ILE HN 0 AMBIG 18  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1958,1996,
 &end
#
# 129 ASN HN 0 AMBIG 19  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1958,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1932,2015,
 &end
#
# 130 ARG+ HN 0 AMBIG 20  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1972,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2015,1932,
 &end
#
# 133 GLU- HN 0 AMBIG 21  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=2037,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2052,1996,
 &end
#
# 5 ILE HN 0 AMBIG 22  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1141, 534,
 &end
#
# 6 ILE HN 0 AMBIG 23  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 514, 515,  76,
 &end
#
# 7 TYR HN 0 AMBIG 24  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=  93, 112,
 &end
#
# 7 TYR HN 0 AMBIG 25  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 534,1153,
 &end
#
# 7 TYR HN 0 AMBIG 26  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1174,  76,
 &end
#
# 8 PHE HN 0 AMBIG 27  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 573, 574, 266, 267,
 &end
#
# 8 PHE HN 0 AMBIG 28  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2= 538, 539, 540, 542, 543, 544,1190,
 &end
#
# 10 CYS HN 0 AMBIG 29  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 170,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1204, 197, 198,
 &end
#
# 11 THR HN 0 AMBIG 30  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 197, 198,1204,
 &end
#
# 12 GLY HN 0 AMBIG 31  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 195,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 601,1220,1221,
 &end
#
# 12 GLY HN 0 AMBIG 32  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 195,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr2= 620, 621, 242, 243,1332,1333,1332,1333,1300,1301,
      
 &end
#
# 13 ASN HN 0 AMBIG 33  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 592, 593, 218,
 &end
#
# 13 ASN HN 0 AMBIG 34  1.8 7.0
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 185, 573, 574, 275,
 &end
#
# 13 ASN HN 0 AMBIG 35  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 582, 172,
 &end
#
# 13 ASN HN 0 AMBIG 36  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 620, 621, 280, 281,1332,1333,
 &end
#
# 16 ARG+ HN 0 AMBIG 37  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 231, 232, 248, 249,
 &end
#
# 17 SER HN 0 AMBIG 38  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 573, 574, 275,
 &end
#
# 17 SER HN 0 AMBIG 39  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 231, 232, 248, 249,
 &end
#
# 17 SER HN 0 AMBIG 40  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 294, 295, 321, 322,
 &end
#
# 17 SER HN 0 AMBIG 41  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 311, 312, 313, 301, 302, 303,1938,1939,1940,
 &end
#
# 18 GLN HN 0 AMBIG 42  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 266, 267, 573, 574,
 &end
#
# 18 GLN HN 0 AMBIG 43  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 311, 312, 313, 905, 906, 907, 301, 302, 303,
 &end
#
# 19 MET HN 0 AMBIG 44  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 301, 302, 303, 905, 906, 907,
 &end
#
# 20 ALA HN 0 AMBIG 45  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 275, 573, 574,
 &end
#
# 20 ALA HN 0 AMBIG 46  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 242, 243, 280, 281, 245, 246,
 &end
#
# 21 GLU- HN 0 AMBIG 47  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 573, 574, 292, 266, 267,
 &end
#
# 21 GLU- HN 0 AMBIG 48  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 275, 573, 574,
 &end
#
# 21 GLU- HN 0 AMBIG 49  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2= 367, 368, 369, 280, 281, 383, 384,
 &end
#
# 22 GLY HN 0 AMBIG 50  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 275, 573, 574,
 &end
#
# 22 GLY HN 0 AMBIG 51  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 905, 906, 907, 311, 312, 313,
 &end
#
# 22 GLY HN 0 AMBIG 52  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 321, 322, 324, 325,
 &end
#
# 22 GLY HN 0 AMBIG 53  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 341, 894,
 &end
#
# 22 GLY HN 0 AMBIG 54  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 367, 368, 369, 383, 384,
 &end
#
# 23 TRP HN 0 AMBIG 55  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 905, 906, 907, 301, 302, 303,
 &end
#
# 23 TRP HN 0 AMBIG 56  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 402, 403, 294, 295, 321, 322, 399, 400, 324, 325,
      
 &end
#
# 23 TRP HN 0 AMBIG 57  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 365,1883,
 &end
#
# 24 ALA HN 0 AMBIG 58  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 363,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 319, 334, 335,
 &end
#
# 24 ALA HN 0 AMBIG 59  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 363,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 375, 275, 573, 574,
 &end
#
# 25 LYS+ HN 0 AMBIG 60  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 373,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 334, 335, 319,
 &end
#
# 25 LYS+ HN 0 AMBIG 61  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 373,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 454, 455, 397,
 &end
#
# 26 GLN HN 0 AMBIG 62  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 334, 335, 319,
 &end
#
# 26 GLN HN 0 AMBIG 63  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 383, 384, 367, 368, 369,
 &end
#
# 28 LEU HN 0 AMBIG 64  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 454, 455, 397,
 &end
#
# 32 TRP HN 0 AMBIG 65  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 475, 476, 437, 438,
 &end
#
# 33 LYS+ HN 0 AMBIG 66  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 490, 491, 523, 524,
 &end
#
# 36 SER HN 0 AMBIG 67  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 982, 983, 135, 136,
 &end
#
# 36 SER HN 0 AMBIG 68  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 982, 983, 135, 136,
 &end
#
# 37 ALA HN 0 AMBIG 69  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 573, 574, 266, 267,
 &end
#
# 37 ALA HN 0 AMBIG 70  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 592, 593, 552, 553,
 &end
#
# 37 ALA HN 0 AMBIG 71  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 133, 992,
 &end
#
# 37 ALA HN 0 AMBIG 72  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 135, 136, 982, 983,
 &end
#
# 37 ALA HN 0 AMBIG 73  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 135, 136, 982, 983,
 &end
#
# 37 ALA HN 0 AMBIG 74  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2= 155, 156, 635, 636, 637,
 &end
#
# 39 ILE HN 0 AMBIG 75  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 597,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1338, 618,
 &end
#
# 39 ILE HN 0 AMBIG 76  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 597,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 172, 582,
 &end
#
# 47 ASN HN 0 AMBIG 77  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 708, 728,
 &end
#
# 48 ALA HN 0 AMBIG 78  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 705, 706,1808,1809,
 &end
#
# 48 ALA HN 0 AMBIG 79  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 231, 232, 738,1808,1809,
 &end
#
# 48 ALA HN 0 AMBIG 80  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 778, 779, 780, 672, 759, 760,
 &end
#
# 49 VAL HN 0 AMBIG 81  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 277, 278, 805, 806,
 &end
#
# 50 LYS+ HN 0 AMBIG 82  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 708, 728, 776,
 &end
#
# 50 LYS+ HN 0 AMBIG 83  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 738, 765, 766,
 &end
#
# 51 ALA HN 0 AMBIG 84  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 765, 766,1808,1809, 738,
 &end
#
# 51 ALA HN 0 AMBIG 85  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 791, 792, 827, 828,
 &end
#
# 52 MET HN 0 AMBIG 86  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 776, 728,
 &end
#
# 52 MET HN 0 AMBIG 87  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 803, 292,
 &end
#
# 53 LYS+ HN 0 AMBIG 88  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 738, 765, 766,
 &end
#
# 53 LYS+ HN 0 AMBIG 89  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 776, 728,
 &end
#
# 53 LYS+ HN 0 AMBIG 90  1.8 7.0
 &rst
  ixpk= 0, nxpk= 0, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1891,1892, 842,
 &end
#
# 52 MET HN 0 AMBIG 91  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 742, 743, 744, 746, 747, 748, 865, 762, 763,
 &end
#
# 55 VAL HN 0 AMBIG 92  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr2= 778, 779, 780, 808, 809, 759, 760,
 &end
#
# 55 VAL HN 0 AMBIG 93  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 805, 806,1828,1829,
 &end
#
# 55 VAL HN 0 AMBIG 94  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 805, 806, 756, 757,
 &end
#
# 56 GLY HN 0 AMBIG 95  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 854,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 827, 828, 791, 792,
 &end
#
# 56 GLY HN 0 AMBIG 96  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 854,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 842,1891,1892,
 &end
#
# 56 GLY HN 0 AMBIG 97  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 854,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 863, 754,
 &end
#
# 58 ASP- HN 0 AMBIG 98  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 880,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 894, 786,
 &end
#
# 57 ILE HN 0 AMBIG 99  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 842,1891,1892,
 &end
#
# 59 ILE HN 0 AMBIG 100  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 892,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 814, 815, 884, 885,
 &end
#
# 11 THR HN 0 AMBIG 101  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 242, 243,1579,1580,
 &end
#
# 61 ASN HN 0 AMBIG 102  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 943, 944, 896,
 &end
#
# 65 ASP- HN 0 AMBIG 103  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 584, 585, 586,1000,1001,
 &end
#
# 67 ILE HN 0 AMBIG 104  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1009,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 584, 585, 586,1000,1001,
 &end
#
# 70 ASP- HN 0 AMBIG 105  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1051,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1105,1106,1119,1120,
 &end
#
# 71 ILE HN 0 AMBIG 106  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1063,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1084,1044,1045,
 &end
#
# 71 ILE HN 0 AMBIG 107  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1063,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1105,1106,1119,1120,
 &end
#
# 72 LEU HN 0 AMBIG 108  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1082,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1032,1033,1055,1056,
 &end
#
# 73 ASN HN 0 AMBIG 109  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1084,1044,1045,
 &end
#
# 73 ASN HN 0 AMBIG 110  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1067,1133,1134,1135,
 &end
#
# 74 ASN HN 0 AMBIG 111  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1131,1042,
 &end
#
# 75 ALA HN 0 AMBIG 112  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1065, 114, 115,
 &end
#
# 75 ALA HN 0 AMBIG 113  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1141,1153,
 &end
#
# 77 LEU HN 0 AMBIG 114  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1153,1141,
 &end
#
# 5 ILE HA 0 AMBIG 115  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1151, 486,
 &end
#
# 77 LEU HN 0 AMBIG 116  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  95,1444,1445,
 &end
#
# 78 VAL HN 0 AMBIG 117  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1441,1442,1460,1461,1155,1156,
 &end
#
# 78 VAL HN 0 AMBIG 118  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  93, 112,
 &end
#
# 78 VAL HN 0 AMBIG 119  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2=1444,1445,1377,1378,  95,
 &end
#
# 79 VAL HN 0 AMBIG 120  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1458, 153,
 &end
#
# 79 VAL HN 0 AMBIG 121  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1460,1461,1155,1156,1441,1442,
 &end
#
# 80 THR HN 0 AMBIG 122  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1458, 153,
 &end
#
# 80 THR HN 0 AMBIG 123  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1463,1464, 155, 156,1223,
 &end
#
# 80 THR HN 0 AMBIG 124  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1466,1467,1499,1500,
 &end
#
# 80 THR HN 0 AMBIG 125  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1516,1517,1239,1240,
 &end
#
# 82 CYX HN 0 AMBIG 126  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1223, 155, 156,
 &end
#
# 84 ASP- HN 0 AMBIG 127  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1252,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1247,1248,1565,
 &end
#
# 84 ASP- HN 0 AMBIG 128  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1252,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1266, 185,
 &end
#
# 87 ASP- HN 0 AMBIG 129  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1266, 185,
 &end
#
# 99 GLU- HN 0 AMBIG 130  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1460,1461,1441,1442,
 &end
#
# 101 TRP HN 0 AMBIG 131  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1499,1500,1466,1467,
 &end
#
# 104 ASP- HN 0 AMBIG 132  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1563,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1547,1548,1567,1568,
 &end
#
# 109 ALA HN 0 AMBIG 133  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1577,1647,
 &end
#
# 109 ALA HN 0 AMBIG 134  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1615,1616,1738,1739,
 &end
#
# 114 GLU- HN 0 AMBIG 135  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1702,1703,1687,1688,
 &end
#
# 115 GLU- HN 0 AMBIG 136  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1713,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1717,1718,1702,1703,
 &end
#
# 115 GLU- HN 0 AMBIG 137  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1713,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2=1735,1736,1778,1779,1780,1738,1739,
 &end
#
# 116 LYS+ HN 0 AMBIG 138  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1728,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1700,1603,
 &end
#
# 117 TRP HN 0 AMBIG 139  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1735,1736,1738,1739,
 &end
#
# 118 ALA HN 0 AMBIG 140  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1774,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1700,1786,
 &end
#
# 120 PHE HN 0 AMBIG 141  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1804,  -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr2=1591,1592,1778,1779,1780,1735,1736,
 &end
#
# 123 VAL HN 0 AMBIG 142  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1865,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1851,1852,1788,1789,
 &end
#
# 124 ARG+ HN 0 AMBIG 143  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1881,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1808,1809, 231, 232,
 &end
#
# 124 ARG+ HN 0 AMBIG 144  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1881,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1808,1809, 294, 295,1921,1922,
 &end
#
# 124 ARG+ HN 0 AMBIG 145  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1881,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1907, 786,
 &end
#
# 126 GLU- HN 0 AMBIG 146  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1845,1846,1885,1886,1953,1954,
 &end
#
# 127 ILE HN 0 AMBIG 147  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1953,1954,1979,1980,
 &end
#
# 127 ILE HN 0 AMBIG 148  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1953,1954,1845,1846,
 &end
#
# 127 ILE HN 0 AMBIG 149  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1924,1925,1909,1910,1962,1963,
 &end
#
# 128 GLY HN 0 AMBIG 150  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1891,1892,1924,1925,
 &end
#
# 129 ASN HN 0 AMBIG 151  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1958,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2019,2020,1936,
 &end
#
# 130 ARG+ HN 0 AMBIG 152  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1972,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2044,2045,1921,1922,
 &end
#
# 131 LEU HN 0 AMBIG 153  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1996,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2056,2057, 343, 344,
 &end
#
# 132 LYS+ HN 0 AMBIG 154  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2015,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1960,1998,1974,
 &end
#
# 132 LYS+ HN 0 AMBIG 155  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=2015,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2000,2001,1953,1954,
 &end
#
# 132 LYS+ HN 0 AMBIG 156  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2015,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2056,2057, 343, 344,
 &end
#
# 133 GLU- HN 0 AMBIG 157  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=2037,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1974,1960,1998,
 &end
#
# 133 GLU- HN 0 AMBIG 158  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=2037,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2017,2131,2132,
 &end
#
# 133 GLU- HN 0 AMBIG 159  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2037,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=2000,2001,2076,2077,2078,
 &end
#
# 134 PHE HN 0 AMBIG 160  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=2052,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1998,1974,
 &end
#
# 134 PHE HN 0 AMBIG 161  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=2052,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2122,2123,1976,1977,
 &end
#
# 134 PHE HN 0 AMBIG 162  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2052,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2131,2132,2017,
 &end
#
# 134 PHE HN 0 AMBIG 163  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=2052,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2041,2042,2086,2087,
 &end
#
# 134 PHE HN 0 AMBIG 164  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=2052,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2041,2042,1979,1980,
 &end
#
# 135 ALA HN 0 AMBIG 165  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=2072,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 437, 438,2041,2042,
 &end
#
# 135 ALA HN 0 AMBIG 166  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2072,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2000,2001,2041,2042,1979,1980,
 &end
#
# 136 GLU- HN 0 AMBIG 167  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2082,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2056,2057, 416, 417,
 &end
#
# 137 THR HN 0 AMBIG 168  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2097,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2086,2087,2041,2042,
 &end
#
# 138 GLY HN 0 AMBIG 169  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2086,2087,2041,2042,
 &end
#
# 104 ASP- HN 0 AMBIG 170  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1563,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 120 PHE HN 0 AMBIG 171  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1804,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2= 778, 779, 780,1735,1736,
 &end
#
# 101 TRP HN 0 AMBIG 172  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2=1208,1209,1210,1942,1943,
 &end
#
# 27 TYR HN 0 AMBIG 173  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=2000,2001,2076,2077,2078,
 &end
#
# 28 LEU HN 0 AMBIG 174  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=2076,2077,2078,2000,2001,
 &end
#
# 26 GLN HN 0 AMBIG 175  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr2= 871, 872, 442, 443, 444, 446, 447, 448,
 &end
#
# 23 TRP HN 0 AMBIG 176  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 898, 899, 900, 844, 845, 846, 848, 849, 850,
 &end
#
# 98 ARG+ HN 0 AMBIG 177  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1456,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr2=1160,1161,1162,1164,1165,1166,1424,1425,1426,1428,
      1429,1430,1176,1177,1178,1180,1181,1182,
 &end
#
# 99 GLU- HN 0 AMBIG 178  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1160,1161,1162,1164,1165,1166,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 103 PHE HN 0 AMBIG 179  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1543,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,1942,1943,
 &end
#
# 105 ASP- HN 0 AMBIG 180  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1575,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 8 PHE HN 0 AMBIG 181  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1176,1177,1178,1180,1181,1182,1225,1226,1227,1229,
      1230,1231,
 &end
#
# 9 LEU HN 0 AMBIG 182  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 151,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2=1225,1226,1227,1229,1230,1231,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 4 LYS+ QB 0 AMBIG 183  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  54,  55,
 igr2= 486,1151,
 &end
#
# 97 LYS+ HN 0 AMBIG 184  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1434,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1153,1141,
 &end
#
# 7 TYR HN 0 AMBIG 185  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr2=  97,  98,  99, 538, 539, 540, 542, 543, 544,1091,
      1092,1093,1095,1096,1097,
 &end
#
# 8 PHE HN 0 AMBIG 186  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr2= 160, 161, 162, 164, 165, 166, 101, 102,
 &end
#
# 16 ARG+ HN 0 AMBIG 187  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 301, 302, 303,1945,1946,1947,
 &end
#
# 16 ARG+ HN 0 AMBIG 188  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 20 ALA HN 0 AMBIG 189  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 277, 278,1936, 245, 246,
 &end
#
# 20 ALA HN 0 AMBIG 190  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 297, 298, 343, 344,
 &end
#
# 21 GLU- HN 0 AMBIG 191  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 343, 344, 386, 387, 297, 298,
 &end
#
# 35 TYR HN 0 AMBIG 192  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1133,1134,1135,1067,
 &end
#
# 35 TYR HN 0 AMBIG 193  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 324, 325, 321, 322,
 &end
#
# 36 SER HN 0 AMBIG 194  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 324, 325, 321, 322,
 &end
#
# 37 ALA HN 0 AMBIG 195  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 280, 281, 321, 322, 324, 325,
 &end
#
# 37 ALA HN 0 AMBIG 196  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1022,1023,1024,1015,1016,1017,
 &end
#
# 38 GLY HN 0 AMBIG 197  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 590,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 996, 997, 998, 635, 636, 637,
 &end
#
# 41 ALA HN 0 AMBIG 198  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2=1000,1001, 584, 585, 586,
 &end
#
# 45 ASN HN 0 AMBIG 199  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 47 ASN HN 0 AMBIG 200  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 48 ALA HN 0 AMBIG 201  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 48 ALA HN 0 AMBIG 202  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 905, 906, 907, 301, 302, 303,
 &end
#
# 50 LYS+ HN 0 AMBIG 203  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 50 LYS+ HN 0 AMBIG 204  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 905, 906, 907, 301, 302, 303,
 &end
#
# 52 MET HN 0 AMBIG 205  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 905, 906, 907, 301, 302, 303,
 &end
#
# 53 LYS+ HN 0 AMBIG 206  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 844, 845, 846, 848, 849, 850, 898, 899, 900,
 &end
#
# 55 VAL HN 0 AMBIG 207  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1891,1892, 830, 831,
 &end
#
# 59 ILE HN 0 AMBIG 208  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 892,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 59 ILE HN 0 AMBIG 209  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 892,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 896, 791, 792, 943, 944,
 &end
#
# 60 SER HN 0 AMBIG 210  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 911,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 62 GLN HN 0 AMBIG 211  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 936,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 959, 960, 961, 669, 670,
 &end
#
# 70 ASP- HN 0 AMBIG 212  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1051,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 72 LEU HN 0 AMBIG 213  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1082,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2=1073,1074,1424,1425,1426,1428,1429,1430,
 &end
#
# 73 ASN HN 0 AMBIG 214  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 73 ASN HN 0 AMBIG 215  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2=1424,1425,1426,1428,1429,1430,1073,1074,
 &end
#
# 74 ASN HN 0 AMBIG 216  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2=1424,1425,1426,1428,1429,1430,1073,1074,
 &end
#
# 79 VAL HN 0 AMBIG 217  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1158,1208,1209,1210,
 &end
#
# 81 LEU HN 0 AMBIG 218  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1216,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1223, 155, 156,
 &end
#
# 91 MET HN 0 AMBIG 219  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 610, 611, 612,1365,1366,1367,
 &end
#
# 109 ALA HN 0 AMBIG 220  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1788,1789,1621,1622,
 &end
#
# 109 ALA HN 0 AMBIG 221  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1652,1653,1720,1721,
 &end
#
# 111 GLY HN 0 AMBIG 222  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1652,1653,1720,1721,
 &end
#
# 111 GLY HN 0 AMBIG 223  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2=1735,1736,1675,1676,1677,
 &end
#
# 113 GLU- HN 0 AMBIG 224  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1683,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1675,1676,1677,1735,1736,
 &end
#
# 114 GLU- HN 0 AMBIG 225  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1675,1676,1677,1735,1736,
 &end
#
# 115 GLU- HN 0 AMBIG 226  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1713,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2=1675,1676,1677,1735,1736,
 &end
#
# 118 ALA HN 0 AMBIG 227  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1774,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1705,1706,1720,1721,
 &end
#
# 122 ARG+ HN 0 AMBIG 228  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1841,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 123 VAL HN 0 AMBIG 229  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1865,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 301, 302, 303,1945,1946,1947,
 &end
#
# 124 ARG+ HN 0 AMBIG 230  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1881,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 124 ARG+ HN 0 AMBIG 231  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1881,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1891,1892,1924,1925,
 &end
#
# 125 ASP- HN 0 AMBIG 232  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1905,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877, 844, 845, 846, 848, 849, 850,1942,1943,
      
 &end
#
# 125 ASP- HN 0 AMBIG 233  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1905,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 301, 302, 303,1945,1946,1947,1938,1939,1940,
 &end
#
# 126 GLU- HN 0 AMBIG 234  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr2=1942,1943,1871,1872,1873,1875,1876,1877,1871,1872,
      1873,1875,1876,1877,
 &end
#
# 126 GLU- HN 0 AMBIG 235  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1945,1946,1947,1938,1939,1940,
 &end
#
# 128 GLY HN 0 AMBIG 236  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr2=1942,1943,1871,1872,1873,1875,1876,1877,1871,1872,
      1873,1875,1876,1877,
 &end
#
# 128 GLY HN 0 AMBIG 237  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1938,1939,1940,1945,1946,1947,
 &end
#
# 129 ASN HN 0 AMBIG 238  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1958,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1938,1939,1940,2005,2006,2007,2009,2010,2011,1945,
      1946,1947,
 &end
#
# 130 ARG+ HN 0 AMBIG 239  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1972,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=2005,2006,2007,2009,2010,2011,1945,1946,1947,1938,
      1939,1940,
 &end
#
# 135 ALA HN 0 AMBIG 240  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=2072,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2089,2090,2044,2045,
 &end
#
# 138 GLY HN 0 AMBIG 241  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=2111,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2089,2090,2044,2045,
 &end
#
# 4 LYS+ HN 0 AMBIG 242  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=  54,  55,  60,  61,
 &end
#
# 16 ARG+ HN 0 AMBIG 243  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 245, 246, 242, 243,
 &end
#
# 18 GLN HN 0 AMBIG 244  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 275, 573, 574,
 &end
#
# 20 ALA HN 0 AMBIG 245  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 309, 240,
 &end
#
# 26 GLN HN 0 AMBIG 246  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 399, 400, 402, 403,
 &end
#
# 26 GLN HN 0 AMBIG 247  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 399, 400, 377, 378,
 &end
#
# 41 ALA HN 0 AMBIG 248  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 635, 636, 637, 996, 997, 998,
 &end
#
# 47 ASN HN 0 AMBIG 249  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 716, 717, 705, 706,
 &end
#
# 48 ALA HN 0 AMBIG 250  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 728, 708,
 &end
#
# 49 VAL HN 0 AMBIG 251  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 51 ALA HN 0 AMBIG 252  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 776, 728,
 &end
#
# 54 GLU- HN 0 AMBIG 253  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 823,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 830, 831,1891,1892,
 &end
#
# 66 ILE HN 0 AMBIG 254  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 990,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 996, 997, 998, 635, 636, 637,
 &end
#
# 72 LEU HN 0 AMBIG 255  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1082,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2=1089,1091,1092,1093,1095,1096,1097,
 &end
#
# 74 ASN HN 0 AMBIG 256  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1119,1120,1105,1106,
 &end
#
# 78 VAL HN 0 AMBIG 257  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1160,1161,1162,1164,1165,1166,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 80 THR HN 0 AMBIG 258  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1206,1482,
 &end
#
# 80 THR HN 0 AMBIG 259  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1225,1226,1227,1229,1230,1231,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 88 LYS+ HN 0 AMBIG 260  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 187, 188, 189,1303,1304,
 &end
#
# 97 LYS+ HN 0 AMBIG 261  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1434,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1420,1436,
 &end
#
# 97 LYS+ HN 0 AMBIG 262  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1434,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1444,1445,1377,1378,
 &end
#
# 98 ARG+ HN 0 AMBIG 263  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1456,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1441,1442,1460,1461,
 &end
#
# 114 GLU- HN 0 AMBIG 264  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1702,1703,1687,1688,
 &end
#
# 114 GLU- HN 0 AMBIG 265  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1705,1706,1690,1691,
 &end
#
# 115 GLU- HN 0 AMBIG 266  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1713,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1720,1721,1705,1706,
 &end
#
# 123 VAL HN 0 AMBIG 267  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1865,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 126 GLU- HN 0 AMBIG 268  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1919,1843,
 &end
#
# 127 ILE HN 0 AMBIG 269  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2=1945,1946,1947,1938,1939,1940, 301, 302, 303,
 &end
#
# 130 ARG+ HN 0 AMBIG 270  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1972,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1974,1960,
 &end
#
# 131 LEU HN 0 AMBIG 271  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1996,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1998,1974,
 &end
#
# 139 LYS+ HN 0 AMBIG 272  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=2118,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=2122,2123,2128,2129,
 &end
#
# 5 ILE HN 0 AMBIG 273  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 503,1124,1125,
 &end
#
# 6 ILE HN 0 AMBIG 274  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  45,  46,1129,
 &end
#
# 7 TYR HN 0 AMBIG 275  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 131,  91,
 &end
#
# 7 TYR HN 0 AMBIG 276  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1139,1480,
 &end
#
# 7 TYR HN 0 AMBIG 277  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 141, 145, 501,
 &end
#
# 8 PHE HN 0 AMBIG 278  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 120, 125, 143,
 &end
#
# 8 PHE HN 0 AMBIG 279  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 324, 325, 321, 322,
 &end
#
# 8 PHE HN 0 AMBIG 280  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1133,1134,1135,1067,
 &end
#
# 8 PHE HN 0 AMBIG 281  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr2= 538, 539, 540, 542, 543, 544,1176,1177,1178,1180,
      1181,1182,  97,  98,  99,
 &end
#
# 11 THR HN 0 AMBIG 282  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1322,1323, 592, 593,
 &end
#
# 12 GLY HN 0 AMBIG 283  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 195,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 603, 604, 605, 635, 636, 637,
 &end
#
# 13 ASN HN 0 AMBIG 284  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 195, 590,
 &end
#
# 14 SER HN 0 AMBIG 285  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 280, 281, 242, 243,
 &end
#
# 15 CYS HN 0 AMBIG 286  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 227,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 280, 281, 730, 731, 732,
 &end
#
# 15 CYS HN 0 AMBIG 287  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 227,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 277, 278, 245, 246,
 &end
#
# 16 ARG+ HN 0 AMBIG 288  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1601, 211, 212, 684,
 &end
#
# 16 ARG+ HN 0 AMBIG 289  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1588,1589, 220, 221,
 &end
#
# 17 SER HN 0 AMBIG 290  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2=1223,1591,1592, 155, 156,
 &end
#
# 18 GLN HN 0 AMBIG 291  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 674, 675, 676, 678, 679, 680,1225,1226,1227,1229,
      1230,1231,
 &end
#
# 19 MET HN 0 AMBIG 292  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2= 674, 675, 676, 678, 679, 680,1225,1226,1227,1229,
      1230,1231,
 &end
#
# 20 ALA HN 0 AMBIG 293  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 135, 136, 791, 792,
 &end
#
# 20 ALA HN 0 AMBIG 294  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 277, 278,2000,2001,
 &end
#
# 21 GLU- HN 0 AMBIG 295  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 317,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 143, 347,
 &end
#
# 22 GLY HN 0 AMBIG 296  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 347, 143,
 &end
#
# 22 GLY HN 0 AMBIG 297  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 386, 387, 297, 298,
 &end
#
# 22 GLY HN 0 AMBIG 298  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 791, 792, 896, 943, 944,
 &end
#
# 24 ALA HN 0 AMBIG 299  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 363,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 143, 347,
 &end
#
# 24 ALA HN 0 AMBIG 300  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 363,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2= 402, 403, 324, 325, 399, 400, 437, 438,
 &end
#
# 24 ALA HN 0 AMBIG 301  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 363,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=2000,2001,1953,1954, 536,
 &end
#
# 28 LEU HN 0 AMBIG 302  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 395, 494,
 &end
#
# 28 LEU HN 0 AMBIG 303  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2000,2001, 536,
 &end
#
# 28 LEU HN 0 AMBIG 304  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 538, 539, 540, 542, 543, 544,  97,  98,  99,
 &end
#
# 29 GLY HN 0 AMBIG 305  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 452,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 395, 494,
 &end
#
# 77 LEU HN 0 AMBIG 306  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1424,1425,1426,1428,1429,1430,1176,1177,1178,1180,
      1181,1182,1160,1161,1162,1164,1165,1166,
 &end
#
# 33 LYS+ HN 0 AMBIG 307  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2=  97,  98,  99, 538, 539, 540, 542, 543, 544,
 &end
#
# 34 VAL HN 0 AMBIG 308  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 324, 325, 437, 438, 321, 322,
 &end
#
# 35 TYR HN 0 AMBIG 309  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 131,  91,
 &end
#
# 35 TYR HN 0 AMBIG 310  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 532, 110,
 &end
#
# 35 TYR HN 0 AMBIG 311  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 120, 125, 143,
 &end
#
# 35 TYR HN 0 AMBIG 312  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 367, 368, 369, 383, 384,  76,
 &end
#
# 35 TYR HN 0 AMBIG 313  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 548,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr2=  78,  79,  80,1176,1177,1178,1180,1181,1182,
 &end
#
# 36 SER HN 0 AMBIG 314  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 548, 953,
 &end
#
# 36 SER HN 0 AMBIG 315  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 948, 949, 558, 563,
 &end
#
# 37 ALA HN 0 AMBIG 316  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 131, 151,
 &end
#
# 37 ALA HN 0 AMBIG 317  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1019,1020, 155, 156,
 &end
#
# 37 ALA HN 0 AMBIG 318  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1225,1226,1227,1229,1230,1231,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 39 ILE HN 0 AMBIG 319  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 597,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 590, 195,
 &end
#
# 121 GLN HN 0 AMBIG 320  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1765,1814,1818,
 &end
#
# 41 ALA HN 0 AMBIG 321  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 616, 658,
 &end
#
# 45 ASN HN 0 AMBIG 322  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 693, 694, 967,
 &end
#
# 45 ASN HN 0 AMBIG 323  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 231, 232, 738,
 &end
#
# 45 ASN HN 0 AMBIG 324  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 905, 906, 907, 301, 302, 303,
 &end
#
# 47 ASN HN 0 AMBIG 325  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 752, 684,
 &end
#
# 47 ASN HN 0 AMBIG 326  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 712,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 672, 778, 779, 780,
 &end
#
# 49 VAL HN 0 AMBIG 327  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 699, 700, 913, 292,
 &end
#
# 50 LYS+ HN 0 AMBIG 328  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 752,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 705, 706,1808,1809,
 &end
#
# 51 ALA HN 0 AMBIG 329  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 736, 823,
 &end
#
# 51 ALA HN 0 AMBIG 330  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1769,1763,
 &end
#
# 51 ALA HN 0 AMBIG 331  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 52 MET HN 0 AMBIG 332  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1891,1892, 842,
 &end
#
# 52 MET HN 0 AMBIG 333  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 844, 845, 846, 848, 849, 850, 898, 899, 900,
 &end
#
# 53 LYS+ HN 0 AMBIG 334  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 52 MET HN 0 AMBIG 335  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 784,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 823, 736,
 &end
#
# 54 GLU- HN 0 AMBIG 336  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 823,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 854, 861,
 &end
#
# 117 TRP HZ3 0 AMBIG 337  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1767,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 823, 736,
 &end
#
# 55 VAL HN 0 AMBIG 338  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1888,1889, 811, 812, 759, 760,
 &end
#
# 57 ILE HN 0 AMBIG 339  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 791, 792, 896,
 &end
#
# 57 ILE HN 0 AMBIG 340  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 805, 806, 399, 400,
 &end
#
# 58 ASP- HN 0 AMBIG 341  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 880,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr2= 898, 899, 900, 844, 845, 846, 848, 849, 850,
 &end
#
# 60 SER HN 0 AMBIG 342  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 911,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 880, 948, 949,
 &end
#
# 64 SER HN 0 AMBIG 343  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 967,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 957, 955,
 &end
#
# 65 ASP- HN 0 AMBIG 344  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 967, 953,
 &end
#
# 67 ILE HN 0 AMBIG 345  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1009,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr2= 610, 611, 612,1091,1092,1093,1095,1096,1097,
 &end
#
# 68 ASP- HN 0 AMBIG 346  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1028,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1009,1063,
 &end
#
# 68 ASP- HN 0 AMBIG 347  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1028,  -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 73 ASN HN 0 AMBIG 348  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1424,1425,1426,1428,1429,1430,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 74 ASN HN 0 AMBIG 349  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1110,1111,1124,1125,
 &end
#
# 74 ASN HN 0 AMBIG 350  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=  85,  86,  87,1089,
 &end
#
# 75 ALA HN 0 AMBIG 351  1.8 7.0
 &rst
  ixpk= 0, nxpk= 0, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 110,1028,
 &end
#
# 75 ALA HN 0 AMBIG 352  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1176,1177,1178,1180,1181,1182,1091,1092,1093,1095,
      1096,1097,
 &end
#
# 75 ALA HN 0 AMBIG 353  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2=1424,1425,1426,1428,1429,1430,  78,  79,  80,1176,
      1177,1178,1180,1181,1182,
 &end
#
# 6 ILE HN 0 AMBIG 354  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1151, 486,
 &end
#
# 79 VAL HN 0 AMBIG 355  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 151, 131,
 &end
#
# 79 VAL HN 0 AMBIG 356  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 141, 145,1520,
 &end
#
# 79 VAL HN 0 AMBIG 357  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr2=1160,1161,1162,1164,1165,1166, 311, 312, 313,
 &end
#
# 80 THR HN 0 AMBIG 358  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1480,1495,
 &end
#
# 80 THR HN 0 AMBIG 359  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1512,1186,
 &end
#
# 80 THR HN 0 AMBIG 360  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1520, 141, 145,
 &end
#
# 82 CYX HN 0 AMBIG 361  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 174, 175,1516,1517,
 &end
#
# 82 CYX HN 0 AMBIG 362  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1288,1289,1499,1500,
 &end
#
# 82 CYX HN 0 AMBIG 363  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 242, 243, 245, 246,1332,1333,
 &end
#
# 84 ASP- HN 0 AMBIG 364  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1252,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1538,1539,1621,1622,
 &end
#
# 87 ASP- HN 0 AMBIG 365  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1264,1575,
 &end
#
# 87 ASP- HN 0 AMBIG 366  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1621,1622,1322,1323,
 &end
#
# 87 ASP- HN 0 AMBIG 367  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 187, 188, 189,1303,1304,
 &end
#
# 89 CYX HN 0 AMBIG 368  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1329,1330,1329,1330,
 &end
#
# 89 CYX HN 0 AMBIG 369  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 187, 188, 189,1303,1304,
 &end
#
# 98 ARG+ HN 0 AMBIG 370  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1456,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1434,1170,
 &end
#
# 99 GLU- HN 0 AMBIG 371  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1202,1170,
 &end
#
# 99 GLU- HN 0 AMBIG 372  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1456,1186,
 &end
#
# 99 GLU- HN 0 AMBIG 373  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1158,1208,1209,1210,
 &end
#
# 101 TRP HN 0 AMBIG 374  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1484,1485,1220,1221,
 &end
#
# 107 ALA HN 0 AMBIG 375  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 231, 232, 248, 249,
 &end
#
# 107 ALA HN 0 AMBIG 376  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 108 ARG+ HN 0 AMBIG 377  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1611,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1588,1589,1730,
 &end
#
# 109 ALA HN 0 AMBIG 378  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1741,1742,1579,1580,
 &end
#
# 109 ALA HN 0 AMBIG 379  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 111 GLY HN 0 AMBIG 380  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1735,1736,1738,1739,
 &end
#
# 113 GLU- HN 0 AMBIG 381  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1683,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1738,1739,1735,1736,
 &end
#
# 114 GLU- HN 0 AMBIG 382  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr2=1738,1739,1735,1736,1778,1779,1780,
 &end
#
# 115 GLU- HN 0 AMBIG 383  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1713,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1698,1669,
 &end
#
# 117 TRP HN 0 AMBIG 384  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1808,1809,1720,1721,
 &end
#
# 118 ALA HN 0 AMBIG 385  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1774,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1769,1763,
 &end
#
# 118 ALA HN 0 AMBIG 386  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1774,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1828,1829,1702,1703,
 &end
#
# 119 PHE HN 0 AMBIG 387  1.8 7.0
 &rst
  ixpk= 0, nxpk= 0, iat=1784,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1828,1829,1869,
 &end
#
# 119 PHE HN 0 AMBIG 388  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1784,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 122 ARG+ HN 0 AMBIG 389  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1841,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1909,1910,1891,1892,
 &end
#
# 123 VAL HN 0 AMBIG 390  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1865,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1921,1922,1831,1832,
 &end
#
# 124 ARG+ HN 0 AMBIG 391  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1881,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1591,1592,1936, 245, 246,
 &end
#
# 106 PRO QG 0 AMBIG 392  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1591,1592,
 igr2=1881,1804,
 &end
#
# 125 ASP- HN 0 AMBIG 393  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1905,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1841,1958,
 &end
#
# 125 ASP- HN 0 AMBIG 394  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1905,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1828,1829, 294, 295,
 &end
#
# 126 GLU- HN 0 AMBIG 395  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1932,1905,
 &end
#
# 126 GLU- HN 0 AMBIG 396  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1881,1865,
 &end
#
# 126 GLU- HN 0 AMBIG 397  1.8 7.0
 &rst
  ixpk= 0, nxpk= 0, iat=1917,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2=1891,1892,1547,1548,
 &end
#
# 128 GLY HN 0 AMBIG 398  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1883,1960,
 &end
#
# 128 GLY HN 0 AMBIG 399  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 309, 240,
 &end
#
# 128 GLY HN 0 AMBIG 400  1.8 7.0
 &rst
  ixpk= 0, nxpk= 0, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2=1891,1892,1982,1983,
 &end
#
# 130 ARG+ HN 0 AMBIG 401  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1972,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1996,1958,
 &end
#
# 131 LEU HN 0 AMBIG 402  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1996,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1962,1963,1924,1925, 416, 417,
 &end
#
# 133 GLU- HN 0 AMBIG 403  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2037,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2025,2026,2125,2126,
 &end
#
# 139 LYS+ HN 0 AMBIG 404  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2118,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2097,2052,
 &end
#
# 3 ASN QD2 0 AMBIG 405  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  45,  46,
 igr2=  36, 459,
 &end
#
# 3 ASN QD2 0 AMBIG 406  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  45,  46,
 igr2=  36, 459,
 &end
#
# 18 GLN QE2 0 AMBIG 407  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 285, 286,
 igr2= 953, 967,
 &end
#
# 18 GLN QE2 0 AMBIG 408  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 285, 286,
 igr2= 206, 207, 982, 983,
 &end
#
# 18 GLN QE2 0 AMBIG 409  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 285, 286,
 igr2= 953, 967,
 &end
#
# 26 GLN QE2 0 AMBIG 410  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 407, 408,
 igr2= 377, 378, 399, 400,
 &end
#
# 26 GLN QE2 0 AMBIG 411  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 407, 408,
 igr2= 402, 403, 399, 400,
 &end
#
# 26 GLN QE2 0 AMBIG 412  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 407, 408,
 igr2= 377, 378, 399, 400,
 &end
#
# 26 GLN QE2 0 AMBIG 413  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 407, 408,
 igr2= 402, 403, 399, 400,
 &end
#
# 45 ASN QD2 0 AMBIG 414  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 693, 694,
 igr2= 684,1601,
 &end
#
# 45 ASN QD2 0 AMBIG 415  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 693, 694,
 igr2= 684,1601,
 &end
#
# 47 ASN QD2 0 AMBIG 416  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 721, 722,
 igr2= 693, 694, 726,
 &end
#
# 47 ASN QD2 0 AMBIG 417  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 721, 722,
 igr2= 693, 694, 726,
 &end
#
# 47 ASN QD2 0 AMBIG 418  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 721, 722,
 igr2= 716, 717,1732,1733,
 &end
#
# 47 ASN QD2 0 AMBIG 419  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 721, 722,
 igr2=1603, 728,1700, 708,
 &end
#
# 47 ASN QD2 0 AMBIG 420  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 721, 722,
 igr2=1603, 728,1700, 708,
 &end
#
# 62 GLN QE2 0 AMBIG 421  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 948, 949,
 igr2= 280, 281, 383, 384,
 &end
#
# 62 GLN QE2 0 AMBIG 422  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 948, 949,
 igr2= 321, 322, 324, 325,
 &end
#
# 62 GLN QE2 0 AMBIG 423  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 948, 949,
 igr2= 931, 932, 211, 212,
 &end
#
# 62 GLN QE2 0 AMBIG 424  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 948, 949,
 igr2= 931, 932, 211, 212,
 &end
#
# 62 GLN QE2 0 AMBIG 425  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 948, 949,
 igr2= 321, 322, 324, 325,
 &end
#
# 62 GLN QE2 0 AMBIG 426  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 948, 949,
 igr2= 280, 281, 383, 384,
 &end
#
# 73 ASN QD2 0 AMBIG 427  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1110,1111,
 igr2=1105,1106,1119,1120,
 &end
#
# 73 ASN QD2 0 AMBIG 428  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1110,1111,
 igr2=1053,1103,
 &end
#
# 73 ASN QD2 0 AMBIG 429  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1110,1111,
 igr2=1053,1103,
 &end
#
# 73 ASN QD2 0 AMBIG 430  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1110,1111,
 igr2=1105,1106,1119,1120,
 &end
#
# 74 ASN QD2 0 AMBIG 431  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1124,1125,
 igr2=  52,1053,
 &end
#
# 74 ASN QD2 0 AMBIG 432  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1124,1125,
 igr2=  52,1053,
 &end
#
# 74 ASN QD2 0 AMBIG 433  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1124,1125,
 igr2=  78,  79,  80,  85,  86,  87,
 &end
#
# 129 ASN QD2 0 AMBIG 434  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1967,1968,
 igr2=2044,2045,1921,1922,
 &end
#
# 129 ASN QD2 0 AMBIG 435  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1967,1968,
 igr2=1962,1963,1924,1925,
 &end
#
# 129 ASN QD2 0 AMBIG 436  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1967,1968,
 igr2=1974,1960,
 &end
#
# 129 ASN QD2 0 AMBIG 437  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1967,1968,
 igr2=1974,1960,
 &end
#
# 129 ASN QD2 0 AMBIG 438  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1967,1968,
 igr2=1962,1963,1924,1925,
 &end
#
# 129 ASN QD2 0 AMBIG 439  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1967,1968,
 igr2=2044,2045,1921,1922,
 &end
#
# 117 TRP HE1 0 AMBIG 440  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1760,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 765, 766,1754,1755,
 &end
#
# 117 TRP HE1 0 AMBIG 441  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1760,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1828,1829,1702,1703,
 &end
#
# 101 TRP HE1 0 AMBIG 442  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1522,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1225,1226,1227,1229,1230,1231,1160,1161,1162,1164,
      1165,1166,
 &end
#
# 101 TRP HE1 0 AMBIG 443  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1522,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1482,2054,
 &end
#
# 101 TRP HE1 0 AMBIG 444  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1522,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1520, 141, 145,
 &end
#
# 32 TRP HE1 0 AMBIG 445  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=  60,  61,  54,  55,
 &end
#
# 32 TRP HE1 0 AMBIG 446  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 478, 479,  63,  64,
 &end
#
# 32 TRP HE1 0 AMBIG 447  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 473, 454, 455,
 &end
#
# 32 TRP HE1 0 AMBIG 448  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=  45,  46,2064, 503,
 &end
#
# 23 TRP HE1 0 AMBIG 449  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1938,1939,1940, 301, 302, 303,1945,1946,1947,
 &end
#
# 23 TRP HE1 0 AMBIG 450  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1885,1886,1953,1954,
 &end
#
# 23 TRP HE1 0 AMBIG 451  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1891,1892,1909,1910,
 &end
#
# 23 TRP HE1 0 AMBIG 452  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1826, 334, 335,
 &end
#
# 23 TRP HE1 0 AMBIG 453  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1934, 297, 298,
 &end
#
# 23 TRP HE1 0 AMBIG 454  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 309, 240,
 &end
#
# 23 TRP HE1 0 AMBIG 455  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1907, 786,
 &end
#
# 23 TRP HE1 0 AMBIG 456  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 354,1972,
 &end
#
# 23 TRP HE1 0 AMBIG 457  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 349,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr2= 844, 845, 846, 848, 849, 850,1942,1943,1871,1872,
      1873,1875,1876,1877,
 &end
#
# 137 THR HB 0 AMBIG 458  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=2101,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2128,2129,2122,2123,
 &end
#
# 80 THR HB 0 AMBIG 459  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1206,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1235,1216,
 &end
#
# 92 THR HB 0 AMBIG 460  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2=1365,1366,1367,1091,1092,1093,1095,1096,1097,
 &end
#
# 123 VAL HA 0 AMBIG 461  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 123 VAL HA 0 AMBIG 462  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1924,1925,1909,1910,
 &end
#
# 123 VAL HA 0 AMBIG 463  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1865,1881,
 &end
#
# 11 THR HA 0 AMBIG 464  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1332,1333,1332,1333,
 &end
#
# 49 VAL HA 0 AMBIG 465  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 49 VAL HA 0 AMBIG 466  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 791, 792, 896,
 &end
#
# 49 VAL HA 0 AMBIG 467  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 708, 776,
 &end
#
# 127 ILE HA 0 AMBIG 468  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1934,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1945,1946,1947,1938,1939,1940,
 &end
#
# 46 PRO HA 0 AMBIG 469  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 46 PRO HA 0 AMBIG 470  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 752, 684,
 &end
#
# 39 ILE HA 0 AMBIG 471  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1332,1333,1332,1333,
 &end
#
# 71 ILE HA 0 AMBIG 472  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1065,  -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr2=  78,  79,  80,1089,  85,  86,  87,
 &end
#
# 120 PHE HA 0 AMBIG 473  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1806,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 120 PHE HA 0 AMBIG 474  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1806,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1804,1865,1881,
 &end
#
# 67 ILE HA 0 AMBIG 475  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1011,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1022,1023,1024,1015,1016,1017,
 &end
#
# 106 PRO HA 0 AMBIG 476  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1597,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1804,
 &end
#
# 106 PRO HA 0 AMBIG 477  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1597,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1591,1592,1735,1736,1618,1619,
 &end
#
# 106 PRO HA 0 AMBIG 478  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1597,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 60 SER HA 0 AMBIG 479  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 913,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 112 THR HA 0 AMBIG 480  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1671,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1669,1698,
 &end
#
# 112 THR HA 0 AMBIG 481  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1671,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1690,1691,1717,1718,1705,1706,
 &end
#
# 112 THR HA 0 AMBIG 482  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1671,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1717,1718,1702,1703,
 &end
#
# 34 VAL HA 0 AMBIG 483  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2=  97,  98,  99, 538, 539, 540, 542, 543, 544,
 &end
#
# 134 PHE HA 0 AMBIG 484  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=2054,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2052,2097,
 &end
#
# 63 THR HA 0 AMBIG 485  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 955,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 953, 967,
 &end
#
# 119 PHE HA 0 AMBIG 486  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1804,1865,
 &end
#
# 63 THR HA 0 AMBIG 487  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 955,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 959, 960, 961, 669, 670,
 &end
#
# 14 SER QB 0 AMBIG 488  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 220, 221,
 igr2= 645, 646, 688, 689,
 &end
#
# 14 SER QB 0 AMBIG 489  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 220, 221,
 igr2= 645, 646, 688, 689,
 &end
#
# 14 SER HA 0 AMBIG 490  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 667, 220, 221,
 &end
#
# 5 ILE HA 0 AMBIG 491  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  74,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 514, 515,  76,
 &end
#
# 23 TRP HA 0 AMBIG 492  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 341,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 402, 403, 399, 400,
 &end
#
# 79 VAL HA 0 AMBIG 493  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1188,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr2=1176,1177,1178,1180,1181,1182,1160,1161,1162,1164,
      1165,1166,1225,1226,1227,1229,1230,1231,
 &end
#
# 92 THR HA 0 AMBIG 494  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2=1365,1366,1367,1091,1092,1093,1095,1096,1097,
 &end
#
# 92 THR HA 0 AMBIG 495  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1086,1087,1377,1378,
 &end
#
# 92 THR HA 0 AMBIG 496  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1335,1336,1377,1378,
 &end
#
# 113 GLU- HA 0 AMBIG 497  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1685,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1738,1739,1735,1736,
 &end
#
# 116 LYS+ HA 0 AMBIG 498  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1730,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1732,1733,1732,1733,
 &end
#
# 116 LYS+ HA 0 AMBIG 499  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1730,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1750,1645,
 &end
#
# 16 ARG+ HA 0 AMBIG 500  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 301, 302, 303,1945,1946,1947,
 &end
#
# 16 ARG+ HA 0 AMBIG 501  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 248, 249, 297, 298,
 &end
#
# 124 ARG+ HA 0 AMBIG 502  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1883,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 301, 302, 303,1945,1946,1947,
 &end
#
# 124 ARG+ HA 0 AMBIG 503  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1883,  -1, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,1942,1943,
 &end
#
# 53 LYS+ HA 0 AMBIG 504  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 803,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 861, 854,
 &end
#
# 53 LYS+ HA 0 AMBIG 505  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 803,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr2= 865, 742, 743, 744, 746, 747, 748, 742, 743, 744,
       746, 747, 748, 762, 763,
 &end
#
# 53 LYS+ HA 0 AMBIG 506  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 803,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr2= 844, 845, 846, 848, 849, 850, 898, 899, 900,
 &end
#
# 21 GLU- HA 0 AMBIG 507  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 319,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 321, 322, 324, 325,
 &end
#
# 133 GLU- HA 0 AMBIG 508  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=2039,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2097,2052,
 &end
#
# 133 GLU- HA 0 AMBIG 509  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=2039,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=2086,2087,2041,2042,
 &end
#
# 115 GLU- HA 0 AMBIG 510  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1735,1736,1675,1676,1677,
 &end
#
# 50 LYS+ HA 0 AMBIG 511  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 754,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 805, 806, 756, 757,
 &end
#
# 121 GLN HA 0 AMBIG 512  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1826,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1881,1865,
 &end
#
# 121 GLN HA 0 AMBIG 513  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1826,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1891,1892,1909,1910,
 &end
#
# 66 ILE HA 0 AMBIG 514  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 992,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1019,1020,1000,1001,
 &end
#
# 117 TRP HA 0 AMBIG 515  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1750,1836,1837,
 &end
#
# 117 TRP HA 0 AMBIG 516  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1808,1809,1754,1755,
 &end
#
# 117 TRP HA 0 AMBIG 517  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1700,1786,1603, 776,
 &end
#
# 80 THR HA 0 AMBIG 518  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2= 160, 161, 162, 164, 165, 166,1192,1193,1194,1196,
      1197,1198,
 &end
#
# 72 LEU HA 0 AMBIG 519  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1084,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1115,1063,
 &end
#
# 72 LEU HA 0 AMBIG 520  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1084,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 97 LYS+ HA 0 AMBIG 521  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1436,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr2=1424,1425,1426,1428,1429,1430,1160,1161,1162,1164,
      1165,1166,1176,1177,1178,1180,1181,1182,
 &end
#
# 31 GLU- HA 0 AMBIG 522  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 473,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  36, 459,
 &end
#
# 26 GLN HA 0 AMBIG 523  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 399, 400, 402, 403,
 &end
#
# 70 ASP- HA 0 AMBIG 524  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1053,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1063,1115,
 &end
#
# 18 GLN HA 0 AMBIG 525  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr2= 730, 731, 732, 242, 243, 367, 368, 369,
 &end
#
# 18 GLN HA 0 AMBIG 526  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 905, 906, 907, 311, 312, 313,
 &end
#
# 10 CYS HA 0 AMBIG 527  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1329,1330,1329,1330,
 &end
#
# 76 ASP- HA 0 AMBIG 528  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1141,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2=  85,  86,  87,1176,1177,1178,1180,1181,1182,
 &end
#
# 8 PHE HA 0 AMBIG 529  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 151, 131,
 &end
#
# 8 PHE HA 0 AMBIG 530  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1223,1463,1464,
 &end
#
# 8 PHE HA 0 AMBIG 531  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1208,1209,1210,1158,
 &end
#
# 8 PHE HA 0 AMBIG 532  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1225,1226,1227,1229,1230,1231,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 6 ILE HA 0 AMBIG 533  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  93,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2=  97,  98,  99,1176,1177,1178,1180,1181,1182, 538,
       539, 540, 542, 543, 544,
 &end
#
# 36 SER HA 0 AMBIG 534  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 571,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 573, 574, 266, 267,
 &end
#
# 36 SER HA 0 AMBIG 535  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 571,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 321, 322, 324, 325,
 &end
#
# 32 TRP HA 0 AMBIG 536  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2=  97,  98,  99, 538, 539, 540, 542, 543, 544,
 &end
#
# 24 ALA HA 0 AMBIG 537  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 538, 539, 540, 542, 543, 544,  97,  98,  99,
 &end
#
# 24 ALA HA 0 AMBIG 538  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2=2005,2006,2007,2009,2010,2011, 442, 443, 444, 446,
       447, 448,
 &end
#
# 129 ASN HA 0 AMBIG 539  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1960,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2022,2023,2022,2023,
 &end
#
# 51 ALA HN 0 AMBIG 540  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 776, 728,
 &end
#
# 51 ALA HA 0 AMBIG 541  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1891,1892, 842,
 &end
#
# 51 ALA QB 0 AMBIG 542  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 778, 779, 780,
 igr2= 776, 728,
 &end
#
# 51 ALA HA 0 AMBIG 543  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 776,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1891,1892, 830, 831,
 &end
#
# 30 ASP- HA 0 AMBIG 544  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 377, 378, 437, 438,
 &end
#
# 82 CYX HA 0 AMBIG 545  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1237,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1288,1289,1256,1257,
 &end
#
# 47 ASN HA 0 AMBIG 546  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 714,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 759, 760, 778, 779, 780,
 &end
#
# 47 ASN HA 0 AMBIG 547  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 714,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 756, 757, 716, 717,
 &end
#
# 52 MET HA 0 AMBIG 548  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 786,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1891,1892, 842,
 &end
#
# 4 LYS+ HA 0 AMBIG 549  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=  72,  57,  58,
 &end
#
# 77 LEU HA 0 AMBIG 550  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1153,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1160,1161,1162,1164,1165,1166,1424,1425,1426,1428,
      1429,1430,
 &end
#
# 77 LEU HA 0 AMBIG 551  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1153,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1441,1442,1155,1156,
 &end
#
# 77 LEU HA 0 AMBIG 552  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1153,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1170,1434,
 &end
#
# 104 ASP- HA 0 AMBIG 553  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1565,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1256,1257,1567,1568,
 &end
#
# 99 GLU- HA 0 AMBIG 554  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1482,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1495,1480,
 &end
#
# 91 MET HA 0 AMBIG 555  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1344,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2=1365,1366,1367,1091,1092,1093,1095,1096,1097,
 &end
#
# 40 GLU- HA 0 AMBIG 556  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2=1000,1001, 584, 585, 586,
 &end
#
# 40 GLU- HA 0 AMBIG 557  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 620, 621, 620, 621,
 &end
#
# 118 ALA HA 0 AMBIG 558  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1776,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1824,1784,
 &end
#
# 20 ALA HA 0 AMBIG 559  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1938,1939,1940, 311, 312, 313,
 &end
#
# 81 LEU HA 0 AMBIG 560  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1218,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1235,1216,
 &end
#
# 65 ASP- HA 0 AMBIG 561  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 980,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1000,1001, 584, 585, 586,
 &end
#
# 65 ASP- HA 0 AMBIG 562  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 980,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 635, 636, 637, 996, 997, 998,
 &end
#
# 107 ALA HA 0 AMBIG 563  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1603,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2=1605,1606,1607,1738,1739,
 &end
#
# 109 ALA HA 0 AMBIG 564  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1637,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1652,1653,1652,1653,
 &end
#
# 98 ARG+ HA 0 AMBIG 565  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1458,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2=1176,1177,1178,1180,1181,1182,1160,1161,1162,1164,
      1165,1166,
 &end
#
# 58 ASP- HA 0 AMBIG 566  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 882,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 814, 815, 884, 885,
 &end
#
# 37 ALA HA 0 AMBIG 567  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 206, 207, 982, 983,
 &end
#
# 37 ALA HA 0 AMBIG 568  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 266, 267, 197, 198,
 &end
#
# 94 PRO QD 0 AMBIG 569  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1388,1389,
 igr2=1377,1378,1086,1087,
 &end
#
# 93 PRO QD 0 AMBIG 570  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1=1374,1375,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 41 ALA HA 0 AMBIG 571  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 633,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 658, 616,
 &end
#
# 93 PRO QD 0 AMBIG 572  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1=1374,1375,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 7 TYR HA 0 AMBIG 573  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 112,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr2= 538, 539, 540, 542, 543, 544,  97,  98,  99,1176,
      1177,1178,1180,1181,1182,
 &end
#
# 106 PRO QD 0 AMBIG 574  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1588,1589,
 igr2= 245, 246,1591,1592,
 &end
#
# 106 PRO QD 0 AMBIG 575  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1588,1589,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 22 GLY QA 0 AMBIG 576  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 334, 335,
 igr2= 324, 325, 788, 789, 402, 403,
 &end
#
# 22 GLY QA 0 AMBIG 577  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 334, 335,
 igr2= 324, 325, 788, 789, 402, 403,
 &end
#
# 9 LEU QB 0 AMBIG 578  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 155, 156,
 igr2=1332,1333,1332,1333,
 &end
#
# 102 GLY QA 0 AMBIG 579  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1538,1539,
 igr2=1543,1536,
 &end
#
# 56 GLY QA 0 AMBIG 580  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 856, 857,
 igr2= 854, 861,
 &end
#
# 56 GLY QA 0 AMBIG 581  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 856, 857,
 igr2= 854, 861,
 &end
#
# 56 GLY QA 0 AMBIG 582  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 856, 857,
 igr2= 838, 407, 408,
 &end
#
# 56 GLY QA 0 AMBIG 583  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 856, 857,
 igr2= 838, 407, 408,
 &end
#
# 138 GLY QA 0 AMBIG 584  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2113,2114,
 igr2=2097,2052,
 &end
#
# 138 GLY QA 0 AMBIG 585  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2113,2114,
 igr2=2097,2052,
 &end
#
# 29 GLY QA 0 AMBIG 586  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 454, 455,
 igr2= 475, 476, 377, 378,
 &end
#
# 82 CYX QB 0 AMBIG 587  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1239,1240,
 igr2=1288,1289,1322,1323,
 &end
#
# 82 CYX QB 0 AMBIG 588  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1239,1240,
 igr2=1288,1289,1322,1323,
 &end
#
# 77 LEU QB 0 AMBIG 589  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1155,1156,
 igr2=  95,1444,1445,
 &end
#
# 77 LEU QB 0 AMBIG 590  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1155,1156,
 igr2=1170,1434,
 &end
#
# 128 GLY QA 0 AMBIG 591  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1953,1954,
 igr2=1958,1996,
 &end
#
# 128 GLY QA 0 AMBIG 592  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1953,1954,
 igr2=1958,1996,
 &end
#
# 111 GLY QA 0 AMBIG 593  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1664,1665,
 igr2=1675,1676,1677,1735,1736,
 &end
#
# 103 PHE QB 0 AMBIG 594  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1547,1548,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 108 ARG+ QD 0 AMBIG 595  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1621,1622,
 igr2=1613,1276,
 &end
#
# 98 ARG+ QD 0 AMBIG 596  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1466,1467,
 igr2=1456,1186,
 &end
#
# 98 ARG+ QD 0 AMBIG 597  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1466,1467,
 igr2=1456,1186,
 &end
#
# 68 ASP- QB 0 AMBIG 598  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1032,1033,
 igr2=1073,1074, 584, 585, 586,
 &end
#
# 72 LEU QB 0 AMBIG 599  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1=1086,1087,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 72 LEU QB 0 AMBIG 600  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1=1086,1087,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 5 ILE HB 0 AMBIG 601  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=  85,  86,  87,  78,  79,  80,
 &end
#
# 131 LEU QB 0 AMBIG 602  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2000,2001,
 igr2=1998, 365,
 &end
#
# 131 LEU QB 0 AMBIG 603  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2000,2001,
 igr2=1998, 365,
 &end
#
# 131 LEU QB 0 AMBIG 604  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2000,2001,
 igr2= 343, 344, 416, 417,
 &end
#
# 131 LEU QB 0 AMBIG 605  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2000,2001,
 igr2= 343, 344, 416, 417,
 &end
#
# 44 LEU QB 0 AMBIG 606  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 669, 670,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 44 LEU QB 0 AMBIG 607  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 669, 670,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 76 ASP- QB 0 AMBIG 608  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1143,1144,
 igr2=  72,  57,  58,
 &end
#
# 104 ASP- QB 0 AMBIG 609  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1567,1568,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 104 ASP- QB 0 AMBIG 610  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1567,1568,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 132 LYS+ QE 0 AMBIG 611  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=2028,2029,
 igr2=2025,2026,2025,2026,
 &end
#
# 53 LYS+ QE 0 AMBIG 612  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 814, 815,
 igr2= 803, 913,
 &end
#
# 97 LYS+ QE 0 AMBIG 613  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1447,1448,
 igr2=1155,1156,1441,1442,
 &end
#
# 97 LYS+ QE 0 AMBIG 614  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1447,1448,
 igr2=1436,1420,
 &end
#
# 7 TYR QB 0 AMBIG 615  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 114, 115,
 igr2= 110,1186,
 &end
#
# 7 TYR QB 0 AMBIG 616  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 114, 115,
 igr2=1176,1177,1178,1180,1181,1182,1091,1092,1093,1095,
      1096,1097,
 &end
#
# 7 TYR QB 0 AMBIG 617  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 114, 115,
 igr2=1176,1177,1178,1180,1181,1182,  78,  79,  80,
 &end
#
# 7 TYR QB 0 AMBIG 618  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 114, 115,
 igr2= 110,1186,
 &end
#
# 4 LYS+ QE 0 AMBIG 619  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  63,  64,
 igr2=  54,  55,  60,  61,
 &end
#
# 131 LEU QB 0 AMBIG 620  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2000,2001,
 igr2= 367, 368, 369, 440,
 &end
#
# 6 ILE HB 0 AMBIG 621  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  95,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1160,1161,1162,1164,1165,1166, 442, 443, 444, 446,
       447, 448,
 &end
#
# 66 ILE HB 0 AMBIG 622  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 990, 616,
 &end
#
# 66 ILE HB 0 AMBIG 623  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1000,1001,1019,1020,
 &end
#
# 57 ILE HB 0 AMBIG 624  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 865,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 341, 894,
 &end
#
# 57 ILE HB 0 AMBIG 625  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 865,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 844, 845, 846, 848, 849, 850, 898, 899, 900,
 &end
#
# 38 GLY QA 0 AMBIG 626  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 592, 593,
 igr2= 590, 195,
 &end
#
# 74 ASN QB 0 AMBIG 627  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1119,1120,
 igr2=1124,1125,1110,1111,
 &end
#
# 8 PHE QB 0 AMBIG 628  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 135, 136,
 igr2= 131, 151,
 &end
#
# 8 PHE QB 0 AMBIG 629  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 135, 136,
 igr2= 573, 574, 266, 267,
 &end
#
# 3 ASN QB 0 AMBIG 630  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  40,  41,
 igr2= 514, 515,  76,
 &end
#
# 27 TYR QB 0 AMBIG 631  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 416, 417,
 igr2=2076,2077,2078,2000,2001,
 &end
#
# 89 CYX QB 0 AMBIG 632  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1322,1323,
 igr2=1247,1248,1344,
 &end
#
# 89 CYX QB 0 AMBIG 633  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1322,1323,
 igr2=1329,1330,1329,1330,
 &end
#
# 89 CYX QB 0 AMBIG 634  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1322,1323,
 igr2=1329,1330,1329,1330,
 &end
#
# 3 ASN QB 0 AMBIG 635  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  40,  41,
 igr2= 514, 515,  76,
 &end
#
# 70 ASP- QB 0 AMBIG 636  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1055,1056,
 igr2=1110,1111,1124,1125,
 &end
#
# 134 PHE QB 0 AMBIG 637  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2056,2057,
 igr2=2062,2066, 141, 145,
 &end
#
# 73 ASN QB 0 AMBIG 638  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1105,1106,
 igr2=1110,1111,1411,
 &end
#
# 67 ILE HB 0 AMBIG 639  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1022,1023,1024,1015,1016,1017,
 &end
#
# 67 ILE HB 0 AMBIG 640  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2= 996, 997, 998, 603, 604, 605, 155, 156,
 &end
#
# 67 ILE HB 0 AMBIG 641  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2= 584, 585, 586,1000,1001,
 &end
#
# 39 ILE HB 0 AMBIG 642  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1332,1333,1332,1333,
 &end
#
# 127 ILE HB 0 AMBIG 643  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1938,1939,1940,1945,1946,1947,
 &end
#
# 127 ILE HB 0 AMBIG 644  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2000,2001,1979,1980,
 &end
#
# 127 ILE HB 0 AMBIG 645  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1958,1996,
 &end
#
# 129 ASN QB 0 AMBIG 646  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1962,1963,
 igr2=1921,1922,2044,2045,
 &end
#
# 115 GLU- QG 0 AMBIG 647  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1720,1721,
 igr2=1717,1718,1702,1703,
 &end
#
# 115 GLU- QG 0 AMBIG 648  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1720,1721,
 igr2=1649,1650,1732,1733,
 &end
#
# 115 GLU- QG 0 AMBIG 649  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1720,1721,
 igr2=1675,1676,1677,1735,1736,
 &end
#
# 126 GLU- QG 0 AMBIG 650  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1924,1925,
 igr2=1958,1996,
 &end
#
# 47 ASN QB 0 AMBIG 651  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 716, 717,
 igr2= 721, 722,1816,
 &end
#
# 47 ASN QB 0 AMBIG 652  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 716, 717,
 igr2= 726, 693, 694,
 &end
#
# 99 GLU- QG 0 AMBIG 653  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1487,1488,
 igr2=1495,1480,
 &end
#
# 136 GLU- QG 0 AMBIG 654  1.8 7.0
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=2089,2090,
 igr2=2017,2131,2132,
 &end
#
# 136 GLU- QG 0 AMBIG 655  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2089,2090,
 igr2=2076,2077,2078,2025,2026,
 &end
#
# 40 GLU- QG 0 AMBIG 656  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 623, 624,
 igr2= 195, 590,
 &end
#
# 47 ASN QB 0 AMBIG 657  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 716, 717,
 igr2= 726, 693, 694,
 &end
#
# 4 LYS+ QB 0 AMBIG 658  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  54,  55,
 igr2=  72,  57,  58,
 &end
#
# 21 GLU- QG 0 AMBIG 659  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 324, 325,
 igr2= 275, 375,
 &end
#
# 21 GLU- QG 0 AMBIG 660  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 324, 325,
 igr2= 319, 334, 335,
 &end
#
# 21 GLU- QG 0 AMBIG 661  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 324, 325,
 igr2= 383, 384, 367, 368, 369,
 &end
#
# 98 ARG+ QB 0 AMBIG 662  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1460,1461,
 igr2=1466,1467,1466,1467,
 &end
#
# 98 ARG+ QB 0 AMBIG 663  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1460,1461,
 igr2=1466,1467,1466,1467,
 &end
#
# 98 ARG+ QB 0 AMBIG 664  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1460,1461,
 igr2=1176,1177,1178,1180,1181,1182,1424,1425,1426,1428,
      1429,1430,
 &end
#
# 98 ARG+ QB 0 AMBIG 665  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1460,1461,
 igr2=1176,1177,1178,1180,1181,1182,1424,1425,1426,1428,
      1429,1430,
 &end
#
# 96 VAL HB 0 AMBIG 666  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1422,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1424,1425,1426,1428,1429,1430,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 96 VAL HB 0 AMBIG 667  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1422,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2=1176,1177,1178,1180,1181,1182,1091,1092,1093,1095,
      1096,1097,
 &end
#
# 99 GLU- QB 0 AMBIG 668  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1484,1485,
 igr2=1480,1495,
 &end
#
# 78 VAL HB 0 AMBIG 669  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1176,1177,1178,1180,1181,1182,1424,1425,1426,1428,
      1429,1430,
 &end
#
# 19 MET QG 0 AMBIG 670  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 297, 298,
 igr2= 905, 906, 907, 301, 302, 303,
 &end
#
# 19 MET QB 0 AMBIG 671  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 294, 295,
 igr2= 301, 302, 303,1945,1946,1947,
 &end
#
# 97 LYS+ QB 0 AMBIG 672  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1438,1439,
 igr2=1434,1170,
 &end
#
# 110 GLN QB 0 AMBIG 673  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1649,1650,
 igr2=1652,1653,1652,1653,
 &end
#
# 110 GLN QB 0 AMBIG 674  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1649,1650,
 igr2=1652,1653,1652,1653,
 &end
#
# 53 LYS+ QB 0 AMBIG 675  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr1= 805, 806,
 igr2= 762, 763, 742, 743, 744, 746, 747, 748, 742, 743,
       744, 746, 747, 748,
 &end
#
# 49 VAL HB 0 AMBIG 676  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 90 PRO QB 0 AMBIG 677  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1335,1336,
 igr2=1329,1330,1329,1330,
 &end
#
# 46 PRO QB 0 AMBIG 678  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 705, 706,
 igr2= 762, 763, 742, 743, 744, 746, 747, 748, 742, 743,
       744, 746, 747, 748,
 &end
#
# 123 VAL HB 0 AMBIG 679  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1869,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1865,1881,
 &end
#
# 123 VAL HB 0 AMBIG 680  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1869,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1808,1809, 294, 295,
 &end
#
# 123 VAL HB 0 AMBIG 681  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1869,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 90 PRO QB 0 AMBIG 682  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1335,1336,
 igr2= 610, 611, 612,1365,1366,1367,
 &end
#
# 90 PRO QB 0 AMBIG 683  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1335,1336,
 igr2=1329,1330,1329,1330,
 &end
#
# 93 PRO QB 0 AMBIG 684  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1380,1381,
 igr2=1377,1378,1086,1087,
 &end
#
# 55 VAL HB 0 AMBIG 685  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 842,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 827, 828, 791, 792,
 &end
#
# 54 GLU- QB 0 AMBIG 686  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 827, 828,
 igr2=1891,1892, 842,
 &end
#
# 54 GLU- QB 0 AMBIG 687  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 827, 828,
 igr2= 830, 831,1891,1892,
 &end
#
# 126 GLU- QB 0 AMBIG 688  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr1=1921,1922,
 igr2=1942,1943,1871,1872,1873,1875,1876,1877,1871,1872,
      1873,1875,1876,1877,
 &end
#
# 97 LYS+ QD 0 AMBIG 689  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1444,1445,
 igr2=1441,1442,1155,1156,
 &end
#
# 97 LYS+ QD 0 AMBIG 690  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1444,1445,
 igr2=1434,1170,
 &end
#
# 113 GLU- QB 0 AMBIG 691  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1687,1688,
 igr2=1735,1736,1675,1676,1677,
 &end
#
# 90 PRO QG 0 AMBIG 692  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1332,1333,
 igr2=1329,1330,1329,1330,
 &end
#
# 90 PRO QG 0 AMBIG 693  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1332,1333,
 igr2=1329,1330,1329,1330,
 &end
#
# 53 LYS+ QD 0 AMBIG 694  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 811, 812,
 igr2= 805, 806, 805, 806,
 &end
#
# 39 ILE QG1 0 AMBIG 695  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 607, 608,
 igr2=1332,1333,1332,1333,1300,1301,
 &end
#
# 5 ILE QG1 0 AMBIG 696  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=  82,  83,
 igr2= 514, 515,  76,
 &end
#
# 71 ILE QG1 0 AMBIG 697  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1073,1074,
 igr2= 514, 515,  76,
 &end
#
# 71 ILE QG1 0 AMBIG 698  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1073,1074,
 igr2=1032,1033,1119,1120,
 &end
#
# 106 PRO QG 0 AMBIG 699  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1591,1592,
 igr2= 294, 295,1615,1616,
 &end
#
# 106 PRO QG 0 AMBIG 700  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1591,1592,
 igr2=1869, 245, 246,
 &end
#
# 106 PRO QG 0 AMBIG 701  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1591,1592,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 93 PRO QG 0 AMBIG 702  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1377,1378,
 igr2=1361,1403,
 &end
#
# 93 PRO QG 0 AMBIG 703  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1377,1378,
 igr2=1424,1425,1426,1428,1429,1430,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 93 PRO QG 0 AMBIG 704  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1=1377,1378,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 28 LEU HG 0 AMBIG 705  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 442, 443, 444, 446, 447, 448,2005,2006,2007,2009,
      2010,2011,
 &end
#
# 66 ILE QG1 0 AMBIG 706  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1000,1001,
 igr2= 992, 980,
 &end
#
# 66 ILE QG1 0 AMBIG 707  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1000,1001,
 igr2= 992, 980,
 &end
#
# 122 ARG+ QG 0 AMBIG 708  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1848,1849,
 igr2=1909,1910,1924,1925,
 &end
#
# 98 ARG+ QG 0 AMBIG 709  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1463,1464,
 igr2=1186,1456,
 &end
#
# 98 ARG+ QG 0 AMBIG 710  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1463,1464,
 igr2=1466,1467,1499,1500,
 &end
#
# 77 LEU HG 0 AMBIG 711  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1158,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 110,1186,
 &end
#
# 77 LEU QQD 0 AMBIG 712  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2= 501, 141, 145,
 &end
#
# 77 LEU QQD 0 AMBIG 713  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1444,1445,1484,1485,
 &end
#
# 77 LEU QQD 0 AMBIG 714  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1441,1442,1155,1156,
 &end
#
# 77 LEU QQD 0 AMBIG 715  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1463,1464,1190,
 &end
#
# 72 LEU HG 0 AMBIG 716  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1089,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1042,1363,
 &end
#
# 9 LEU HG 0 AMBIG 717  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr2=1091,1092,1093,1095,1096,1097,1176,1177,1178,1180,
      1181,1182,1365,1366,1367,
 &end
#
# 9 LEU HG 0 AMBIG 718  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 155, 156,1019,1020,
 &end
#
# 9 LEU HG 0 AMBIG 719  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1332,1333,1332,1333,1174,
 &end
#
# 131 LEU QQD 0 AMBIG 720  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2005,2006,2007,2009,2010,2011,
 igr2=1998, 365,
 &end
#
# 28 LEU QQD 0 AMBIG 721  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 442, 443, 444, 446, 447, 448,
 igr2=  97,  98,  99, 538, 539, 540, 542, 543, 544,
 &end
#
# 6 ILE QD1 0 AMBIG 722  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 104, 105, 106,
 igr2= 442, 443, 444, 446, 447, 448,2005,2006,2007,2009,
      2010,2011,
 &end
#
# 81 LEU QQD 0 AMBIG 723  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1225,1226,1227,1229,1230,1231,
 igr2=1220,1221, 245, 246,
 &end
#
# 81 LEU QQD 0 AMBIG 724  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1225,1226,1227,1229,1230,1231,
 igr2=1520,1553,1557, 141, 145,
 &end
#
# 15 CYS QB 0 AMBIG 725  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 231, 232,
 igr2= 245, 246, 730, 731, 732,
 &end
#
# 15 CYS QB 0 AMBIG 726  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 231, 232,
 igr2= 245, 246,1591,1592,
 &end
#
# 15 CYS QB 0 AMBIG 727  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 231, 232,
 igr2= 245, 246,1591,1592,
 &end
#
# 93 PRO QG 0 AMBIG 728  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1=1377,1378,
 igr2=1091,1092,1093,1095,1096,1097,1089,
 &end
#
# 99 GLU- QB 0 AMBIG 729  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1484,1485,
 igr2=1480,1495,
 &end
#
# 79 VAL HB 0 AMBIG 730  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1190,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 151, 131,
 &end
#
# 23 TRP QB 0 AMBIG 731  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 343, 344,
 igr2=1953,1954,2000,2001,
 &end
#
# 23 TRP QB 0 AMBIG 732  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 343, 344,
 igr2=1938,1939,1940, 311, 312, 313,
 &end
#
# 32 TRP QB 0 AMBIG 733  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 490, 491,
 igr2=  97,  98,  99, 538, 539, 540, 542, 543, 544,
 &end
#
# 32 TRP QB 0 AMBIG 734  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 490, 491,
 igr2=  97,  98,  99, 538, 539, 540, 542, 543, 544,
 &end
#
# 106 PRO QB 0 AMBIG 735  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1594,1595,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 4 LYS+ QD 0 AMBIG 736  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  60,  61,
 igr2=  63,  64,  28,  29,
 &end
#
# 44 LEU HG 0 AMBIG 737  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 116 LYS+ QG 0 AMBIG 738  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1735,1736,
 igr2=1645,1750,
 &end
#
# 11 THR QG2 0 AMBIG 739  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 187, 188, 189,
 igr2=1329,1330,1329,1330,
 &end
#
# 11 THR QG2 0 AMBIG 740  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 187, 188, 189,
 igr2=1309,1310,1288,1289,
 &end
#
# 11 THR QG2 0 AMBIG 741  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 187, 188, 189,
 igr2= 601, 623, 624,
 &end
#
# 44 LEU QQD 0 AMBIG 742  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 674, 675, 676, 678, 679, 680,
 igr2= 953, 967,
 &end
#
# 44 LEU QQD 0 AMBIG 743  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 674, 675, 676, 678, 679, 680,
 igr2= 971, 972, 915, 916,
 &end
#
# 44 LEU QQD 0 AMBIG 744  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 674, 675, 676, 678, 679, 680,
 igr2= 277, 278, 672,
 &end
#
# 123 VAL QQG 0 AMBIG 745  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1871,1872,1873,1875,1876,1877,
 igr2=1814,1818,1854,
 &end
#
# 123 VAL QQG 0 AMBIG 746  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1871,1872,1873,1875,1876,1877,
 igr2= 245, 246,1591,1592,
 &end
#
# 37 ALA QB 0 AMBIG 747  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 584, 585, 586,
 igr2= 982, 983, 206, 207,
 &end
#
# 131 LEU HG 0 AMBIG 748  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=2003,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 141, 145,2062,2066,
 &end
#
# 131 LEU HG 0 AMBIG 749  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=2003,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1998, 365,
 &end
#
# 131 LEU HG 0 AMBIG 750  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=2003,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 343, 344, 416, 417,2056,2057,
 &end
#
# 34 VAL QQG 0 AMBIG 751  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 538, 539, 540, 542, 543, 544,
 igr2=  91, 131, 363,
 &end
#
# 34 VAL QQG 0 AMBIG 752  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 538, 539, 540, 542, 543, 544,
 igr2= 367, 368, 369, 383, 384,
 &end
#
# 34 VAL QQG 0 AMBIG 753  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 538, 539, 540, 542, 543, 544,
 igr2= 536, 377, 378,
 &end
#
# 63 THR QG2 0 AMBIG 754  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 959, 960, 961,
 igr2= 953, 967,
 &end
#
# 63 THR QG2 0 AMBIG 755  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 959, 960, 961,
 igr2= 955, 957,
 &end
#
# 112 THR QG2 0 AMBIG 756  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1675,1676,1677,
 igr2=1705,1706,1717,1718,1690,1691,
 &end
#
# 112 THR QG2 0 AMBIG 757  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1675,1676,1677,
 igr2=1717,1718,1687,1688,
 &end
#
# 51 ALA HN 0 AMBIG 758  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 759, 760, 808, 809,
 &end
#
# 16 ARG+ QG 0 AMBIG 759  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 245, 246,
 igr2=1591,1592,1223,
 &end
#
# 16 ARG+ QG 0 AMBIG 760  1.8 7.0
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 245, 246,
 igr2=1235,1216,
 &end
#
# 16 ARG+ QG 0 AMBIG 761  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 245, 246,
 igr2=1867, 264,
 &end
#
# 16 ARG+ QG 0 AMBIG 762  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 245, 246,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 44 LEU QQD 0 AMBIG 763  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 674, 675, 676, 678, 679, 680,
 igr2= 953, 967,
 &end
#
# 44 LEU QQD 0 AMBIG 764  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 674, 675, 676, 678, 679, 680,
 igr2= 943, 944, 896,
 &end
#
# 44 LEU QQD 0 AMBIG 765  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 674, 675, 676, 678, 679, 680,
 igr2= 321, 322, 788, 789,
 &end
#
# 44 LEU QQD 0 AMBIG 766  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 674, 675, 676, 678, 679, 680,
 igr2= 277, 278, 672,
 &end
#
# 44 LEU QQD 0 AMBIG 767  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 674, 675, 676, 678, 679, 680,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 77 LEU QQD 0 AMBIG 768  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1456, 110,
 &end
#
# 78 VAL QQG 0 AMBIG 769  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1176,1177,1178,1180,1181,1182,
 igr2=1186, 110,
 &end
#
# 78 VAL QQG 0 AMBIG 770  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1176,1177,1178,1180,1181,1182,
 igr2=1361,1153,
 &end
#
# 77 LEU QQD 0 AMBIG 771  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1444,1445,1484,1485,
 &end
#
# 77 LEU QQD 0 AMBIG 772  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1160,1161,1162,1164,1165,1166,
 igr2=1441,1442,1155,1156,
 &end
#
# 78 VAL QQG 0 AMBIG 773  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=1176,1177,1178,1180,1181,1182,
 igr2=1133,1134,1135,1463,1464,
 &end
#
# 92 THR QG2 0 AMBIG 774  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1365,1366,1367,
 igr2=1463,1464,1463,1464,
 &end
#
# 92 THR QG2 0 AMBIG 775  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1365,1366,1367,
 igr2=1466,1467,1466,1467,
 &end
#
# 92 THR QG2 0 AMBIG 776  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1365,1366,1367,
 igr2=1374,1375,1322,1323,
 &end
#
# 92 THR QG2 0 AMBIG 777  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1365,1366,1367,
 igr2=1186,1342,1456,
 &end
#
# 49 VAL QQG 0 AMBIG 778  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 742, 743, 744, 746, 747, 748,
 igr2= 667, 699, 700,
 &end
#
# 49 VAL QQG 0 AMBIG 779  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 742, 743, 744, 746, 747, 748,
 igr2= 805, 806, 705, 706, 756, 757,
 &end
#
# 49 VAL QQG 0 AMBIG 780  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 742, 743, 744, 746, 747, 748,
 igr2= 669, 670, 811, 812, 808, 809,
 &end
#
# 80 THR QG2 0 AMBIG 781  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1208,1209,1210,
 igr2= 155, 156,1463,1464,
 &end
#
# 80 THR QG2 0 AMBIG 782  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1=1208,1209,1210,
 igr2=1332,1333,1332,1333,1174,
 &end
#
# 80 THR QG2 0 AMBIG 783  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1208,1209,1210,
 igr2=1466,1467,1322,1323,
 &end
#
# 80 THR QG2 0 AMBIG 784  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1208,1209,1210,
 igr2=1329,1330,1329,1330,
 &end
#
# 80 THR QG2 0 AMBIG 785  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1208,1209,1210,
 igr2=1216,1235,
 &end
#
# 80 THR QG2 0 AMBIG 786  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1208,1209,1210,
 igr2=1186,1512,
 &end
#
# 55 VAL QQG 0 AMBIG 787  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2= 861, 854,
 &end
#
# 55 VAL QQG 0 AMBIG 788  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2=1891,1892, 842,
 &end
#
# 55 VAL QQG 0 AMBIG 789  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2= 827, 828, 791, 792,
 &end
#
# 49 VAL QQG 0 AMBIG 790  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 742, 743, 744, 746, 747, 748,
 igr2= 726, 784,
 &end
#
# 34 VAL QQG 0 AMBIG 791  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 538, 539, 540, 542, 543, 544,
 igr2=  91, 131, 363,
 &end
#
# 34 VAL QQG 0 AMBIG 792  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 538, 539, 540, 542, 543, 544,
 igr2= 534, 512,
 &end
#
# 34 VAL QQG 0 AMBIG 793  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 538, 539, 540, 542, 543, 544,
 igr2= 367, 368, 369, 383, 384,
 &end
#
# 78 VAL QQG 0 AMBIG 794  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1176,1177,1178,1180,1181,1182,
 igr2= 151, 131,
 &end
#
# 78 VAL QQG 0 AMBIG 795  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1176,1177,1178,1180,1181,1182,
 igr2=1186, 110,
 &end
#
# 78 VAL HB 0 AMBIG 796  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1176,1177,1178,1180,1181,1182,1424,1425,1426,1428,
      1429,1430,
 &end
#
# 96 VAL HB 0 AMBIG 797  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1422,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1424,1425,1426,1428,1429,1430,1176,1177,1178,1180,
      1181,1182,
 &end
#
# 123 VAL QQG 0 AMBIG 798  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1871,1872,1873,1875,1876,1877,
 igr2=1945,1946,1947, 301, 302, 303,
 &end
#
# 123 VAL QQG 0 AMBIG 799  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1871,1872,1873,1875,1876,1877,
 igr2= 242, 243,1924,1925,1579,1580,
 &end
#
# 123 VAL QQG 0 AMBIG 800  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1871,1872,1873,1875,1876,1877,
 igr2= 245, 246,1591,1592,
 &end
#
# 137 THR QG2 0 AMBIG 801  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2103,2104,2105,
 igr2=2089,2090,2044,2045,
 &end
#
# 28 LEU QQD 0 AMBIG 802  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 442, 443, 444, 446, 447, 448,
 igr2= 433,2072,
 &end
#
# 28 LEU QQD 0 AMBIG 803  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 442, 443, 444, 446, 447, 448,
 igr2=2064, 503,
 &end
#
# 28 LEU QQD 0 AMBIG 804  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 442, 443, 444, 446, 447, 448,
 igr2= 365,1998,
 &end
#
# 28 LEU QQD 0 AMBIG 805  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 442, 443, 444, 446, 447, 448,
 igr2= 416, 417,2056,2057,
 &end
#
# 96 VAL QQG 0 AMBIG 806  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1424,1425,1426,1428,1429,1430,
 igr2=1434,1170,
 &end
#
# 96 VAL QQG 0 AMBIG 807  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1424,1425,1426,1428,1429,1430,
 igr2=1153,1141,
 &end
#
# 96 VAL QQG 0 AMBIG 808  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1424,1425,1426,1428,1429,1430,
 igr2=1405,1406,1105,1106,1143,1144,
 &end
#
# 96 VAL QQG 0 AMBIG 809  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1424,1425,1426,1428,1429,1430,
 igr2=1377,1378,1086,1087,
 &end
#
# 96 VAL QQG 0 AMBIG 810  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1=1424,1425,1426,1428,1429,1430,
 igr2=1176,1177,1178,1180,1181,1182,1091,1092,1093,1095,
      1096,1097,
 &end
#
# 24 ALA QB 0 AMBIG 811  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 367, 368, 369,
 igr2= 395, 494,
 &end
#
# 24 ALA QB 0 AMBIG 812  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 367, 368, 369,
 igr2= 343, 344, 416, 417, 386, 387,
 &end
#
# 24 ALA QB 0 AMBIG 813  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 367, 368, 369,
 igr2= 538, 539, 540, 542, 543, 544,2003,
 &end
#
# 24 ALA QB 0 AMBIG 814  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 367, 368, 369,
 igr2= 538, 539, 540, 542, 543, 544,  97,  98,  99,
 &end
#
# 24 ALA QB 0 AMBIG 815  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 367, 368, 369,
 igr2=2005,2006,2007,2009,2010,2011, 442, 443, 444, 446,
       447, 448,
 &end
#
# 55 VAL QQG 0 AMBIG 816  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2= 861, 854,
 &end
#
# 55 VAL QQG 0 AMBIG 817  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2= 803, 292,
 &end
#
# 55 VAL QQG 0 AMBIG 818  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2=1891,1892, 842,
 &end
#
# 55 VAL QQG 0 AMBIG 819  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 844, 845, 846, 848, 849, 850,
 igr2= 827, 828, 791, 792,
 &end
#
# 41 ALA QB 0 AMBIG 820  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 635, 636, 637,
 igr2= 980, 992,
 &end
#
# 109 ALA QB 0 AMBIG 821  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1639,1640,1641,
 igr2=1871,1872,1873,1875,1876,1877,1871,1872,1873,1875,
      1876,1877,
 &end
#
# 109 ALA QB 0 AMBIG 822  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1639,1640,1641,
 igr2=1735,1736,1738,1739,
 &end
#
# 109 ALA QB 0 AMBIG 823  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1639,1640,1641,
 igr2=1732,1733,1732,1733,
 &end
#
# 59 ILE QG2 0 AMBIG 824  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 898, 899, 900,
 igr2= 339, 953,
 &end
#
# 59 ILE QG2 0 AMBIG 825  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 898, 899, 900,
 igr2= 791, 792, 896,
 &end
#
# 79 VAL QQG 0 AMBIG 826  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1192,1193,1194,1196,1197,1198,
 igr2=1186,1512, 110,
 &end
#
# 79 VAL QQG 0 AMBIG 827  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1192,1193,1194,1196,1197,1198,
 igr2=1520, 141, 145,
 &end
#
# 79 VAL QQG 0 AMBIG 828  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=1192,1193,1194,1196,1197,1198,
 igr2=1225,1226,1227,1229,1230,1231,1160,1161,1162,1164,
      1165,1166,
 &end
#
# 79 VAL QQG 0 AMBIG 829  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1192,1193,1194,1196,1197,1198,
 igr2=1186,1512, 110,
 &end
#
# 79 VAL QQG 0 AMBIG 830  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1192,1193,1194,1196,1197,1198,
 igr2=1155,1156,1441,1442,
 &end
#
# 79 VAL QQG 0 AMBIG 831  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1=1192,1193,1194,1196,1197,1198,
 igr2=1225,1226,1227,1229,1230,1231,1160,1161,1162,1164,
      1165,1166,
 &end
#
# 135 ALA QB 0 AMBIG 832  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2076,2077,2078,
 igr2=2015, 452,
 &end
#
# 75 ALA QB 0 AMBIG 833  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1133,1134,1135,
 igr2=1153, 534,
 &end
#
# 75 ALA QB 0 AMBIG 834  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1133,1134,1135,
 igr2=1143,1144,1105,1106,
 &end
#
# 75 ALA QB 0 AMBIG 835  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1133,1134,1135,
 igr2=  76,1174,
 &end
#
# 75 ALA QB 0 AMBIG 836  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1=1133,1134,1135,
 igr2=1176,1177,1178,1180,1181,1182,1424,1425,1426,1428,
      1429,1430,  78,  79,  80,
 &end
#
# 48 ALA QB 0 AMBIG 837  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 730, 731, 732,
 igr2= 297, 298, 231, 232,
 &end
#
# 48 ALA QB 0 AMBIG 838  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 730, 731, 732,
 igr2= 294, 295, 788, 789,
 &end
#
# 48 ALA QB 0 AMBIG 839  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 730, 731, 732,
 igr2= 669, 670, 716, 717,
 &end
#
# 48 ALA QB 0 AMBIG 840  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 730, 731, 732,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 48 ALA QB 0 AMBIG 841  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 730, 731, 732,
 igr2= 905, 906, 907, 301, 302, 303,
 &end
#
# 107 ALA QB 0 AMBIG 842  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1605,1606,1607,
 igr2=1588,1589, 220, 221,
 &end
#
# 118 ALA QB 0 AMBIG 843  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1778,1779,1780,
 igr2=1788,1789,1754,1755,
 &end
#
# 118 ALA QB 0 AMBIG 844  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1778,1779,1780,
 igr2=1788,1789,1851,1852,
 &end
#
# 118 ALA QB 0 AMBIG 845  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1778,1779,1780,
 igr2=1705,1706,1717,1718,
 &end
#
# 118 ALA QB 0 AMBIG 846  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1778,1779,1780,
 igr2=1828,1829,1702,1703,
 &end
#
# 118 ALA QB 0 AMBIG 847  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1778,1779,1780,
 igr2=1732,1733,1732,1733,
 &end
#
# 51 ALA QB 0 AMBIG 848  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 778, 779, 780,
 igr2=1804,1865,
 &end
#
# 51 ALA QB 0 AMBIG 849  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 778, 779, 780,
 igr2=1765,1814,1818,
 &end
#
# 51 ALA QB 0 AMBIG 850  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 778, 779, 780,
 igr2= 776, 728,
 &end
#
# 51 ALA QB 0 AMBIG 851  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 778, 779, 780,
 igr2=1828,1829, 788, 789, 294, 295,
 &end
#
# 51 ALA QB 0 AMBIG 852  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 778, 779, 780,
 igr2= 730, 731, 732, 788, 789,
 &end
#
# 39 ILE QG2 0 AMBIG 853  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 603, 604, 605,
 igr2= 195, 590,
 &end
#
# 39 ILE QG2 0 AMBIG 854  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 603, 604, 605,
 igr2= 618,1338,
 &end
#
# 39 ILE QG2 0 AMBIG 855  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 603, 604, 605,
 igr2=1300,1301, 620, 621, 620, 621,1306,1307,
 &end
#
# 5 ILE QG2 0 AMBIG 856  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  78,  79,  80,
 igr2=  76, 514, 515,
 &end
#
# 5 ILE QG2 0 AMBIG 857  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  78,  79,  80,
 igr2= 114, 115,1065,
 &end
#
# 5 ILE QG2 0 AMBIG 858  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  78,  79,  80,
 igr2=  93, 112,
 &end
#
# 5 ILE QG2 0 AMBIG 859  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  78,  79,  80,
 igr2=1129,  45,  46,
 &end
#
# 67 ILE QG2 0 AMBIG 860  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1015,1016,1017,
 igr2=1009,1063,
 &end
#
# 67 ILE QG2 0 AMBIG 861  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1015,1016,1017,
 igr2=1084, 599,
 &end
#
# 67 ILE QG2 0 AMBIG 862  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1015,1016,1017,
 igr2=1086,1087,1346,1347,
 &end
#
# 67 ILE QG2 0 AMBIG 863  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1015,1016,1017,
 igr2=1332,1333,1332,1333,
 &end
#
# 67 ILE QG2 0 AMBIG 864  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1015,1016,1017,
 igr2= 584, 585, 586,1000,1001,
 &end
#
# 6 ILE QG2 0 AMBIG 865  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  97,  98,  99,
 igr2= 110, 532,
 &end
#
# 6 ILE QG2 0 AMBIG 866  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  97,  98,  99,
 igr2= 486,1151, 373,
 &end
#
# 6 ILE QG2 0 AMBIG 867  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  97,  98,  99,
 igr2=  45,  46, 317,
 &end
#
# 6 ILE QG2 0 AMBIG 868  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  97,  98,  99,
 igr2=  93, 112,
 &end
#
# 6 ILE QG2 0 AMBIG 869  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=  97,  98,  99,
 igr2= 536,  95,
 &end
#
# 6 ILE QG2 0 AMBIG 870  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  97,  98,  99,
 igr2=1155,1156, 380, 381,
 &end
#
# 127 ILE QG2 0 AMBIG 871  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1938,1939,1940,
 igr2=1934, 343, 344,
 &end
#
# 127 ILE QG2 0 AMBIG 872  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1938,1939,1940,
 igr2=2000,2001,1953,1954,
 &end
#
# 20 ALA QB 0 AMBIG 873  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 311, 312, 313,
 igr2= 266, 267, 573, 574,
 &end
#
# 20 ALA QB 0 AMBIG 874  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 311, 312, 313,
 igr2= 343, 344, 297, 298,
 &end
#
# 20 ALA QB 0 AMBIG 875  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 311, 312, 313,
 igr2= 321, 322, 324, 325,
 &end
#
# 20 ALA QB 0 AMBIG 876  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 311, 312, 313,
 igr2=1936, 245, 246,
 &end
#
# 20 ALA QB 0 AMBIG 877  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 311, 312, 313,
 igr2= 367, 368, 369, 242, 243,
 &end
#
# 20 ALA QB 0 AMBIG 878  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 311, 312, 313,
 igr2= 143, 347,
 &end
#
# 57 ILE QG2 0 AMBIG 879  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 867, 868, 869,
 igr2= 341, 894, 786,
 &end
#
# 57 ILE QG2 0 AMBIG 880  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 867, 868, 869,
 igr2= 791, 792, 896,
 &end
#
# 57 ILE QG2 0 AMBIG 881  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 867, 868, 869,
 igr2= 402, 403, 788, 789,
 &end
#
# 57 ILE QG2 0 AMBIG 882  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 867, 868, 869,
 igr2= 402, 403, 788, 789,
 &end
#
# 71 ILE QG2 0 AMBIG 883  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1069,1070,1071,
 igr2=1063,1115,
 &end
#
# 71 ILE QG2 0 AMBIG 884  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1069,1070,1071,
 igr2=1065, 114, 115,
 &end
#
# 71 ILE QG2 0 AMBIG 885  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1069,1070,1071,
 igr2=1119,1120,1032,1033,
 &end
#
# 71 ILE QG2 0 AMBIG 886  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1069,1070,1071,
 igr2=  76, 514, 515,
 &end
#
# 71 ILE QG2 0 AMBIG 887  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1069,1070,1071,
 igr2=1067,1133,1134,1135,
 &end
#
# 124 ARG+ HA 0 AMBIG 888  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1883,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 301, 302, 303,1945,1946,1947,
 &end
#
# 19 MET QB 0 AMBIG 889  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 294, 295,
 igr2= 301, 302, 303,1945,1946,1947,
 &end
#
# 19 MET QB 0 AMBIG 890  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 294, 295,
 igr2= 301, 302, 303,1945,1946,1947,
 &end
#
# 127 ILE HN 0 AMBIG 891  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1945,1946,1947, 301, 302, 303,
 &end
#
# 19 MET HN 0 AMBIG 892  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 301, 302, 303,1945,1946,1947,
 &end
#
# 52 MET QE 0 AMBIG 893  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 795, 796, 797,
 igr2= 786, 341,
 &end
#
# 52 MET QE 0 AMBIG 894  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 795, 796, 797,
 igr2= 788, 789, 294, 295,
 &end
#
# 52 MET QE 0 AMBIG 895  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 795, 796, 797,
 igr2= 784, 373,
 &end
#
# 6 ILE QD1 0 AMBIG 896  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 104, 105, 106,
 igr2=1160,1161,1162,1164,1165,1166, 442, 443, 444, 446,
       447, 448,
 &end
#
# 6 ILE QD1 0 AMBIG 897  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 104, 105, 106,
 igr2=  97,  98,  99, 538, 539, 540, 542, 543, 544,
 &end
#
# 6 ILE QD1 0 AMBIG 898  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 104, 105, 106,
 igr2=2003,1484,1485,
 &end
#
# 6 ILE QD1 0 AMBIG 899  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 104, 105, 106,
 igr2= 112,  93,
 &end
#
# 6 ILE QD1 0 AMBIG 900  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 104, 105, 106,
 igr2= 110,1186,
 &end
#
# 6 ILE QD1 0 AMBIG 901  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 104, 105, 106,
 igr2= 131,  91,
 &end
#
# 59 ILE QD1 0 AMBIG 902  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 905, 906, 907,
 igr2= 784, 726,
 &end
#
# 59 ILE QD1 0 AMBIG 903  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 905, 906, 907,
 igr2= 894, 786,
 &end
#
# 59 ILE QD1 0 AMBIG 904  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 905, 906, 907,
 igr2= 791, 792, 896,
 &end
#
# 59 ILE QD1 0 AMBIG 905  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 905, 906, 907,
 igr2= 788, 789, 294, 295,
 &end
#
# 59 ILE QD1 0 AMBIG 906  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 905, 906, 907,
 igr2= 730, 731, 732, 788, 789,
 &end
#
# 59 ILE QD1 0 AMBIG 907  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 905, 906, 907,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 67 ILE QD1 0 AMBIG 908  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1022,1023,1024,
 igr2=1342,1028,
 &end
#
# 67 ILE QD1 0 AMBIG 909  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1022,1023,1024,
 igr2=1332,1333,1332,1333,
 &end
#
# 67 ILE QD1 0 AMBIG 910  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1022,1023,1024,
 igr2=1019,1020, 155, 156,
 &end
#
# 67 ILE QD1 0 AMBIG 911  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1=1022,1023,1024,
 igr2= 607, 608, 584, 585, 586,
 &end
#
# 39 ILE QD1 0 AMBIG 912  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 610, 611, 612,
 igr2=1329,1330,1329,1330,
 &end
#
# 66 ILE QD1 0 AMBIG 913  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1003,1004,1005,
 igr2= 980, 992,
 &end
#
# 39 ILE QD1 0 AMBIG 914  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 610, 611, 612,
 igr2= 187, 188, 189,1303,1304,
 &end
#
# 57 ILE QD1 0 AMBIG 915  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 874, 875, 876,
 igr2= 861, 854,
 &end
#
# 57 ILE QD1 0 AMBIG 916  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 874, 875, 876,
 igr2= 343, 344, 297, 298,
 &end
#
# 57 ILE QD1 0 AMBIG 917  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 874, 875, 876,
 igr2= 842,1891,1892,
 &end
#
# 57 ILE QD1 0 AMBIG 918  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 874, 875, 876,
 igr2= 402, 403, 399, 400,
 &end
#
# 71 ILE QD1 0 AMBIG 919  1.8 4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1076,1077,1078,
 igr2=  78,  79,  80,1089,
 &end
#
# 90 PRO QD 0 AMBIG 920  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1329,1330,
 igr2=1332,1333,1332,1333,
 &end
#
# 90 PRO QD 0 AMBIG 921  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1329,1330,
 igr2=1332,1333,1332,1333,
 &end
#
# 58 ASP- HA 0 AMBIG 922  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 882,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2= 742, 743, 744, 746, 747, 748, 742, 743, 744, 746,
       747, 748,
 &end
#
# 18 GLN HA 0 AMBIG 923  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 321, 322, 280, 281,
 &end
#
# 27 TYR QB 0 AMBIG 924  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 416, 417,
 igr2=2076,2077,2078,2000,2001,
 &end
#
# 53 LYS+ QG 0 AMBIG 925  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 808, 809,
 igr2= 742, 743, 744, 746, 747, 748, 762, 763,
 &end
#
# 53 LYS+ QD 0 AMBIG 926  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 811, 812,
 igr2= 814, 815, 884, 885,
 &end
#
# 59 ILE HA 0 AMBIG 927  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat= 894,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 943, 944, 896,
 &end
#
# 89 CYX HA 0 AMBIG 928  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1320,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2= 187, 188, 189,1303,1304,
 &end
#
# 89 CYX HA 0 AMBIG 929  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1320,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1332,1333,1332,1333,
 &end
#
# 89 CYX HA 0 AMBIG 930  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1320,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1322,1323,1288,1289,
 &end
#
# 89 CYX HA 0 AMBIG 931  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1320,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1329,1330,1329,1330,
 &end
#
# 131 LEU HA 0 AMBIG 932  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1998,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1996,2052,
 &end
#
# 131 LEU HA 0 AMBIG 933  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=1998,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=2000,2001,1979,1980,
 &end
#
# 73 ASN QB 0 AMBIG 934  1.8 2.8
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1105,1106,
 igr2=1103,1053,
 &end
#
# 109 ALA QB 0 AMBIG 935  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1639,1640,1641,
 igr2=1738,1739,1615,1616,
 &end
#
# 69 SER HA 0 AMBIG 936  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1042,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1063,1115,
 &end
#
# 127 ILE HA 0 AMBIG 937  1.8 5.5
 &rst
  ixpk= 0, nxpk= 0, iat=1934,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1996,1958,
 &end
#
# 130 ARG+ HA 0 AMBIG 938  1.8 3.5
 &rst
  ixpk= 0, nxpk= 0, iat=1974,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1996,2052,
 &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           H1       MET   1   8.444   6.161   2.984
    2   2H    MET   1           H2       MET   1   7.388   7.404   2.796
    3   3H    MET   1           H3       MET   1   6.836   5.880   3.030
    4    HA   MET   1           HA       MET   1   6.576   6.479   0.743
    5   1HB   MET   1          HB2       MET   1   8.433   8.121   0.671
    6   2HB   MET   1          HB3       MET   1   9.613   6.809   0.771
    7   1HG   MET   1          HG2       MET   1   8.796   5.912  -1.392
    8   2HG   MET   1          HG3       MET   1   7.585   7.200  -1.469
    9   1HE   MET   1          HE1       MET   1   9.576   6.525  -3.853
   10   2HE   MET   1          HE2       MET   1   8.384   7.846  -3.922
   11   3HE   MET   1          HE3       MET   1  10.082   8.153  -4.349
   12    H    GLU   2           H        GLU   2   6.039   4.563  -0.198
   13    HA   GLU   2           HA       GLU   2   7.992   2.317  -0.070
   14   1HB   GLU   2          HB2       GLU   2   5.988   2.174   1.515
   15   2HB   GLU   2          HB3       GLU   2   4.971   2.056   0.082
   16   1HG   GLU   2          HG2       GLU   2   5.413  -0.145   1.074
   17   2HG   GLU   2          HG3       GLU   2   6.080  -0.072  -0.543
   18    H    ASN   3           H        ASN   3   6.705   4.516  -2.122
   19    HA   ASN   3           HA       ASN   3   6.126   2.819  -4.431
   20   1HB   ASN   3          HB2       ASN   3   5.368   5.278  -4.021
   21   2HB   ASN   3          HB3       ASN   3   7.027   5.736  -4.432
   22   1HD2  ASN   3          HD22      ASN   3   7.796   5.093  -6.690
   23   2HD2  ASN   3          HD21      ASN   3   6.531   4.987  -7.924
   24    H    LYS   4           H        LYS   4   7.752   2.121  -5.881
   25    HA   LYS   4           HA       LYS   4  10.518   2.090  -4.898
   26   1HB   LYS   4          HB2       LYS   4   8.990   0.910  -7.239
   27   2HB   LYS   4          HB3       LYS   4  10.727   1.060  -7.379
   28   1HG   LYS   4          HG2       LYS   4  10.140  -1.143  -6.686
   29   2HG   LYS   4          HG3       LYS   4  11.106  -0.358  -5.451
   30   1HD   LYS   4          HD2       LYS   4   8.101  -0.262  -5.132
   31   2HD   LYS   4          HD3       LYS   4   8.898  -1.826  -4.954
   32   1HE   LYS   4          HE2       LYS   4  10.429  -0.899  -3.248
   33   2HE   LYS   4          HE3       LYS   4   9.619   0.673  -3.371
   34   1HZ   LYS   4          HZ1       LYS   4   8.771  -0.668  -1.513
   35   2HZ   LYS   4          HZ2       LYS   4   7.617  -0.304  -2.583
   36   3HZ   LYS   4          HZ3       LYS   4   8.258  -1.832  -2.556
   37    H    ILE   5           H        ILE   5  12.242   2.582  -6.608
   38    HA   ILE   5           HA       ILE   5  11.732   4.947  -8.255
   39    HB   ILE   5           HB       ILE   5  14.016   4.773  -6.258
   40   1HG1  ILE   5          HG12      ILE   5  12.857   7.035  -5.401
   41   2HG1  ILE   5          HG13      ILE   5  11.402   6.185  -5.897
   42   1HG2  ILE   5          HG21      ILE   5  14.602   6.012  -8.320
   43   2HG2  ILE   5          HG22      ILE   5  13.176   7.038  -8.112
   44   3HG2  ILE   5          HG23      ILE   5  14.518   7.114  -6.952
   45   1HD1  ILE   5          HD11      ILE   5  12.067   4.283  -4.377
   46   2HD1  ILE   5          HD12      ILE   5  13.544   5.165  -3.970
   47   3HD1  ILE   5          HD13      ILE   5  11.964   5.822  -3.507
   48    H    ILE   6           H        ILE   6  13.156   4.794 -10.136
   49    HA   ILE   6           HA       ILE   6  15.204   2.683 -10.119
   50    HB   ILE   6           HB       ILE   6  13.203   1.459 -10.702
   51   1HG1  ILE   6          HG12      ILE   6  14.876   1.862 -13.217
   52   2HG1  ILE   6          HG13      ILE   6  15.399   0.942 -11.801
   53   1HG2  ILE   6          HG21      ILE   6  12.822   3.324 -13.075
   54   2HG2  ILE   6          HG22      ILE   6  11.814   1.932 -12.648
   55   3HG2  ILE   6          HG23      ILE   6  11.819   3.344 -11.605
   56   1HD1  ILE   6          HD11      ILE   6  14.570  -0.581 -13.477
   57   2HD1  ILE   6          HD12      ILE   6  13.445  -0.578 -12.100
   58   3HD1  ILE   6          HD13      ILE   6  13.036   0.288 -13.603
   59    H    TYR   7           H        TYR   7  16.772   2.957 -11.783
   60    HA   TYR   7           HA       TYR   7  16.630   5.547 -13.221
   61   1HB   TYR   7          HB2       TYR   7  17.903   5.338 -10.905
   62   2HB   TYR   7          HB3       TYR   7  19.115   4.499 -11.839
   63    HD1  TYR   7           HD1      TYR   7  20.572   6.199 -10.755
   64    HD2  TYR   7           HD2      TYR   7  17.529   7.364 -13.589
   65    HE1  TYR   7           HE1      TYR   7  21.445   8.513 -10.761
   66    HE2  TYR   7           HE2      TYR   7  18.394   9.657 -13.589
   67    HH   TYR   7           HH       TYR   7  19.853  11.158 -12.579
   68    H    PHE   8           H        PHE   8  17.492   5.485 -15.264
   69    HA   PHE   8           HA       PHE   8  18.922   3.008 -16.172
   70   1HB   PHE   8          HB2       PHE   8  17.095   4.837 -17.785
   71   2HB   PHE   8          HB3       PHE   8  17.963   3.439 -18.397
   72    HD1  PHE   8           HD1      PHE   8  17.364   1.104 -17.484
   73    HD2  PHE   8           HD2      PHE   8  14.936   4.597 -16.795
   74    HE1  PHE   8           HE1      PHE   8  15.483  -0.348 -16.801
   75    HE2  PHE   8           HE2      PHE   8  13.049   3.128 -16.158
   76    HZ   PHE   8           HZ       PHE   8  13.329   0.668 -16.086
   77    H    LEU   9           H        LEU   9  20.941   3.383 -16.999
   78    HA   LEU   9           HA       LEU   9  21.791   6.225 -17.336
   79   1HB   LEU   9          HB2       LEU   9  23.218   3.871 -16.060
   80   2HB   LEU   9          HB3       LEU   9  23.940   5.452 -16.350
   81    HG   LEU   9           HG       LEU   9  21.667   4.819 -14.425
   82   1HD1  LEU   9          HD11      LEU   9  23.941   4.159 -13.696
   83   2HD1  LEU   9          HD12      LEU   9  24.517   5.813 -13.975
   84   3HD1  LEU   9          HD13      LEU   9  23.302   5.496 -12.723
   85   1HD2  LEU   9          HD21      LEU   9  21.184   7.011 -15.296
   86   2HD2  LEU   9          HD22      LEU   9  21.937   7.223 -13.723
   87   3HD2  LEU   9          HD23      LEU   9  22.893   7.490 -15.204
   88    H    CYS  10           H        CYS  10  23.107   6.722 -19.021
   89    HA   CYS  10           HA       CYS  10  24.356   4.529 -20.615
   90   1HB   CYS  10          HB2       CYS  10  22.548   6.758 -21.661
   91   2HB   CYS  10          HB3       CYS  10  23.639   5.847 -22.709
   92    HG   CYS  10           HG       CYS  10  21.940   4.087 -20.615
   93    H    THR  11           H        THR  11  25.768   5.556 -22.385
   94    HA   THR  11           HA       THR  11  27.856   7.112 -21.296
   95    HB   THR  11           HB       THR  11  28.456   7.289 -23.787
   96    HG1  THR  11           HG1      THR  11  26.239   7.109 -24.550
   97   1HG2  THR  11          HG21      THR  11  27.707   4.482 -22.827
   98   2HG2  THR  11          HG22      THR  11  28.919   4.910 -24.046
   99   3HG2  THR  11          HG23      THR  11  29.169   5.362 -22.347
  100    H    GLY  12           H        GLY  12  24.832   8.036 -22.942
  101   1HA   GLY  12          HA1       GLY  12  25.055  10.685 -21.843
  102   2HA   GLY  12          HA2       GLY  12  24.981  10.652 -23.620
  103    H    ASN  13           H        ASN  13  22.954  11.465 -21.496
  104    HA   ASN  13           HA       ASN  13  20.904   9.419 -21.481
  105   1HB   ASN  13          HB2       ASN  13  21.336  11.042 -19.609
  106   2HB   ASN  13          HB3       ASN  13  20.766  12.341 -20.652
  107   1HD2  ASN  13          HD22      ASN  13  19.308   8.955 -20.219
  108   2HD2  ASN  13          HD21      ASN  13  17.795   9.608 -19.621
  109    H    SER  14           H        SER  14  21.171   9.556 -24.079
  110    HA   SER  14           HA       SER  14  19.110  11.494 -25.061
  111   1HB   SER  14          HB2       SER  14  21.708  10.670 -26.391
  112   2HB   SER  14          HB3       SER  14  20.495  11.774 -27.068
  113    HG   SER  14           HG       SER  14  20.865  13.210 -25.469
  114    H    CYS  15           H        CYS  15  20.058   8.132 -25.122
  115    HA   CYS  15           HA       CYS  15  17.999   7.653 -27.235
  116   1HB   CYS  15          HB2       CYS  15  20.785   6.409 -27.121
  117   2HB   CYS  15          HB3       CYS  15  19.504   5.983 -28.264
  118    HG   CYS  15           HG       CYS  15  21.536   7.348 -29.238
  119    H    ARG  16           H        ARG  16  20.112   5.224 -25.807
  120    HA   ARG  16           HA       ARG  16  18.023   3.420 -25.393
  121   1HB   ARG  16          HB2       ARG  16  20.761   3.666 -24.134
  122   2HB   ARG  16          HB3       ARG  16  19.745   2.265 -23.860
  123   1HG   ARG  16          HG2       ARG  16  19.936   1.509 -26.071
  124   2HG   ARG  16          HG3       ARG  16  20.497   3.070 -26.681
  125   1HD   ARG  16          HD2       ARG  16  22.071   1.374 -24.689
  126   2HD   ARG  16          HD3       ARG  16  22.322   1.324 -26.442
  127    HE   ARG  16           HE       ARG  16  22.521   3.996 -25.952
  128   1HH1  ARG  16          HH21      ARG  16  24.236   1.270 -24.413
  129   2HH1  ARG  16          HH22      ARG  16  25.768   2.138 -24.494
  130   1HH2  ARG  16          HH11      ARG  16  24.308   5.107 -25.719
  131   2HH2  ARG  16          HH12      ARG  16  25.710   4.524 -24.857
  132    H    SER  17           H        SER  17  19.598   5.466 -22.801
  133    HA   SER  17           HA       SER  17  17.936   4.350 -20.769
  134   1HB   SER  17          HB2       SER  17  18.797   6.308 -19.432
  135   2HB   SER  17          HB3       SER  17  20.003   5.273 -20.146
  136    HG   SER  17           HG       SER  17  20.731   7.179 -20.747
  137    H    GLN  18           H        GLN  18  17.547   7.219 -22.822
  138    HA   GLN  18           HA       GLN  18  15.249   8.332 -21.548
  139   1HB   GLN  18          HB2       GLN  18  16.510   8.487 -24.305
  140   2HB   GLN  18          HB3       GLN  18  14.934   9.190 -24.051
  141   1HG   GLN  18          HG2       GLN  18  17.334   9.872 -22.303
  142   2HG   GLN  18          HG3       GLN  18  16.944  10.748 -23.779
  143   1HE2  GLN  18          HE22      GLN  18  16.927  11.812 -20.921
  144   2HE2  GLN  18          HE21      GLN  18  15.283  12.431 -20.768
  145    H    MET  19           H        MET  19  15.501   6.159 -24.380
  146    HA   MET  19           HA       MET  19  12.728   5.654 -24.670
  147   1HB   MET  19          HB2       MET  19  15.081   3.837 -25.370
  148   2HB   MET  19          HB3       MET  19  13.411   3.603 -25.891
  149   1HG   MET  19          HG2       MET  19  13.589   6.009 -26.868
  150   2HG   MET  19          HG3       MET  19  15.331   5.789 -26.719
  151   1HE   MET  19          HE1       MET  19  15.978   2.778 -29.197
  152   2HE   MET  19          HE2       MET  19  16.716   3.878 -28.006
  153   3HE   MET  19          HE3       MET  19  15.604   2.592 -27.473
  154    H    ALA  20           H        ALA  20  15.163   3.894 -22.660
  155    HA   ALA  20           HA       ALA  20  13.414   1.819 -21.839
  156   1HB   ALA  20          HB1       ALA  20  15.791   3.031 -20.354
  157   2HB   ALA  20          HB2       ALA  20  15.039   1.458 -20.021
  158   3HB   ALA  20          HB3       ALA  20  15.864   1.730 -21.569
  159    H    GLU  21           H        GLU  21  14.121   4.971 -20.257
  160    HA   GLU  21           HA       GLU  21  12.302   4.694 -18.117
  161   1HB   GLU  21          HB2       GLU  21  13.905   6.523 -18.309
  162   2HB   GLU  21          HB3       GLU  21  13.024   7.194 -19.687
  163   1HG   GLU  21          HG2       GLU  21  11.028   7.513 -18.176
  164   2HG   GLU  21          HG3       GLU  21  12.002   6.929 -16.837
  165    H    GLY  22           H        GLY  22  11.657   5.739 -21.506
  166   1HA   GLY  22          HA1       GLY  22   8.908   6.352 -21.296
  167   2HA   GLY  22          HA2       GLY  22   9.726   5.713 -22.733
  168    H    TRP  23           H        TRP  23  10.384   3.176 -22.108
  169    HA   TRP  23           HA       TRP  23   7.849   1.805 -22.153
  170   1HB   TRP  23          HB2       TRP  23  10.713   0.847 -21.779
  171   2HB   TRP  23          HB3       TRP  23   9.334  -0.241 -21.819
  172    HD1  TRP  23           HD1      TRP  23  11.678   1.530 -24.091
  173    HE1  TRP  23           HE1      TRP  23  11.114   0.996 -26.509
  174    HE3  TRP  23           HE3      TRP  23   7.004  -0.437 -23.405
  175    HZ2  TRP  23           HZ2      TRP  23   8.777   0.069 -28.026
  176    HZ3  TRP  23           HZ3      TRP  23   5.668  -1.205 -25.338
  177    HH2  TRP  23           HH2      TRP  23   6.556  -0.985 -27.646
  178    H    ALA  24           H        ALA  24  10.296   2.280 -19.579
  179    HA   ALA  24           HA       ALA  24   9.137   0.480 -17.751
  180   1HB   ALA  24          HB1       ALA  24  11.443   1.264 -17.582
  181   2HB   ALA  24          HB2       ALA  24  10.893   2.916 -17.309
  182   3HB   ALA  24          HB3       ALA  24  10.584   1.653 -16.089
  183    H    LYS  25           H        LYS  25   8.580   4.030 -18.128
  184    HA   LYS  25           HA       LYS  25   6.743   4.381 -16.024
  185   1HB   LYS  25          HB2       LYS  25   6.745   5.498 -18.837
  186   2HB   LYS  25          HB3       LYS  25   5.599   6.034 -17.605
  187   1HG   LYS  25          HG2       LYS  25   7.408   6.830 -16.162
  188   2HG   LYS  25          HG3       LYS  25   8.621   6.276 -17.305
  189   1HD   LYS  25          HD2       LYS  25   6.574   8.491 -17.723
  190   2HD   LYS  25          HD3       LYS  25   8.334   8.656 -17.578
  191   1HE   LYS  25          HE2       LYS  25   8.577   7.277 -19.667
  192   2HE   LYS  25          HE3       LYS  25   6.812   7.296 -19.851
  193   1HZ   LYS  25          HZ1       LYS  25   7.048   9.796 -19.882
  194   2HZ   LYS  25          HZ2       LYS  25   8.683   9.544 -20.046
  195   3HZ   LYS  25          HZ3       LYS  25   7.633   9.027 -21.202
  196    H    GLN  26           H        GLN  26   6.157   2.910 -19.223
  197    HA   GLN  26           HA       GLN  26   3.329   2.700 -18.790
  198   1HB   GLN  26          HB2       GLN  26   4.831   0.806 -20.619
  199   2HB   GLN  26          HB3       GLN  26   3.159   1.332 -20.695
  200   1HG   GLN  26          HG2       GLN  26   5.663   2.793 -21.478
  201   2HG   GLN  26          HG3       GLN  26   4.255   2.418 -22.453
  202   1HE2  GLN  26          HE22      GLN  26   5.843   4.945 -21.113
  203   2HE2  GLN  26          HE21      GLN  26   4.497   6.057 -20.858
  204    H    TYR  27           H        TYR  27   5.836   0.142 -18.734
  205    HA   TYR  27           HA       TYR  27   3.978  -1.830 -17.832
  206   1HB   TYR  27          HB2       TYR  27   7.017  -1.862 -17.724
  207   2HB   TYR  27          HB3       TYR  27   5.975  -3.251 -17.457
  208    HD1  TYR  27           HD1      TYR  27   4.196  -3.760 -19.392
  209    HD2  TYR  27           HD2      TYR  27   7.872  -1.573 -19.890
  210    HE1  TYR  27           HE1      TYR  27   4.196  -4.328 -21.798
  211    HE2  TYR  27           HE2      TYR  27   7.967  -2.264 -22.272
  212    HH   TYR  27           HH       TYR  27   5.337  -4.160 -23.827
  213    H    LEU  28           H        LEU  28   6.358   0.138 -16.029
  214    HA   LEU  28           HA       LEU  28   5.853  -1.239 -13.518
  215   1HB   LEU  28          HB2       LEU  28   7.247   1.416 -14.031
  216   2HB   LEU  28          HB3       LEU  28   7.314   0.481 -12.570
  217    HG   LEU  28           HG       LEU  28   8.446  -0.408 -15.248
  218   1HD1  LEU  28          HD11      LEU  28  10.606  -0.057 -14.252
  219   2HD1  LEU  28          HD12      LEU  28   9.658   1.431 -14.049
  220   3HD1  LEU  28          HD13      LEU  28   9.884   0.327 -12.675
  221   1HD2  LEU  28          HD21      LEU  28   8.588  -1.816 -12.551
  222   2HD2  LEU  28          HD22      LEU  28   7.686  -2.382 -13.972
  223   3HD2  LEU  28          HD23      LEU  28   9.439  -2.296 -14.034
  224    H    GLY  29           H        GLY  29   3.933   0.975 -15.195
  225   1HA   GLY  29          HA1       GLY  29   2.065   2.115 -14.639
  226   2HA   GLY  29          HA2       GLY  29   1.943   0.979 -13.285
  227    H    ASP  30           H        ASP  30   4.590   3.257 -13.571
  228    HA   ASP  30           HA       ASP  30   5.451   4.828 -12.275
  229   1HB   ASP  30          HB2       ASP  30   3.588   6.069 -13.286
  230   2HB   ASP  30          HB3       ASP  30   2.606   5.762 -11.850
  231    H    GLU  31           H        GLU  31   4.105   2.267 -10.907
  232    HA   GLU  31           HA       GLU  31   4.084   2.968  -8.107
  233   1HB   GLU  31          HB2       GLU  31   4.711   0.221  -9.257
  234   2HB   GLU  31          HB3       GLU  31   4.109   0.625  -7.653
  235   1HG   GLU  31          HG2       GLU  31   2.007   1.520  -8.836
  236   2HG   GLU  31          HG3       GLU  31   2.642   0.744 -10.299
  237    H    TRP  32           H        TRP  32   6.464   3.127 -10.333
  238    HA   TRP  32           HA       TRP  32   8.682   2.940  -8.426
  239   1HB   TRP  32          HB2       TRP  32   8.811   2.110 -11.351
  240   2HB   TRP  32          HB3       TRP  32  10.109   2.035 -10.177
  241    HD1  TRP  32           HD1      TRP  32   6.549   0.470 -10.395
  242    HE1  TRP  32           HE1      TRP  32   6.642  -1.986  -9.847
  243    HE3  TRP  32           HE3      TRP  32  11.600   0.037  -9.633
  244    HZ2  TRP  32           HZ2      TRP  32   8.661  -3.979  -9.416
  245    HZ3  TRP  32           HZ3      TRP  32  12.586  -2.197  -9.224
  246    HH2  TRP  32           HH2      TRP  32  11.136  -4.227  -9.175
  247    H    LYS  33           H        LYS  33   9.460   5.049  -8.370
  248    HA   LYS  33           HA       LYS  33   8.690   7.113 -10.231
  249   1HB   LYS  33          HB2       LYS  33  10.779   6.933  -8.019
  250   2HB   LYS  33          HB3       LYS  33  10.477   8.395  -8.956
  251   1HG   LYS  33          HG2       LYS  33   8.521   7.043  -7.056
  252   2HG   LYS  33          HG3       LYS  33   9.481   8.473  -6.755
  253   1HD   LYS  33          HD2       LYS  33   7.490   9.451  -7.236
  254   2HD   LYS  33          HD3       LYS  33   8.254   9.503  -8.826
  255   1HE   LYS  33          HE2       LYS  33   6.946   7.441  -9.464
  256   2HE   LYS  33          HE3       LYS  33   6.215   7.430  -7.856
  257   1HZ   LYS  33          HZ1       LYS  33   4.825   8.475  -9.570
  258   2HZ   LYS  33          HZ2       LYS  33   5.170   9.532  -8.357
  259   3HZ   LYS  33          HZ3       LYS  33   5.935   9.640  -9.804
  260    H    VAL  34           H        VAL  34   9.309   6.605 -12.294
  261    HA   VAL  34           HA       VAL  34  11.838   5.385 -12.839
  262    HB   VAL  34           HB       VAL  34  10.044   6.602 -14.952
  263   1HG1  VAL  34          HG11      VAL  34  11.340   3.862 -14.878
  264   2HG1  VAL  34          HG12      VAL  34  10.789   4.821 -16.277
  265   3HG1  VAL  34          HG13      VAL  34  12.248   5.296 -15.388
  266   1HG2  VAL  34          HG21      VAL  34   8.723   4.456 -15.007
  267   2HG2  VAL  34          HG22      VAL  34   9.371   4.061 -13.408
  268   3HG2  VAL  34          HG23      VAL  34   8.340   5.496 -13.640
  269    H    TYR  35           H        TYR  35  13.682   6.358 -13.627
  270    HA   TYR  35           HA       TYR  35  13.649   9.144 -14.631
  271   1HB   TYR  35          HB2       TYR  35  15.466   8.065 -12.428
  272   2HB   TYR  35          HB3       TYR  35  15.705   9.593 -13.255
  273    HD1  TYR  35           HD1      TYR  35  14.001   7.910 -10.537
  274    HD2  TYR  35           HD2      TYR  35  14.002  11.458 -12.995
  275    HE1  TYR  35           HE1      TYR  35  12.688   9.112  -8.810
  276    HE2  TYR  35           HE2      TYR  35  12.660  12.651 -11.294
  277    HH   TYR  35           HH       TYR  35  11.621  12.517  -9.207
  278    H    SER  36           H        SER  36  15.749   9.621 -15.778
  279    HA   SER  36           HA       SER  36  17.548   7.369 -16.171
  280   1HB   SER  36          HB2       SER  36  17.597   7.635 -18.594
  281   2HB   SER  36          HB3       SER  36  16.017   7.078 -18.048
  282    HG   SER  36           HG       SER  36  15.193   9.105 -18.379
  283    H    ALA  37           H        ALA  37  19.625   8.067 -17.068
  284    HA   ALA  37           HA       ALA  37  20.230  10.863 -17.377
  285   1HB   ALA  37          HB1       ALA  37  21.260   9.465 -14.866
  286   2HB   ALA  37          HB2       ALA  37  21.769  11.055 -15.464
  287   3HB   ALA  37          HB3       ALA  37  20.118  10.827 -14.922
  288    H    GLY  38           H        GLY  38  22.995  10.751 -16.976
  289   1HA   GLY  38          HA1       GLY  38  24.251   8.357 -17.778
  290   2HA   GLY  38          HA2       GLY  38  23.992   9.379 -19.208
  291    H    ILE  39           H        ILE  39  26.482   8.962 -18.803
  292    HA   ILE  39           HA       ILE  39  27.972  10.640 -17.071
  293    HB   ILE  39           HB       ILE  39  28.378   9.043 -19.559
  294   1HG1  ILE  39          HG12      ILE  39  30.152   9.329 -17.107
  295   2HG1  ILE  39          HG13      ILE  39  28.709   8.322 -17.125
  296   1HG2  ILE  39          HG21      ILE  39  30.430  11.149 -18.824
  297   2HG2  ILE  39          HG22      ILE  39  30.656   9.833 -20.003
  298   3HG2  ILE  39          HG23      ILE  39  29.467  11.080 -20.325
  299   1HD1  ILE  39          HD11      ILE  39  31.115   7.952 -18.967
  300   2HD1  ILE  39          HD12      ILE  39  30.696   6.962 -17.571
  301   3HD1  ILE  39          HD13      ILE  39  29.627   6.978 -18.989
  302    H    GLU  40           H        GLU  40  26.102  11.476 -19.930
  303    HA   GLU  40           HA       GLU  40  26.564  14.254 -19.349
  304   1HB   GLU  40          HB2       GLU  40  26.990  14.956 -21.619
  305   2HB   GLU  40          HB3       GLU  40  28.308  13.959 -21.018
  306   1HG   GLU  40          HG2       GLU  40  27.641  12.076 -22.349
  307   2HG   GLU  40          HG3       GLU  40  26.071  12.787 -22.727
  308    H    ALA  41           H        ALA  41  24.981  15.577 -20.773
  309    HA   ALA  41           HA       ALA  41  22.795  14.107 -21.997
  310   1HB   ALA  41          HB1       ALA  41  22.389  15.938 -19.579
  311   2HB   ALA  41          HB2       ALA  41  21.096  15.451 -20.684
  312   3HB   ALA  41          HB3       ALA  41  21.943  14.220 -19.720
  313    H    HIS  42           H        HIS  42  22.193  15.275 -23.757
  314    HA   HIS  42           HA       HIS  42  22.566  18.214 -23.793
  315   1HB   HIS  42          HB2       HIS  42  23.664  16.228 -25.826
  316   2HB   HIS  42          HB3       HIS  42  23.390  17.925 -26.208
  317    HD1  HIS  42           HD1      HIS  42  26.097  15.788 -24.707
  318    HD2  HIS  42           HD2      HIS  42  24.706  19.779 -24.553
  319    HE1  HIS  42           HE1      HIS  42  27.976  17.171 -23.735
  320    H    GLY  43           H        GLY  43  20.346  16.035 -23.566
  321   1HA   GLY  43          HA1       GLY  43  18.047  16.557 -24.055
  322   2HA   GLY  43          HA2       GLY  43  18.521  17.201 -25.632
  323    H    LEU  44           H        LEU  44  16.589  15.333 -25.603
  324    HA   LEU  44           HA       LEU  44  17.793  12.694 -25.980
  325   1HB   LEU  44          HB2       LEU  44  15.640  11.780 -25.910
  326   2HB   LEU  44          HB3       LEU  44  15.767  12.933 -24.588
  327    HG   LEU  44           HG       LEU  44  14.278  13.327 -27.222
  328   1HD1  LEU  44          HD11      LEU  44  13.300  12.966 -24.353
  329   2HD1  LEU  44          HD12      LEU  44  12.280  13.162 -25.790
  330   3HD1  LEU  44          HD13      LEU  44  13.294  11.721 -25.610
  331   1HD2  LEU  44          HD21      LEU  44  14.475  15.208 -24.824
  332   2HD2  LEU  44          HD22      LEU  44  14.940  15.558 -26.517
  333   3HD2  LEU  44          HD23      LEU  44  13.249  15.335 -26.099
  334    H    ASN  45           H        ASN  45  17.469  11.424 -27.850
  335    HA   ASN  45           HA       ASN  45  18.175  12.939 -30.174
  336   1HB   ASN  45          HB2       ASN  45  19.081  10.702 -29.422
  337   2HB   ASN  45          HB3       ASN  45  17.569   9.960 -29.928
  338   1HD2  ASN  45          HD22      ASN  45  20.675  10.661 -30.900
  339   2HD2  ASN  45          HD21      ASN  45  20.458  10.626 -32.635
  340    HA   PRO  46           HA       PRO  46  14.011  13.410 -31.884
  341   1HB   PRO  46          HB2       PRO  46  15.497  13.210 -34.512
  342   2HB   PRO  46          HB3       PRO  46  14.205  14.357 -34.035
  343   1HG   PRO  46          HG2       PRO  46  16.799  15.140 -34.010
  344   2HG   PRO  46          HG3       PRO  46  15.715  15.594 -32.655
  345   1HD   PRO  46          HD2       PRO  46  17.765  13.375 -32.759
  346   2HD   PRO  46          HD3       PRO  46  17.396  14.526 -31.437
  347    H    ASN  47           H        ASN  47  16.224  10.828 -33.054
  348    HA   ASN  47           HA       ASN  47  14.098   9.315 -34.355
  349   1HB   ASN  47          HB2       ASN  47  16.815   8.425 -33.366
  350   2HB   ASN  47          HB3       ASN  47  15.740   7.488 -34.392
  351   1HD2  ASN  47          HD22      ASN  47  18.275   9.764 -34.331
  352   2HD2  ASN  47          HD21      ASN  47  18.356  10.062 -36.059
  353    H    ALA  48           H        ALA  48  15.537   9.496 -31.108
  354    HA   ALA  48           HA       ALA  48  14.374   7.069 -30.105
  355   1HB   ALA  48          HB1       ALA  48  16.301   8.224 -28.992
  356   2HB   ALA  48          HB2       ALA  48  15.236   9.569 -28.561
  357   3HB   ALA  48          HB3       ALA  48  14.933   7.961 -27.895
  358    H    VAL  49           H        VAL  49  13.408  10.541 -30.125
  359    HA   VAL  49           HA       VAL  49  10.908  10.222 -28.852
  360    HB   VAL  49           HB       VAL  49  11.742  12.225 -30.998
  361   1HG1  VAL  49          HG11      VAL  49   9.395  12.307 -29.054
  362   2HG1  VAL  49          HG12      VAL  49   9.948  13.668 -30.052
  363   3HG1  VAL  49          HG13      VAL  49   9.303  12.225 -30.833
  364   1HG2  VAL  49          HG21      VAL  49  12.139  13.733 -29.082
  365   2HG2  VAL  49          HG22      VAL  49  11.714  12.423 -27.960
  366   3HG2  VAL  49          HG23      VAL  49  13.166  12.304 -28.975
  367    H    LYS  50           H        LYS  50  11.653  10.091 -32.430
  368    HA   LYS  50           HA       LYS  50   9.028   9.364 -33.215
  369   1HB   LYS  50          HB2       LYS  50  11.748   8.702 -34.427
  370   2HB   LYS  50          HB3       LYS  50  10.236   8.110 -35.101
  371   1HG   LYS  50          HG2       LYS  50   9.446  10.527 -35.273
  372   2HG   LYS  50          HG3       LYS  50  11.092  11.009 -34.843
  373   1HD   LYS  50          HD2       LYS  50  10.937  11.029 -37.260
  374   2HD   LYS  50          HD3       LYS  50  11.955   9.675 -36.786
  375   1HE   LYS  50          HE2       LYS  50  10.557   8.861 -38.526
  376   2HE   LYS  50          HE3       LYS  50   9.928   8.137 -37.047
  377   1HZ   LYS  50          HZ1       LYS  50   8.782  10.504 -38.427
  378   2HZ   LYS  50          HZ2       LYS  50   8.165   9.000 -38.452
  379   3HZ   LYS  50          HZ3       LYS  50   8.177   9.842 -37.058
  380    H    ALA  51           H        ALA  51  11.743   7.229 -32.212
  381    HA   ALA  51           HA       ALA  51  10.499   4.805 -32.815
  382   1HB   ALA  51          HB1       ALA  51  12.436   5.411 -30.529
  383   2HB   ALA  51          HB2       ALA  51  12.131   3.821 -31.252
  384   3HB   ALA  51          HB3       ALA  51  12.895   5.090 -32.211
  385    H    MET  52           H        MET  52  10.349   6.733 -29.761
  386    HA   MET  52           HA       MET  52   8.599   4.840 -28.472
  387   1HB   MET  52          HB2       MET  52   9.092   7.781 -27.854
  388   2HB   MET  52          HB3       MET  52   8.220   6.649 -26.824
  389   1HG   MET  52          HG2       MET  52  11.157   6.675 -27.509
  390   2HG   MET  52          HG3       MET  52  10.390   6.780 -25.936
  391   1HE   MET  52          HE1       MET  52   9.084   4.784 -24.850
  392   2HE   MET  52          HE2       MET  52   8.282   4.174 -26.330
  393   3HE   MET  52          HE3       MET  52   9.237   3.086 -25.316
  394    H    LYS  53           H        LYS  53   7.959   7.813 -30.413
  395    HA   LYS  53           HA       LYS  53   5.146   7.715 -29.994
  396   1HB   LYS  53          HB2       LYS  53   6.953   9.013 -32.013
  397   2HB   LYS  53          HB3       LYS  53   5.262   8.795 -32.454
  398   1HG   LYS  53          HG2       LYS  53   5.393  10.952 -31.467
  399   2HG   LYS  53          HG3       LYS  53   4.553   9.892 -30.330
  400   1HD   LYS  53          HD2       LYS  53   6.835   9.610 -29.148
  401   2HD   LYS  53          HD3       LYS  53   7.408  10.941 -30.150
  402   1HE   LYS  53          HE2       LYS  53   4.988  11.021 -28.290
  403   2HE   LYS  53          HE3       LYS  53   6.615  11.511 -27.825
  404   1HZ   LYS  53          HZ1       LYS  53   6.536  13.253 -29.503
  405   2HZ   LYS  53          HZ2       LYS  53   5.004  12.835 -29.924
  406   3HZ   LYS  53          HZ3       LYS  53   5.325  13.413 -28.432
  407    H    GLU  54           H        GLU  54   7.244   5.746 -32.058
  408    HA   GLU  54           HA       GLU  54   5.146   4.872 -33.772
  409   1HB   GLU  54          HB2       GLU  54   7.539   4.863 -34.388
  410   2HB   GLU  54          HB3       GLU  54   7.800   3.539 -33.242
  411   1HG   GLU  54          HG2       GLU  54   6.289   2.085 -34.520
  412   2HG   GLU  54          HG3       GLU  54   5.814   3.432 -35.559
  413    H    VAL  55           H        VAL  55   5.907   4.119 -30.492
  414    HA   VAL  55           HA       VAL  55   4.072   1.760 -30.597
  415    HB   VAL  55           HB       VAL  55   5.175   1.054 -28.503
  416   1HG1  VAL  55          HG11      VAL  55   7.034   1.427 -30.894
  417   2HG1  VAL  55          HG12      VAL  55   7.204   0.212 -29.617
  418   3HG1  VAL  55          HG13      VAL  55   5.819   0.151 -30.707
  419   1HG2  VAL  55          HG21      VAL  55   7.258   3.193 -29.099
  420   2HG2  VAL  55          HG22      VAL  55   6.028   3.340 -27.821
  421   3HG2  VAL  55          HG23      VAL  55   7.241   2.067 -27.744
  422    H    GLY  56           H        GLY  56   4.015   5.016 -29.892
  423   1HA   GLY  56          HA1       GLY  56   2.103   6.137 -29.233
  424   2HA   GLY  56          HA2       GLY  56   1.427   4.647 -28.552
  425    H    ILE  57           H        ILE  57   4.697   5.951 -27.875
  426    HA   ILE  57           HA       ILE  57   3.902   6.546 -25.063
  427    HB   ILE  57           HB       ILE  57   6.373   5.195 -26.209
  428   1HG1  ILE  57          HG12      ILE  57   4.372   4.252 -24.111
  429   2HG1  ILE  57          HG13      ILE  57   4.364   3.754 -25.797
  430   1HG2  ILE  57          HG21      ILE  57   7.210   5.152 -23.802
  431   2HG2  ILE  57          HG22      ILE  57   7.225   6.736 -24.560
  432   3HG2  ILE  57          HG23      ILE  57   5.935   6.309 -23.410
  433   1HD1  ILE  57          HD11      ILE  57   6.523   3.079 -23.772
  434   2HD1  ILE  57          HD12      ILE  57   5.359   1.995 -24.543
  435   3HD1  ILE  57          HD13      ILE  57   6.630   2.741 -25.512
  436    H    ASP  58           H        ASP  58   5.335   8.227 -24.141
  437    HA   ASP  58           HA       ASP  58   6.558  10.023 -26.146
  438   1HB   ASP  58          HB2       ASP  58   4.443  11.097 -25.561
  439   2HB   ASP  58          HB3       ASP  58   4.801  10.920 -23.829
  440    H    ILE  59           H        ILE  59   8.411  10.861 -25.562
  441    HA   ILE  59           HA       ILE  59   9.354  10.691 -22.782
  442    HB   ILE  59           HB       ILE  59  11.666  10.117 -23.625
  443   1HG1  ILE  59          HG12      ILE  59  10.285   9.256 -26.205
  444   2HG1  ILE  59          HG13      ILE  59  11.195  10.751 -26.050
  445   1HG2  ILE  59          HG21      ILE  59  10.134   8.451 -22.571
  446   2HG2  ILE  59          HG22      ILE  59   9.545   7.986 -24.174
  447   3HG2  ILE  59          HG23      ILE  59  11.237   7.709 -23.721
  448   1HD1  ILE  59          HD11      ILE  59  13.230   9.459 -25.440
  449   2HD1  ILE  59          HD12      ILE  59  12.340   7.946 -25.661
  450   3HD1  ILE  59          HD13      ILE  59  12.602   9.031 -27.035
  451    H    SER  60           H        SER  60   8.441  12.660 -25.280
  452    HA   SER  60           HA       SER  60  10.504  14.633 -25.349
  453   1HB   SER  60          HB2       SER  60   7.566  15.302 -25.541
  454   2HB   SER  60          HB3       SER  60   8.935  16.029 -26.396
  455    HG   SER  60           HG       SER  60   7.624  13.559 -26.754
  456    H    ASN  61           H        ASN  61   7.850  13.970 -23.123
  457    HA   ASN  61           HA       ASN  61   7.902  16.249 -21.481
  458   1HB   ASN  61          HB2       ASN  61   6.093  14.688 -21.426
  459   2HB   ASN  61          HB3       ASN  61   7.157  13.329 -21.097
  460   1HD2  ASN  61          HD22      ASN  61   7.622  12.770 -18.972
  461   2HD2  ASN  61          HD21      ASN  61   7.021  13.656 -17.595
  462    H    GLN  62           H        GLN  62  10.458  13.854 -21.674
  463    HA   GLN  62           HA       GLN  62  11.331  14.483 -18.884
  464   1HB   GLN  62          HB2       GLN  62  12.242  12.121 -18.848
  465   2HB   GLN  62          HB3       GLN  62  10.479  12.250 -18.824
  466   1HG   GLN  62          HG2       GLN  62  10.289  11.707 -21.130
  467   2HG   GLN  62          HG3       GLN  62  12.029  11.883 -21.400
  468   1HE2  GLN  62          HE22      GLN  62  13.213  10.139 -21.452
  469   2HE2  GLN  62          HE21      GLN  62  12.670   8.517 -21.025
  470    H    THR  63           H        THR  63  12.180  16.239 -20.591
  471    HA   THR  63           HA       THR  63  14.339  15.715 -22.235
  472    HB   THR  63           HB       THR  63  14.948  18.181 -21.593
  473    HG1  THR  63           HG1      THR  63  13.885  18.236 -19.578
  474   1HG2  THR  63          HG21      THR  63  13.584  17.538 -23.574
  475   2HG2  THR  63          HG22      THR  63  12.126  17.533 -22.556
  476   3HG2  THR  63          HG23      THR  63  13.014  19.047 -22.841
  477    H    SER  64           H        SER  64  16.477  15.405 -22.040
  478    HA   SER  64           HA       SER  64  17.342  13.925 -20.021
  479   1HB   SER  64          HB2       SER  64  19.072  15.547 -21.918
  480   2HB   SER  64          HB3       SER  64  19.426  13.945 -21.253
  481    HG   SER  64           HG       SER  64  18.422  13.162 -22.865
  482    H    ASP  65           H        ASP  65  19.098  13.966 -18.607
  483    HA   ASP  65           HA       ASP  65  20.393  16.451 -17.842
  484   1HB   ASP  65          HB2       ASP  65  18.265  16.461 -16.479
  485   2HB   ASP  65          HB3       ASP  65  18.761  14.923 -15.767
  486    H    ILE  66           H        ILE  66  22.180  15.986 -16.343
  487    HA   ILE  66           HA       ILE  66  23.462  13.384 -16.788
  488    HB   ILE  66           HB       ILE  66  25.126  14.583 -15.076
  489   1HG1  ILE  66          HG12      ILE  66  23.577  16.649 -14.866
  490   2HG1  ILE  66          HG13      ILE  66  25.309  16.843 -15.031
  491   1HG2  ILE  66          HG21      ILE  66  26.380  15.389 -17.022
  492   2HG2  ILE  66          HG22      ILE  66  25.699  13.772 -17.233
  493   3HG2  ILE  66          HG23      ILE  66  24.921  15.162 -18.026
  494   1HD1  ILE  66          HD11      ILE  66  23.381  17.197 -17.370
  495   2HD1  ILE  66          HD12      ILE  66  24.067  18.497 -16.380
  496   3HD1  ILE  66          HD13      ILE  66  25.127  17.490 -17.378
  497    H    ILE  67           H        ILE  67  24.453  12.362 -14.767
  498    HA   ILE  67           HA       ILE  67  22.395  11.400 -13.116
  499    HB   ILE  67           HB       ILE  67  25.422  11.286 -12.872
  500   1HG1  ILE  67          HG12      ILE  67  23.367   9.161 -13.625
  501   2HG1  ILE  67          HG13      ILE  67  24.204  10.141 -14.818
  502   1HG2  ILE  67          HG21      ILE  67  23.316   9.818 -11.211
  503   2HG2  ILE  67          HG22      ILE  67  25.052   9.435 -11.206
  504   3HG2  ILE  67          HG23      ILE  67  24.498  10.991 -10.607
  505   1HD1  ILE  67          HD11      ILE  67  25.298   8.041 -14.721
  506   2HD1  ILE  67          HD12      ILE  67  26.392   9.244 -14.012
  507   3HD1  ILE  67          HD13      ILE  67  25.491   8.115 -12.965
  508    H    ASP  68           H        ASP  68  21.789  11.833 -11.043
  509    HA   ASP  68           HA       ASP  68  22.944  14.194  -9.651
  510   1HB   ASP  68          HB2       ASP  68  20.941  14.916 -10.952
  511   2HB   ASP  68          HB3       ASP  68  19.969  13.725 -10.079
  512    H    SER  69           H        SER  69  22.998  14.021  -7.462
  513    HA   SER  69           HA       SER  69  23.187  11.556  -6.302
  514   1HB   SER  69          HB2       SER  69  22.608  14.148  -4.844
  515   2HB   SER  69          HB3       SER  69  23.532  12.754  -4.250
  516    HG   SER  69           HG       SER  69  24.885  14.454  -5.011
  517    H    ASP  70           H        ASP  70  20.279  13.492  -6.639
  518    HA   ASP  70           HA       ASP  70  18.884  12.434  -4.362
  519   1HB   ASP  70          HB2       ASP  70  18.418  14.643  -5.410
  520   2HB   ASP  70          HB3       ASP  70  17.796  13.811  -6.842
  521    H    ILE  71           H        ILE  71  19.616  11.070  -7.405
  522    HA   ILE  71           HA       ILE  71  17.445   9.048  -7.115
  523    HB   ILE  71           HB       ILE  71  18.839   9.968  -9.641
  524   1HG1  ILE  71          HG12      ILE  71  15.886  10.457  -9.141
  525   2HG1  ILE  71          HG13      ILE  71  17.040  11.617  -8.504
  526   1HG2  ILE  71          HG21      ILE  71  16.470   8.095  -9.161
  527   2HG2  ILE  71          HG22      ILE  71  17.082   8.591 -10.751
  528   3HG2  ILE  71          HG23      ILE  71  18.104   7.631  -9.678
  529   1HD1  ILE  71          HD11      ILE  71  16.915  10.814 -11.420
  530   2HD1  ILE  71          HD12      ILE  71  16.283  12.311 -10.702
  531   3HD1  ILE  71          HD13      ILE  71  18.030  11.989 -10.673
  532    H    LEU  72           H        LEU  72  20.912   9.648  -8.051
  533    HA   LEU  72           HA       LEU  72  21.514   6.989  -8.538
  534   1HB   LEU  72          HB2       LEU  72  23.773   7.506  -8.555
  535   2HB   LEU  72          HB3       LEU  72  22.938   9.000  -8.992
  536    HG   LEU  72           HG       LEU  72  23.244   9.545  -6.436
  537   1HD1  LEU  72          HD11      LEU  72  25.663   7.765  -6.923
  538   2HD1  LEU  72          HD12      LEU  72  25.427   8.858  -5.550
  539   3HD1  LEU  72          HD13      LEU  72  24.379   7.465  -5.730
  540   1HD2  LEU  72          HD21      LEU  72  24.165  10.855  -8.333
  541   2HD2  LEU  72          HD22      LEU  72  25.361  10.732  -7.042
  542   3HD2  LEU  72          HD23      LEU  72  25.509   9.710  -8.489
  543    H    ASN  73           H        ASN  73  21.580   8.578  -5.352
  544    HA   ASN  73           HA       ASN  73  22.373   6.052  -4.108
  545   1HB   ASN  73          HB2       ASN  73  23.265   7.231  -2.435
  546   2HB   ASN  73          HB3       ASN  73  23.247   8.558  -3.577
  547   1HD2  ASN  73          HD22      ASN  73  21.053   9.983  -3.440
  548   2HD2  ASN  73          HD21      ASN  73  20.453  10.211  -1.821
  549    H    ASN  74           H        ASN  74  19.522   7.016  -5.161
  550    HA   ASN  74           HA       ASN  74  17.934   6.329  -2.712
  551   1HB   ASN  74          HB2       ASN  74  17.972   8.735  -3.268
  552   2HB   ASN  74          HB3       ASN  74  17.516   8.354  -4.924
  553   1HD2  ASN  74          HD22      ASN  74  15.702   9.699  -4.816
  554   2HD2  ASN  74          HD21      ASN  74  14.246   9.232  -3.949
  555    H    ALA  75           H        ALA  75  18.352   5.874  -6.192
  556    HA   ALA  75           HA       ALA  75  15.898   4.636  -6.826
  557   1HB   ALA  75          HB1       ALA  75  18.622   4.210  -8.056
  558   2HB   ALA  75          HB2       ALA  75  17.032   3.829  -8.773
  559   3HB   ALA  75          HB3       ALA  75  17.482   5.512  -8.471
  560    H    ASP  76           H        ASP  76  15.105   2.663  -6.472
  561    HA   ASP  76           HA       ASP  76  16.351   0.861  -4.605
  562   1HB   ASP  76          HB2       ASP  76  13.898   1.079  -4.807
  563   2HB   ASP  76          HB3       ASP  76  13.972   0.466  -6.462
  564    H    LEU  77           H        LEU  77  16.389   1.299  -8.062
  565    HA   LEU  77           HA       LEU  77  18.415  -0.807  -8.352
  566   1HB   LEU  77          HB2       LEU  77  16.336  -2.024  -8.899
  567   2HB   LEU  77          HB3       LEU  77  15.841  -0.729  -9.991
  568    HG   LEU  77           HG       LEU  77  17.780  -1.239 -11.482
  569   1HD1  LEU  77          HD11      LEU  77  19.338  -2.261  -9.835
  570   2HD1  LEU  77          HD12      LEU  77  18.222  -3.627  -9.629
  571   3HD1  LEU  77          HD13      LEU  77  19.033  -3.339 -11.186
  572   1HD2  LEU  77          HD21      LEU  77  15.602  -2.237 -11.917
  573   2HD2  LEU  77          HD22      LEU  77  16.898  -3.348 -12.369
  574   3HD2  LEU  77          HD23      LEU  77  15.994  -3.612 -10.860
  575    H    VAL  78           H        VAL  78  19.918  -0.229  -9.870
  576    HA   VAL  78           HA       VAL  78  19.319   2.058 -11.683
  577    HB   VAL  78           HB       VAL  78  21.971   1.291 -10.379
  578   1HG1  VAL  78          HG11      VAL  78  22.375   2.222 -12.603
  579   2HG1  VAL  78          HG12      VAL  78  21.263   3.573 -12.281
  580   3HG1  VAL  78          HG13      VAL  78  22.787   3.430 -11.384
  581   1HG2  VAL  78          HG21      VAL  78  21.796   3.490  -9.224
  582   2HG2  VAL  78          HG22      VAL  78  20.169   3.712  -9.906
  583   3HG2  VAL  78          HG23      VAL  78  20.489   2.407  -8.753
  584    H    VAL  79           H        VAL  79  19.941   1.664 -13.872
  585    HA   VAL  79           HA       VAL  79  21.008  -1.053 -14.484
  586    HB   VAL  79           HB       VAL  79  18.850   0.393 -16.052
  587   1HG1  VAL  79          HG11      VAL  79  19.748  -2.519 -16.085
  588   2HG1  VAL  79          HG12      VAL  79  18.501  -1.794 -17.115
  589   3HG1  VAL  79          HG13      VAL  79  20.188  -1.301 -17.290
  590   1HG2  VAL  79          HG21      VAL  79  17.213  -1.277 -15.145
  591   2HG2  VAL  79          HG22      VAL  79  18.416  -1.732 -13.923
  592   3HG2  VAL  79          HG23      VAL  79  17.753  -0.086 -13.964
  593    H    THR  80           H        THR  80  22.818  -0.876 -15.762
  594    HA   THR  80           HA       THR  80  23.207   1.673 -17.284
  595    HB   THR  80           HB       THR  80  25.566   0.593 -17.602
  596    HG1  THR  80           HG1      THR  80  24.905  -1.377 -16.443
  597   1HG2  THR  80          HG21      THR  80  25.122   2.679 -16.434
  598   2HG2  THR  80          HG22      THR  80  24.680   1.792 -14.951
  599   3HG2  THR  80          HG23      THR  80  26.348   1.749 -15.573
  600    H    LEU  81           H        LEU  81  23.109   1.635 -19.441
  601    HA   LEU  81           HA       LEU  81  22.373  -0.980 -20.683
  602   1HB   LEU  81          HB2       LEU  81  21.660   1.848 -21.477
  603   2HB   LEU  81          HB3       LEU  81  21.261   0.421 -22.404
  604    HG   LEU  81           HG       LEU  81  19.838  -0.426 -20.563
  605   1HD1  LEU  81          HD11      LEU  81  20.653   0.653 -18.551
  606   2HD1  LEU  81          HD12      LEU  81  20.454   2.273 -19.265
  607   3HD1  LEU  81          HD13      LEU  81  19.051   1.276 -18.843
  608   1HD2  LEU  81          HD21      LEU  81  18.793   0.852 -22.369
  609   2HD2  LEU  81          HD22      LEU  81  17.995   1.208 -20.846
  610   3HD2  LEU  81          HD23      LEU  81  19.140   2.378 -21.516
  611    H    CYS  82           H        CYS  82  25.168   0.152 -20.252
  612    HA   CYS  82           HA       CYS  82  26.228   1.004 -22.769
  613   1HB   CYS  82          HB2       CYS  82  28.401   0.599 -21.644
  614   2HB   CYS  82          HB3       CYS  82  27.334   1.723 -20.815
  615    H    GLY  83           H        GLY  83  26.371  -0.318 -24.531
  616   1HA   GLY  83          HA1       GLY  83  27.990  -2.690 -24.382
  617   2HA   GLY  83          HA2       GLY  83  26.312  -3.070 -24.796
  618    H    ASP  84           H        ASP  84  27.846  -0.040 -25.527
  619    HA   ASP  84           HA       ASP  84  27.481  -0.319 -28.434
  620   1HB   ASP  84          HB2       ASP  84  27.072   2.115 -28.265
  621   2HB   ASP  84          HB3       ASP  84  26.090   1.279 -27.055
  622    H    ALA  85           H        ALA  85  28.786   1.633 -29.526
  623    HA   ALA  85           HA       ALA  85  31.412   0.657 -29.695
  624   1HB   ALA  85          HB1       ALA  85  30.184   1.771 -31.535
  625   2HB   ALA  85          HB2       ALA  85  30.330   3.327 -30.682
  626   3HB   ALA  85          HB3       ALA  85  31.780   2.495 -31.269
  627    H    ALA  86           H        ALA  86  30.225   3.045 -27.408
  628    HA   ALA  86           HA       ALA  86  33.003   4.002 -26.888
  629   1HB   ALA  86          HB1       ALA  86  30.352   5.170 -25.970
  630   2HB   ALA  86          HB2       ALA  86  31.966   5.846 -25.686
  631   3HB   ALA  86          HB3       ALA  86  31.323   5.764 -27.338
  632    H    ASP  87           H        ASP  87  30.104   2.610 -25.363
  633    HA   ASP  87           HA       ASP  87  29.784   1.406 -23.470
  634   1HB   ASP  87          HB2       ASP  87  30.987  -0.117 -24.984
  635   2HB   ASP  87          HB3       ASP  87  32.514   0.300 -24.215
  636    H    LYS  88           H        LYS  88  30.797   3.988 -22.753
  637    HA   LYS  88           HA       LYS  88  32.979   3.852 -20.969
  638   1HB   LYS  88          HB2       LYS  88  30.681   5.837 -20.796
  639   2HB   LYS  88          HB3       LYS  88  32.280   6.032 -20.119
  640   1HG   LYS  88          HG2       LYS  88  31.572   5.965 -23.079
  641   2HG   LYS  88          HG3       LYS  88  32.013   7.376 -22.128
  642   1HD   LYS  88          HD2       LYS  88  33.854   5.028 -22.775
  643   2HD   LYS  88          HD3       LYS  88  33.856   6.606 -23.566
  644   1HE   LYS  88          HE2       LYS  88  34.403   7.696 -21.390
  645   2HE   LYS  88          HE3       LYS  88  34.449   6.108 -20.612
  646   1HZ   LYS  88          HZ1       LYS  88  36.293   5.518 -22.081
  647   2HZ   LYS  88          HZ2       LYS  88  36.251   6.990 -22.793
  648   3HZ   LYS  88          HZ3       LYS  88  36.656   6.853 -21.224
  649    H    CYS  89           H        CYS  89  29.694   2.908 -20.404
  650    HA   CYS  89           HA       CYS  89  28.451   2.345 -18.617
  651   1HB   CYS  89          HB2       CYS  89  31.057   1.086 -17.772
  652   2HB   CYS  89          HB3       CYS  89  29.489   0.746 -17.060
  653    HA   PRO  90           HA       PRO  90  29.274   6.082 -16.086
  654   1HB   PRO  90          HB2       PRO  90  26.395   5.422 -15.505
  655   2HB   PRO  90          HB3       PRO  90  27.156   7.025 -15.776
  656   1HG   PRO  90          HG2       PRO  90  25.756   5.806 -17.758
  657   2HG   PRO  90          HG3       PRO  90  27.283   6.674 -18.115
  658   1HD   PRO  90          HD2       PRO  90  26.800   3.729 -17.878
  659   2HD   PRO  90          HD3       PRO  90  27.857   4.630 -19.007
  660    H    MET  91           H        MET  91  29.902   6.189 -13.997
  661    HA   MET  91           HA       MET  91  30.081   3.851 -12.410
  662   1HB   MET  91          HB2       MET  91  30.552   6.778 -11.652
  663   2HB   MET  91          HB3       MET  91  31.067   5.362 -10.737
  664   1HG   MET  91          HG2       MET  91  32.991   6.035 -11.856
  665   2HG   MET  91          HG3       MET  91  32.415   4.653 -12.782
  666   1HE   MET  91          HE1       MET  91  34.150   6.806 -15.536
  667   2HE   MET  91          HE2       MET  91  34.672   6.537 -13.858
  668   3HE   MET  91          HE3       MET  91  33.984   5.195 -14.803
  669    H    THR  92           H        THR  92  28.959   3.246 -10.614
  670    HA   THR  92           HA       THR  92  26.592   4.784  -9.716
  671    HB   THR  92           HB       THR  92  25.685   2.435  -9.355
  672    HG1  THR  92           HG1      THR  92  27.568   1.239  -9.376
  673   1HG2  THR  92          HG21      THR  92  25.031   2.104 -11.650
  674   2HG2  THR  92          HG22      THR  92  25.212   3.851 -11.427
  675   3HG2  THR  92          HG23      THR  92  26.488   2.927 -12.248
  676    HA   PRO  93           HA       PRO  93  28.293   4.139  -5.601
  677   1HB   PRO  93          HB2       PRO  93  26.076   3.965  -4.006
  678   2HB   PRO  93          HB3       PRO  93  26.595   5.496  -4.779
  679   1HG   PRO  93          HG2       PRO  93  24.508   3.536  -5.756
  680   2HG   PRO  93          HG3       PRO  93  24.365   5.304  -5.604
  681   1HD   PRO  93          HD2       PRO  93  24.962   4.071  -7.963
  682   2HD   PRO  93          HD3       PRO  93  25.661   5.659  -7.543
  683    HA   PRO  94           HA       PRO  94  28.209  -0.333  -5.646
  684   1HB   PRO  94          HB2       PRO  94  29.743  -0.960  -3.471
  685   2HB   PRO  94          HB3       PRO  94  30.410  -0.217  -4.957
  686   1HG   PRO  94          HG2       PRO  94  29.598   1.168  -2.385
  687   2HG   PRO  94          HG3       PRO  94  31.117   1.366  -3.318
  688   1HD   PRO  94          HD2       PRO  94  28.993   3.083  -3.573
  689   2HD   PRO  94          HD3       PRO  94  30.041   2.664  -4.967
  690    H    HIS  95           H        HIS  95  26.990   1.486  -2.898
  691    HA   HIS  95           HA       HIS  95  25.908  -0.664  -1.375
  692   1HB   HIS  95          HB2       HIS  95  26.365   1.652  -0.560
  693   2HB   HIS  95          HB3       HIS  95  25.051   2.257  -1.570
  694    HD1  HIS  95           HD1      HIS  95  25.545  -0.067   1.512
  695    HD2  HIS  95           HD2      HIS  95  22.637   2.203  -0.524
  696    HE1  HIS  95           HE1      HIS  95  23.466  -0.087   2.979
  697    H    VAL  96           H        VAL  96  24.824   0.785  -4.390
  698    HA   VAL  96           HA       VAL  96  22.008   0.029  -3.858
  699    HB   VAL  96           HB       VAL  96  23.220   1.798  -5.999
  700   1HG1  VAL  96          HG11      VAL  96  21.148   0.872  -6.846
  701   2HG1  VAL  96          HG12      VAL  96  20.317   1.202  -5.310
  702   3HG1  VAL  96          HG13      VAL  96  20.854   2.536  -6.353
  703   1HG2  VAL  96          HG21      VAL  96  23.350   2.828  -3.723
  704   2HG2  VAL  96          HG22      VAL  96  22.123   3.635  -4.699
  705   3HG2  VAL  96          HG23      VAL  96  21.632   2.465  -3.460
  706    H    LYS  97           H        LYS  97  20.906  -1.398  -5.169
  707    HA   LYS  97           HA       LYS  97  22.340  -3.514  -6.441
  708   1HB   LYS  97          HB2       LYS  97  20.074  -3.689  -5.346
  709   2HB   LYS  97          HB3       LYS  97  19.391  -2.745  -6.681
  710   1HG   LYS  97          HG2       LYS  97  20.091  -4.521  -8.281
  711   2HG   LYS  97          HG3       LYS  97  20.807  -5.439  -6.944
  712   1HD   LYS  97          HD2       LYS  97  18.579  -5.631  -5.877
  713   2HD   LYS  97          HD3       LYS  97  17.857  -4.695  -7.205
  714   1HE   LYS  97          HE2       LYS  97  18.582  -6.431  -8.826
  715   2HE   LYS  97          HE3       LYS  97  19.331  -7.352  -7.517
  716   1HZ   LYS  97          HZ1       LYS  97  16.430  -6.783  -7.746
  717   2HZ   LYS  97          HZ2       LYS  97  17.147  -8.212  -8.060
  718   3HZ   LYS  97          HZ3       LYS  97  17.131  -7.637  -6.539
  719    H    ARG  98           H        ARG  98  22.734  -3.865  -8.597
  720    HA   ARG  98           HA       ARG  98  21.946  -1.770 -10.528
  721   1HB   ARG  98          HB2       ARG  98  24.178  -1.221  -9.730
  722   2HB   ARG  98          HB3       ARG  98  24.758  -2.845 -10.130
  723   1HG   ARG  98          HG2       ARG  98  24.460  -2.438 -12.509
  724   2HG   ARG  98          HG3       ARG  98  23.647  -0.882 -12.196
  725   1HD   ARG  98          HD2       ARG  98  25.668   0.043 -11.272
  726   2HD   ARG  98          HD3       ARG  98  26.495  -1.519 -11.343
  727    HE   ARG  98           HE       ARG  98  25.594  -0.807 -13.964
  728   1HH1  ARG  98          HH11      ARG  98  27.941   0.497 -11.663
  729   2HH1  ARG  98          HH12      ARG  98  29.259   0.510 -12.787
  730   1HH2  ARG  98          HH21      ARG  98  27.203  -0.615 -15.472
  731   2HH2  ARG  98          HH22      ARG  98  28.827  -0.122 -15.053
  732    H    GLU  99           H        GLU  99  21.797  -2.447 -12.664
  733    HA   GLU  99           HA       GLU  99  22.148  -5.328 -13.328
  734   1HB   GLU  99          HB2       GLU  99  19.817  -3.447 -13.746
  735   2HB   GLU  99          HB3       GLU  99  20.176  -4.602 -15.016
  736   1HG   GLU  99          HG2       GLU  99  19.785  -5.479 -12.133
  737   2HG   GLU  99          HG3       GLU  99  18.441  -5.269 -13.254
  738    H    HIS 100           H        HIS 100  22.620  -5.600 -15.642
  739    HA   HIS 100           HA       HIS 100  23.734  -3.217 -17.015
  740   1HB   HIS 100          HB2       HIS 100  25.634  -4.178 -15.937
  741   2HB   HIS 100          HB3       HIS 100  25.141  -5.821 -16.356
  742    HD1  HIS 100           HD1      HIS 100  26.686  -2.704 -18.051
  743    HD2  HIS 100           HD2      HIS 100  25.849  -6.778 -18.708
  744    HE1  HIS 100           HE1      HIS 100  27.894  -3.347 -20.192
  745    H    TRP 101           H        TRP 101  22.577  -3.088 -18.794
  746    HA   TRP 101           HA       TRP 101  21.607  -5.542 -20.214
  747   1HB   TRP 101          HB2       TRP 101  20.231  -2.863 -19.754
  748   2HB   TRP 101          HB3       TRP 101  19.694  -4.067 -20.907
  749    HD1  TRP 101           HD1      TRP 101  20.594  -5.665 -17.617
  750    HE1  TRP 101           HE1      TRP 101  18.528  -6.250 -16.309
  751    HE3  TRP 101           HE3      TRP 101  17.169  -3.246 -20.548
  752    HZ2  TRP 101           HZ2      TRP 101  15.652  -5.716 -16.497
  753    HZ3  TRP 101           HZ3      TRP 101  14.752  -3.376 -20.007
  754    HH2  TRP 101           HH2      TRP 101  13.993  -4.571 -17.961
  755    H    GLY 102           H        GLY 102  23.984  -5.035 -21.089
  756   1HA   GLY 102          HA1       GLY 102  24.346  -2.644 -22.605
  757   2HA   GLY 102          HA2       GLY 102  25.367  -4.087 -22.644
  758    H    PHE 103           H        PHE 103  23.880  -2.145 -24.655
  759    HA   PHE 103           HA       PHE 103  23.976  -4.022 -26.793
  760   1HB   PHE 103          HB2       PHE 103  21.620  -3.101 -27.636
  761   2HB   PHE 103          HB3       PHE 103  21.779  -4.580 -26.721
  762    HD1  PHE 103           HD1      PHE 103  20.251  -4.952 -25.007
  763    HD2  PHE 103           HD2      PHE 103  21.314  -0.896 -26.023
  764    HE1  PHE 103           HE1      PHE 103  18.739  -4.112 -23.231
  765    HE2  PHE 103           HE2      PHE 103  19.824  -0.069 -24.223
  766    HZ   PHE 103           HZ       PHE 103  18.589  -1.669 -22.780
  767    H    ASP 104           H        ASP 104  23.849  -2.741 -28.859
  768    HA   ASP 104           HA       ASP 104  25.522  -0.503 -28.508
  769   1HB   ASP 104          HB2       ASP 104  25.688  -2.057 -30.424
  770   2HB   ASP 104          HB3       ASP 104  24.144  -1.446 -31.038
  771    H    ASP 105           H        ASP 105  25.262   1.625 -28.975
  772    HA   ASP 105           HA       ASP 105  22.648   2.741 -28.334
  773   1HB   ASP 105          HB2       ASP 105  24.903   3.826 -27.754
  774   2HB   ASP 105          HB3       ASP 105  24.981   4.338 -29.433
  775    HA   PRO 106           HA       PRO 106  21.465   2.456 -32.611
  776   1HB   PRO 106          HB2       PRO 106  19.173   3.982 -32.628
  777   2HB   PRO 106          HB3       PRO 106  19.286   2.298 -32.041
  778   1HG   PRO 106          HG2       PRO 106  19.343   4.836 -30.397
  779   2HG   PRO 106          HG3       PRO 106  18.443   3.324 -30.069
  780   1HD   PRO 106          HD2       PRO 106  20.830   3.921 -28.891
  781   2HD   PRO 106          HD3       PRO 106  20.422   2.240 -29.346
  782    H    ALA 107           H        ALA 107  22.103   5.591 -31.079
  783    HA   ALA 107           HA       ALA 107  22.196   7.071 -33.555
  784   1HB   ALA 107          HB1       ALA 107  23.599   7.654 -30.916
  785   2HB   ALA 107          HB2       ALA 107  23.345   8.785 -32.256
  786   3HB   ALA 107          HB3       ALA 107  21.952   8.177 -31.346
  787    H    ARG 108           H        ARG 108  24.224   4.613 -32.234
  788    HA   ARG 108           HA       ARG 108  26.615   5.544 -33.766
  789   1HB   ARG 108          HB2       ARG 108  26.415   3.637 -31.388
  790   2HB   ARG 108          HB3       ARG 108  27.899   4.048 -32.257
  791   1HG   ARG 108          HG2       ARG 108  27.586   6.438 -31.680
  792   2HG   ARG 108          HG3       ARG 108  26.138   6.025 -30.750
  793   1HD   ARG 108          HD2       ARG 108  27.490   4.632 -29.223
  794   2HD   ARG 108          HD3       ARG 108  28.952   5.020 -30.151
  795    HE   ARG 108           HE       ARG 108  28.365   7.454 -29.654
  796   1HH1  ARG 108          HH21      ARG 108  28.068   4.850 -27.190
  797   2HH1  ARG 108          HH22      ARG 108  27.584   5.941 -25.960
  798   1HH2  ARG 108          HH11      ARG 108  28.004   8.872 -27.916
  799   2HH2  ARG 108          HH12      ARG 108  27.763   8.269 -26.324
  800    H    ALA 109           H        ALA 109  24.009   3.614 -34.222
  801    HA   ALA 109           HA       ALA 109  25.164   1.232 -35.299
  802   1HB   ALA 109          HB1       ALA 109  22.429   2.524 -35.670
  803   2HB   ALA 109          HB2       ALA 109  22.882   0.879 -36.142
  804   3HB   ALA 109          HB3       ALA 109  22.875   1.332 -34.424
  805    H    GLN 110           H        GLN 110  26.846   2.672 -36.445
  806    HA   GLN 110           HA       GLN 110  26.264   4.423 -38.542
  807   1HB   GLN 110          HB2       GLN 110  28.695   2.711 -37.895
  808   2HB   GLN 110          HB3       GLN 110  28.707   3.944 -39.156
  809   1HG   GLN 110          HG2       GLN 110  28.642   5.713 -37.671
  810   2HG   GLN 110          HG3       GLN 110  27.761   4.832 -36.437
  811   1HE2  GLN 110          HE22      GLN 110  28.891   3.433 -34.957
  812   2HE2  GLN 110          HE21      GLN 110  30.631   3.538 -34.776
  813    H    GLY 111           H        GLY 111  26.011   4.254 -40.648
  814   1HA   GLY 111          HA1       GLY 111  26.778   2.344 -42.475
  815   2HA   GLY 111          HA2       GLY 111  25.167   1.811 -41.937
  816    H    THR 112           H        THR 112  23.604   3.834 -41.630
  817    HA   THR 112           HA       THR 112  24.032   6.205 -43.086
  818    HB   THR 112           HB       THR 112  23.624   4.875 -45.091
  819    HG1  THR 112           HG1      THR 112  22.068   6.104 -45.929
  820   1HG2  THR 112          HG21      THR 112  22.382   2.958 -44.191
  821   2HG2  THR 112          HG22      THR 112  20.987   4.006 -43.849
  822   3HG2  THR 112          HG23      THR 112  21.499   3.712 -45.521
  823    H    GLU 113           H        GLU 113  21.891   7.522 -42.996
  824    HA   GLU 113           HA       GLU 113  21.068   7.502 -40.258
  825   1HB   GLU 113          HB2       GLU 113  19.579   9.323 -40.876
  826   2HB   GLU 113          HB3       GLU 113  21.196   9.557 -41.539
  827   1HG   GLU 113          HG2       GLU 113  20.376   8.740 -43.766
  828   2HG   GLU 113          HG3       GLU 113  18.754   8.582 -43.090
  829    H    GLU 114           H        GLU 114  19.679   6.075 -43.182
  830    HA   GLU 114           HA       GLU 114  17.149   5.418 -42.026
  831   1HB   GLU 114          HB2       GLU 114  17.618   5.501 -44.465
  832   2HB   GLU 114          HB3       GLU 114  18.643   4.066 -44.312
  833   1HG   GLU 114          HG2       GLU 114  16.711   2.735 -43.563
  834   2HG   GLU 114          HG3       GLU 114  15.684   4.171 -43.583
  835    H    GLU 115           H        GLU 115  20.318   3.806 -42.078
  836    HA   GLU 115           HA       GLU 115  19.363   1.326 -40.961
  837   1HB   GLU 115          HB2       GLU 115  21.438   1.563 -42.367
  838   2HB   GLU 115          HB3       GLU 115  22.192   2.456 -41.045
  839   1HG   GLU 115          HG2       GLU 115  22.965   0.198 -40.972
  840   2HG   GLU 115          HG3       GLU 115  21.938   0.460 -39.574
  841    H    LYS 116           H        LYS 116  20.961   4.304 -39.680
  842    HA   LYS 116           HA       LYS 116  20.962   3.571 -36.951
  843   1HB   LYS 116          HB2       LYS 116  20.714   6.263 -38.348
  844   2HB   LYS 116          HB3       LYS 116  20.721   6.100 -36.580
  845   1HG   LYS 116          HG2       LYS 116  22.911   4.871 -36.763
  846   2HG   LYS 116          HG3       LYS 116  22.928   5.252 -38.500
  847   1HD   LYS 116          HD2       LYS 116  22.800   7.702 -37.889
  848   2HD   LYS 116          HD3       LYS 116  22.892   7.228 -36.177
  849   1HE   LYS 116          HE2       LYS 116  25.056   5.974 -36.810
  850   2HE   LYS 116          HE3       LYS 116  24.982   6.833 -38.358
  851   1HZ   LYS 116          HZ1       LYS 116  26.363   8.043 -36.810
  852   2HZ   LYS 116          HZ2       LYS 116  25.011   8.928 -37.031
  853   3HZ   LYS 116          HZ3       LYS 116  25.204   8.036 -35.657
  854    H    TRP 117           H        TRP 117  18.351   5.289 -38.799
  855    HA   TRP 117           HA       TRP 117  16.488   5.351 -36.686
  856   1HB   TRP 117          HB2       TRP 117  16.084   6.666 -38.609
  857   2HB   TRP 117          HB3       TRP 117  16.236   5.290 -39.691
  858    HD1  TRP 117           HD1      TRP 117  14.062   4.847 -40.792
  859    HE1  TRP 117           HE1      TRP 117  11.615   4.640 -40.141
  860    HE3  TRP 117           HE3      TRP 117  14.429   6.151 -35.839
  861    HZ2  TRP 117           HZ2      TRP 117   9.998   4.942 -37.747
  862    HZ3  TRP 117           HZ3      TRP 117  12.434   6.108 -34.395
  863    HH2  TRP 117           HH2      TRP 117  10.206   5.499 -35.331
  864    H    ALA 118           H        ALA 118  17.160   2.695 -39.042
  865    HA   ALA 118           HA       ALA 118  14.999   1.074 -38.167
  866   1HB   ALA 118          HB1       ALA 118  16.176   0.742 -40.306
  867   2HB   ALA 118          HB2       ALA 118  17.628   0.208 -39.424
  868   3HB   ALA 118          HB3       ALA 118  16.123  -0.735 -39.329
  869    H    PHE 119           H        PHE 119  18.398   1.338 -37.075
  870    HA   PHE 119           HA       PHE 119  18.074  -0.651 -35.048
  871   1HB   PHE 119          HB2       PHE 119  20.192   1.345 -35.695
  872   2HB   PHE 119          HB3       PHE 119  20.152   0.680 -34.067
  873    HD1  PHE 119           HD1      PHE 119  20.107  -1.840 -33.712
  874    HD2  PHE 119           HD2      PHE 119  21.061  -0.037 -37.510
  875    HE1  PHE 119           HE1      PHE 119  21.132  -3.969 -34.469
  876    HE2  PHE 119           HE2      PHE 119  22.117  -2.156 -38.251
  877    HZ   PHE 119           HZ       PHE 119  22.144  -4.131 -36.737
  878    H    PHE 120           H        PHE 120  17.306   2.825 -35.025
  879    HA   PHE 120           HA       PHE 120  16.926   2.949 -32.182
  880   1HB   PHE 120          HB2       PHE 120  15.796   4.538 -34.498
  881   2HB   PHE 120          HB3       PHE 120  15.035   4.664 -32.933
  882    HD1  PHE 120           HD1      PHE 120  16.202   5.571 -30.961
  883    HD2  PHE 120           HD2      PHE 120  18.002   5.591 -34.877
  884    HE1  PHE 120           HE1      PHE 120  17.891   7.229 -30.200
  885    HE2  PHE 120           HE2      PHE 120  19.710   7.196 -34.097
  886    HZ   PHE 120           HZ       PHE 120  19.628   8.045 -31.761
  887    H    GLN 121           H        GLN 121  14.550   2.069 -34.779
  888    HA   GLN 121           HA       GLN 121  12.571   1.418 -32.813
  889   1HB   GLN 121          HB2       GLN 121  11.359   0.278 -34.624
  890   2HB   GLN 121          HB3       GLN 121  11.804   1.952 -34.942
  891   1HG   GLN 121          HG2       GLN 121  13.700   1.138 -36.342
  892   2HG   GLN 121          HG3       GLN 121  13.140  -0.528 -36.101
  893   1HE2  GLN 121          HE22      GLN 121  12.157   2.715 -37.313
  894   2HE2  GLN 121          HE21      GLN 121  11.032   2.122 -38.510
  895    H    ARG 122           H        ARG 122  15.178  -0.594 -34.255
  896    HA   ARG 122           HA       ARG 122  14.257  -3.054 -33.081
  897   1HB   ARG 122          HB2       ARG 122  17.063  -2.120 -33.808
  898   2HB   ARG 122          HB3       ARG 122  16.693  -3.750 -33.270
  899   1HG   ARG 122          HG2       ARG 122  15.397  -4.254 -35.211
  900   2HG   ARG 122          HG3       ARG 122  15.332  -2.567 -35.715
  901   1HD   ARG 122          HD2       ARG 122  17.874  -2.631 -35.909
  902   2HD   ARG 122          HD3       ARG 122  17.781  -4.380 -35.686
  903    HE   ARG 122           HE       ARG 122  16.158  -4.254 -37.708
  904   1HH1  ARG 122          HH21      ARG 122  19.126  -2.288 -37.377
  905   2HH1  ARG 122          HH22      ARG 122  19.233  -1.938 -39.073
  906   1HH2  ARG 122          HH11      ARG 122  16.425  -3.875 -39.977
  907   2HH2  ARG 122          HH12      ARG 122  17.747  -2.917 -40.540
  908    H    VAL 123           H        VAL 123  16.644  -0.596 -31.815
  909    HA   VAL 123           HA       VAL 123  17.086  -2.110 -29.420
  910    HB   VAL 123           HB       VAL 123  17.625   0.798 -30.148
  911   1HG1  VAL 123          HG11      VAL 123  19.237   0.763 -28.217
  912   2HG1  VAL 123          HG12      VAL 123  17.544   0.704 -27.719
  913   3HG1  VAL 123          HG13      VAL 123  18.532  -0.775 -27.691
  914   1HG2  VAL 123          HG21      VAL 123  18.926  -0.958 -31.430
  915   2HG2  VAL 123          HG22      VAL 123  19.946   0.057 -30.409
  916   3HG2  VAL 123          HG23      VAL 123  19.525  -1.587 -29.887
  917    H    ARG 124           H        ARG 124  14.764   0.502 -30.301
  918    HA   ARG 124           HA       ARG 124  13.587   0.919 -27.767
  919   1HB   ARG 124          HB2       ARG 124  13.069   2.289 -29.720
  920   2HB   ARG 124          HB3       ARG 124  12.523   0.892 -30.612
  921   1HG   ARG 124          HG2       ARG 124  10.768   0.858 -28.462
  922   2HG   ARG 124          HG3       ARG 124  11.082   2.574 -28.653
  923   1HD   ARG 124          HD2       ARG 124   9.135   1.942 -29.970
  924   2HD   ARG 124          HD3       ARG 124  10.466   2.400 -31.037
  925    HE   ARG 124           HE       ARG 124  10.304  -0.471 -30.552
  926   1HH1  ARG 124          HH21      ARG 124   9.054   2.206 -32.471
  927   2HH1  ARG 124          HH22      ARG 124   8.913   1.309 -33.955
  928   1HH2  ARG 124          HH11      ARG 124   9.978  -1.755 -32.490
  929   2HH2  ARG 124          HH12      ARG 124   9.226  -1.040 -33.867
  930    H    ASP 125           H        ASP 125  12.752  -1.513 -30.332
  931    HA   ASP 125           HA       ASP 125  10.591  -2.600 -28.855
  932   1HB   ASP 125          HB2       ASP 125  10.805  -2.948 -31.256
  933   2HB   ASP 125          HB3       ASP 125  12.324  -3.821 -31.043
  934    H    GLU 126           H        GLU 126  14.050  -3.646 -29.078
  935    HA   GLU 126           HA       GLU 126  13.715  -5.947 -27.440
  936   1HB   GLU 126          HB2       GLU 126  16.146  -4.244 -28.080
  937   2HB   GLU 126          HB3       GLU 126  16.208  -5.735 -27.122
  938   1HG   GLU 126          HG2       GLU 126  15.225  -7.009 -28.999
  939   2HG   GLU 126          HG3       GLU 126  15.200  -5.557 -29.993
  940    H    ILE 127           H        ILE 127  14.562  -2.549 -26.594
  941    HA   ILE 127           HA       ILE 127  14.949  -2.993 -23.801
  942    HB   ILE 127           HB       ILE 127  14.151  -0.593 -25.485
  943   1HG1  ILE 127          HG12      ILE 127  16.601  -1.210 -23.776
  944   2HG1  ILE 127          HG13      ILE 127  16.526  -1.483 -25.510
  945   1HG2  ILE 127          HG21      ILE 127  14.333   0.863 -23.563
  946   2HG2  ILE 127          HG22      ILE 127  13.040  -0.283 -23.272
  947   3HG2  ILE 127          HG23      ILE 127  14.609  -0.521 -22.473
  948   1HD1  ILE 127          HD11      ILE 127  16.067   1.015 -25.782
  949   2HD1  ILE 127          HD12      ILE 127  16.496   1.187 -24.061
  950   3HD1  ILE 127          HD13      ILE 127  17.686   0.570 -25.207
  951    H    GLY 128           H        GLY 128  11.978  -2.068 -25.662
  952   1HA   GLY 128          HA1       GLY 128  10.146  -2.057 -23.568
  953   2HA   GLY 128          HA2       GLY 128   9.778  -2.543 -25.236
  954    H    ASN 129           H        ASN 129  11.225  -4.893 -25.511
  955    HA   ASN 129           HA       ASN 129   9.568  -6.791 -24.216
  956   1HB   ASN 129          HB2       ASN 129  12.207  -7.064 -25.700
  957   2HB   ASN 129          HB3       ASN 129  11.497  -8.437 -24.871
  958   1HD2  ASN 129          HD22      ASN 129  10.968  -6.124 -27.530
  959   2HD2  ASN 129          HD21      ASN 129   9.800  -7.117 -28.364
  960    H    ARG 130           H        ARG 130  12.950  -5.819 -23.413
  961    HA   ARG 130           HA       ARG 130  12.925  -7.711 -21.223
  962   1HB   ARG 130          HB2       ARG 130  14.862  -5.575 -22.134
  963   2HB   ARG 130          HB3       ARG 130  15.023  -6.223 -20.501
  964   1HG   ARG 130          HG2       ARG 130  14.907  -7.991 -22.962
  965   2HG   ARG 130          HG3       ARG 130  16.409  -7.417 -22.238
  966   1HD   ARG 130          HD2       ARG 130  14.331  -9.057 -20.681
  967   2HD   ARG 130          HD3       ARG 130  15.675  -9.747 -21.563
  968    HE   ARG 130           HE       ARG 130  17.236  -8.778 -20.107
  969   1HH1  ARG 130          HH21      ARG 130  13.970  -7.917 -18.875
  970   2HH1  ARG 130          HH22      ARG 130  14.435  -8.202 -17.221
  971   1HH2  ARG 130          HH11      ARG 130  17.791  -8.936 -17.895
  972   2HH2  ARG 130          HH12      ARG 130  16.578  -8.778 -16.665
  973    H    LEU 131           H        LEU 131  11.967  -4.303 -21.457
  974    HA   LEU 131           HA       LEU 131  11.828  -3.948 -18.617
  975   1HB   LEU 131          HB2       LEU 131  11.429  -2.279 -20.838
  976   2HB   LEU 131          HB3       LEU 131   9.832  -2.439 -20.152
  977    HG   LEU 131           HG       LEU 131  10.871  -0.538 -19.198
  978   1HD1  LEU 131          HD11      LEU 131  10.830  -0.973 -16.790
  979   2HD1  LEU 131          HD12      LEU 131   9.519  -1.854 -17.604
  980   3HD1  LEU 131          HD13      LEU 131  10.977  -2.704 -17.079
  981   1HD2  LEU 131          HD21      LEU 131  13.226  -1.206 -19.684
  982   2HD2  LEU 131          HD22      LEU 131  12.993  -0.479 -18.099
  983   3HD2  LEU 131          HD23      LEU 131  13.200  -2.230 -18.230
  984    H    LYS 132           H        LYS 132   9.494  -5.139 -21.092
  985    HA   LYS 132           HA       LYS 132   7.310  -5.542 -19.354
  986   1HB   LYS 132          HB2       LYS 132   7.116  -5.736 -21.774
  987   2HB   LYS 132          HB3       LYS 132   8.185  -7.129 -21.802
  988   1HG   LYS 132          HG2       LYS 132   6.590  -8.512 -20.638
  989   2HG   LYS 132          HG3       LYS 132   5.526  -7.120 -20.326
  990   1HD   LYS 132          HD2       LYS 132   5.032  -6.864 -22.679
  991   2HD   LYS 132          HD3       LYS 132   6.306  -7.986 -23.140
  992   1HE   LYS 132          HE2       LYS 132   4.094  -8.989 -23.397
  993   2HE   LYS 132          HE3       LYS 132   5.096  -9.888 -22.257
  994   1HZ   LYS 132          HZ1       LYS 132   3.813  -9.155 -20.469
  995   2HZ   LYS 132          HZ2       LYS 132   3.097  -7.922 -21.323
  996   3HZ   LYS 132          HZ3       LYS 132   2.720  -9.481 -21.616
  997    H    GLU 133           H        GLU 133   9.983  -7.802 -20.187
  998    HA   GLU 133           HA       GLU 133   9.086  -9.782 -18.373
  999   1HB   GLU 133          HB2       GLU 133  11.928  -9.352 -19.319
 1000   2HB   GLU 133          HB3       GLU 133  11.280 -10.785 -18.483
 1001   1HG   GLU 133          HG2       GLU 133   9.674 -11.157 -20.314
 1002   2HG   GLU 133          HG3       GLU 133  10.304  -9.760 -21.180
 1003    H    PHE 134           H        PHE 134  11.283  -7.030 -17.793
 1004    HA   PHE 134           HA       PHE 134  11.997  -7.796 -15.163
 1005   1HB   PHE 134          HB2       PHE 134  13.225  -6.097 -16.314
 1006   2HB   PHE 134          HB3       PHE 134  11.783  -5.122 -16.567
 1007    HD1  PHE 134           HD1      PHE 134  11.225  -3.398 -15.073
 1008    HD2  PHE 134           HD2      PHE 134  13.962  -6.478 -13.811
 1009    HE1  PHE 134           HE1      PHE 134  11.703  -2.106 -13.027
 1010    HE2  PHE 134           HE2      PHE 134  14.392  -5.220 -11.715
 1011    HZ   PHE 134           HZ       PHE 134  13.279  -3.031 -11.323
 1012    H    ALA 135           H        ALA 135   9.116  -6.143 -16.395
 1013    HA   ALA 135           HA       ALA 135   8.201  -5.473 -13.723
 1014   1HB   ALA 135          HB1       ALA 135   7.682  -4.063 -15.713
 1015   2HB   ALA 135          HB2       ALA 135   6.745  -5.401 -16.409
 1016   3HB   ALA 135          HB3       ALA 135   6.202  -4.627 -14.905
 1017    H    GLU 136           H        GLU 136   7.548  -7.942 -16.161
 1018    HA   GLU 136           HA       GLU 136   5.237  -9.023 -14.807
 1019   1HB   GLU 136          HB2       GLU 136   5.315  -8.785 -17.213
 1020   2HB   GLU 136          HB3       GLU 136   6.781  -9.771 -17.321
 1021   1HG   GLU 136          HG2       GLU 136   5.597 -11.753 -16.577
 1022   2HG   GLU 136          HG3       GLU 136   4.104 -10.822 -16.349
 1023    H    THR 137           H        THR 137   8.556 -10.075 -15.474
 1024    HA   THR 137           HA       THR 137   8.077 -12.599 -13.999
 1025    HB   THR 137           HB       THR 137   9.654 -13.666 -15.384
 1026    HG1  THR 137           HG1      THR 137  10.236 -11.060 -16.310
 1027   1HG2  THR 137          HG21      THR 137   8.678 -13.526 -17.579
 1028   2HG2  THR 137          HG22      THR 137   7.384 -13.358 -16.379
 1029   3HG2  THR 137          HG23      THR 137   7.995 -11.924 -17.248
 1030    H    GLY 138           H        GLY 138   9.978  -9.662 -14.028
 1031   1HA   GLY 138          HA1       GLY 138  11.363  -8.845 -12.356
 1032   2HA   GLY 138          HA2       GLY 138  11.361 -10.415 -11.553
 1033    H    LYS 139           H        LYS 139  12.114 -10.539 -15.001
 1034    HA   LYS 139           HA       LYS 139  14.763 -11.522 -14.433
 1035   1HB   LYS 139          HB2       LYS 139  13.199 -10.908 -16.967
 1036   2HB   LYS 139          HB3       LYS 139  14.896 -11.411 -16.995
 1037   1HG   LYS 139          HG2       LYS 139  14.400 -13.518 -15.913
 1038   2HG   LYS 139          HG3       LYS 139  12.736 -13.042 -15.583
 1039   1HD   LYS 139          HD2       LYS 139  12.864 -14.621 -17.456
 1040   2HD   LYS 139          HD3       LYS 139  12.193 -13.066 -17.970
 1041   1HE   LYS 139          HE2       LYS 139  14.372 -12.389 -18.876
 1042   2HE   LYS 139          HE3       LYS 139  15.101 -13.908 -18.326
 1043   1HZ   LYS 139          HZ1       LYS 139  13.591 -15.079 -19.846
 1044   2HZ   LYS 139          HZ2       LYS 139  12.948 -13.651 -20.355
 1045   3HZ   LYS 139          HZ3       LYS 139  14.515 -14.015 -20.666
  Start of MODEL    2
    1   1H    MET   1           H1       MET   1   3.365   0.447   3.146
    2   2H    MET   1           H2       MET   1   2.316  -0.601   2.433
    3   3H    MET   1           H3       MET   1   3.825  -0.374   1.807
    4    HA   MET   1           HA       MET   1   2.172   0.734   0.483
    5   1HB   MET   1          HB2       MET   1   0.580   1.241   2.301
    6   2HB   MET   1          HB3       MET   1   1.714   2.405   2.996
    7   1HG   MET   1          HG2       MET   1  -0.031   3.504   1.667
    8   2HG   MET   1          HG3       MET   1   1.567   3.800   0.989
    9   1HE   MET   1          HE1       MET   1   0.514   4.717  -1.233
   10   2HE   MET   1          HE2       MET   1  -0.724   3.859  -2.177
   11   3HE   MET   1          HE3       MET   1  -1.108   4.460  -0.549
   12    H    GLU   2           H        GLU   2   3.605   1.589  -0.923
   13    HA   GLU   2           HA       GLU   2   5.454   3.701  -0.261
   14   1HB   GLU   2          HB2       GLU   2   7.490   2.450  -0.564
   15   2HB   GLU   2          HB3       GLU   2   6.622   1.792   0.803
   16   1HG   GLU   2          HG2       GLU   2   6.741   0.588  -1.992
   17   2HG   GLU   2          HG3       GLU   2   7.692   0.071  -0.609
   18    H    ASN   3           H        ASN   3   7.059   3.814  -2.294
   19    HA   ASN   3           HA       ASN   3   5.849   2.833  -4.795
   20   1HB   ASN   3          HB2       ASN   3   5.057   5.253  -4.267
   21   2HB   ASN   3          HB3       ASN   3   6.749   5.733  -4.498
   22   1HD2  ASN   3          HD22      ASN   3   7.734   5.227  -6.709
   23   2HD2  ASN   3          HD21      ASN   3   6.600   5.276  -8.054
   24    H    LYS   4           H        LYS   4   7.559   2.276  -6.224
   25    HA   LYS   4           HA       LYS   4  10.218   2.156  -4.966
   26   1HB   LYS   4          HB2       LYS   4   9.345   1.252  -7.731
   27   2HB   LYS   4          HB3       LYS   4  10.786   0.734  -6.876
   28   1HG   LYS   4          HG2       LYS   4   7.908   0.038  -6.157
   29   2HG   LYS   4          HG3       LYS   4   9.065  -1.014  -6.946
   30   1HD   LYS   4          HD2       LYS   4   9.299   0.094  -4.129
   31   2HD   LYS   4          HD3       LYS   4   8.831  -1.550  -4.554
   32   1HE   LYS   4          HE2       LYS   4  11.543  -0.253  -5.073
   33   2HE   LYS   4          HE3       LYS   4  11.183  -1.406  -3.793
   34   1HZ   LYS   4          HZ1       LYS   4  10.823  -3.102  -5.428
   35   2HZ   LYS   4          HZ2       LYS   4  10.979  -2.049  -6.682
   36   3HZ   LYS   4          HZ3       LYS   4  12.271  -2.379  -5.732
   37    H    ILE   5           H        ILE   5  12.093   2.534  -6.675
   38    HA   ILE   5           HA       ILE   5  11.677   4.896  -8.354
   39    HB   ILE   5           HB       ILE   5  13.919   4.692  -6.317
   40   1HG1  ILE   5          HG12      ILE   5  12.818   6.999  -5.520
   41   2HG1  ILE   5          HG13      ILE   5  11.343   6.203  -6.043
   42   1HG2  ILE   5          HG21      ILE   5  14.570   5.882  -8.392
   43   2HG2  ILE   5          HG22      ILE   5  13.164   6.941  -8.225
   44   3HG2  ILE   5          HG23      ILE   5  14.490   7.011  -7.045
   45   1HD1  ILE   5          HD11      ILE   5  11.824   5.858  -3.639
   46   2HD1  ILE   5          HD12      ILE   5  11.888   4.299  -4.480
   47   3HD1  ILE   5          HD13      ILE   5  13.389   5.128  -4.050
   48    H    ILE   6           H        ILE   6  13.064   4.696 -10.210
   49    HA   ILE   6           HA       ILE   6  15.145   2.629 -10.178
   50    HB   ILE   6           HB       ILE   6  13.177   1.367 -10.812
   51   1HG1  ILE   6          HG12      ILE   6  14.919   1.815 -13.273
   52   2HG1  ILE   6          HG13      ILE   6  15.423   0.907 -11.840
   53   1HG2  ILE   6          HG21      ILE   6  12.844   3.246 -13.186
   54   2HG2  ILE   6          HG22      ILE   6  11.845   1.830 -12.811
   55   3HG2  ILE   6          HG23      ILE   6  11.788   3.233 -11.754
   56   1HD1  ILE   6          HD11      ILE   6  13.132   0.205 -13.709
   57   2HD1  ILE   6          HD12      ILE   6  14.693  -0.620 -13.552
   58   3HD1  ILE   6          HD13      ILE   6  13.531  -0.662 -12.203
   59    H    TYR   7           H        TYR   7  16.687   2.906 -11.882
   60    HA   TYR   7           HA       TYR   7  16.613   5.547 -13.251
   61   1HB   TYR   7          HB2       TYR   7  17.590   5.412 -10.863
   62   2HB   TYR   7          HB3       TYR   7  18.856   4.421 -11.546
   63    HD1  TYR   7           HD1      TYR   7  20.305   5.996 -10.376
   64    HD2  TYR   7           HD2      TYR   7  17.742   7.346 -13.580
   65    HE1  TYR   7           HE1      TYR   7  21.413   8.193 -10.347
   66    HE2  TYR   7           HE2      TYR   7  18.858   9.546 -13.541
   67    HH   TYR   7           HH       TYR   7  21.312  10.307 -11.018
   68    H    PHE   8           H        PHE   8  17.574   5.485 -15.244
   69    HA   PHE   8           HA       PHE   8  19.059   3.015 -16.096
   70   1HB   PHE   8          HB2       PHE   8  17.194   4.795 -17.729
   71   2HB   PHE   8          HB3       PHE   8  18.071   3.398 -18.324
   72    HD1  PHE   8           HD1      PHE   8  17.570   1.095 -17.149
   73    HD2  PHE   8           HD2      PHE   8  14.967   4.522 -16.964
   74    HE1  PHE   8           HE1      PHE   8  15.688  -0.383 -16.519
   75    HE2  PHE   8           HE2      PHE   8  13.075   3.021 -16.384
   76    HZ   PHE   8           HZ       PHE   8  13.437   0.590 -16.104
   77    H    LEU   9           H        LEU   9  21.095   3.420 -16.781
   78    HA   LEU   9           HA       LEU   9  21.921   6.252 -17.235
   79   1HB   LEU   9          HB2       LEU   9  23.037   3.964 -15.635
   80   2HB   LEU   9          HB3       LEU   9  24.164   5.079 -16.383
   81    HG   LEU   9           HG       LEU   9  23.372   6.949 -15.159
   82   1HD1  LEU   9          HD11      LEU   9  21.137   5.189 -14.088
   83   2HD1  LEU   9          HD12      LEU   9  21.602   6.762 -13.404
   84   3HD1  LEU   9          HD13      LEU   9  20.985   6.688 -15.043
   85   1HD2  LEU   9          HD21      LEU   9  23.581   4.532 -13.321
   86   2HD2  LEU   9          HD22      LEU   9  24.937   5.460 -13.968
   87   3HD2  LEU   9          HD23      LEU   9  23.824   6.225 -12.835
   88    H    CYS  10           H        CYS  10  23.278   6.692 -18.957
   89    HA   CYS  10           HA       CYS  10  24.413   4.427 -20.540
   90   1HB   CYS  10          HB2       CYS  10  22.694   6.730 -21.573
   91   2HB   CYS  10          HB3       CYS  10  23.733   5.775 -22.631
   92    HG   CYS  10           HG       CYS  10  21.929   4.127 -20.520
   93    H    THR  11           H        THR  11  25.936   5.278 -22.258
   94    HA   THR  11           HA       THR  11  27.904   7.030 -21.204
   95    HB   THR  11           HB       THR  11  28.697   6.862 -23.689
   96    HG1  THR  11           HG1      THR  11  27.792   4.957 -24.640
   97   1HG2  THR  11          HG21      THR  11  28.275   4.289 -22.091
   98   2HG2  THR  11          HG22      THR  11  29.541   4.622 -23.292
   99   3HG2  THR  11          HG23      THR  11  29.531   5.499 -21.749
  100    H    GLY  12           H        GLY  12  24.928   7.658 -22.983
  101   1HA   GLY  12          HA1       GLY  12  25.201  10.465 -22.326
  102   2HA   GLY  12          HA2       GLY  12  25.076  10.135 -24.066
  103    H    ASN  13           H        ASN  13  23.159  11.196 -21.799
  104    HA   ASN  13           HA       ASN  13  21.033   9.216 -21.680
  105   1HB   ASN  13          HB2       ASN  13  21.582  10.804 -19.816
  106   2HB   ASN  13          HB3       ASN  13  21.027  12.134 -20.828
  107   1HD2  ASN  13          HD22      ASN  13  19.441   8.811 -20.343
  108   2HD2  ASN  13          HD21      ASN  13  17.978   9.531 -19.696
  109    H    SER  14           H        SER  14  21.237   9.400 -24.308
  110    HA   SER  14           HA       SER  14  19.167  11.394 -25.175
  111   1HB   SER  14          HB2       SER  14  21.735  10.594 -26.565
  112   2HB   SER  14          HB3       SER  14  20.481  11.644 -27.253
  113    HG   SER  14           HG       SER  14  20.822  13.131 -25.711
  114    H    CYS  15           H        CYS  15  19.991   8.025 -25.235
  115    HA   CYS  15           HA       CYS  15  17.881   7.587 -27.299
  116   1HB   CYS  15          HB2       CYS  15  20.594   6.191 -27.297
  117   2HB   CYS  15          HB3       CYS  15  19.294   6.007 -28.478
  118    HG   CYS  15           HG       CYS  15  21.538   7.280 -29.221
  119    H    ARG  16           H        ARG  16  20.088   5.235 -25.788
  120    HA   ARG  16           HA       ARG  16  18.053   3.340 -25.409
  121   1HB   ARG  16          HB2       ARG  16  20.749   3.730 -24.087
  122   2HB   ARG  16          HB3       ARG  16  19.789   2.293 -23.810
  123   1HG   ARG  16          HG2       ARG  16  20.089   1.471 -25.969
  124   2HG   ARG  16          HG3       ARG  16  20.543   3.044 -26.640
  125   1HD   ARG  16          HD2       ARG  16  22.203   1.556 -24.556
  126   2HD   ARG  16          HD3       ARG  16  22.490   1.448 -26.298
  127    HE   ARG  16           HE       ARG  16  22.526   4.115 -26.027
  128   1HH1  ARG  16          HH21      ARG  16  24.211   1.748 -23.975
  129   2HH1  ARG  16          HH22      ARG  16  25.698   2.674 -24.018
  130   1HH2  ARG  16          HH11      ARG  16  24.194   5.379 -25.771
  131   2HH2  ARG  16          HH12      ARG  16  25.579   4.974 -24.768
  132    H    SER  17           H        SER  17  19.588   5.399 -22.817
  133    HA   SER  17           HA       SER  17  17.902   4.313 -20.787
  134   1HB   SER  17          HB2       SER  17  18.784   6.300 -19.485
  135   2HB   SER  17          HB3       SER  17  19.958   5.190 -20.133
  136    HG   SER  17           HG       SER  17  20.807   6.941 -20.921
  137    H    GLN  18           H        GLN  18  17.521   7.093 -22.940
  138    HA   GLN  18           HA       GLN  18  15.264   8.284 -21.653
  139   1HB   GLN  18          HB2       GLN  18  16.487   8.357 -24.433
  140   2HB   GLN  18          HB3       GLN  18  14.939   9.118 -24.149
  141   1HG   GLN  18          HG2       GLN  18  17.418   9.734 -22.477
  142   2HG   GLN  18          HG3       GLN  18  16.993  10.624 -23.937
  143   1HE2  GLN  18          HE22      GLN  18  17.077  11.607 -21.007
  144   2HE2  GLN  18          HE21      GLN  18  15.454  12.266 -20.813
  145    H    MET  19           H        MET  19  15.433   6.098 -24.489
  146    HA   MET  19           HA       MET  19  12.661   5.590 -24.688
  147   1HB   MET  19          HB2       MET  19  14.997   3.769 -25.426
  148   2HB   MET  19          HB3       MET  19  13.313   3.512 -25.890
  149   1HG   MET  19          HG2       MET  19  13.434   5.913 -26.893
  150   2HG   MET  19          HG3       MET  19  15.182   5.715 -26.799
  151   1HE   MET  19          HE1       MET  19  15.527   2.553 -27.533
  152   2HE   MET  19          HE2       MET  19  15.808   2.718 -29.277
  153   3HE   MET  19          HE3       MET  19  16.558   3.870 -28.145
  154    H    ALA  20           H        ALA  20  15.122   3.820 -22.713
  155    HA   ALA  20           HA       ALA  20  13.370   1.785 -21.810
  156   1HB   ALA  20          HB1       ALA  20  15.771   3.021 -20.379
  157   2HB   ALA  20          HB2       ALA  20  15.017   1.461 -20.000
  158   3HB   ALA  20          HB3       ALA  20  15.832   1.690 -21.561
  159    H    GLU  21           H        GLU  21  14.119   4.971 -20.316
  160    HA   GLU  21           HA       GLU  21  12.377   4.706 -18.116
  161   1HB   GLU  21          HB2       GLU  21  14.009   6.520 -18.401
  162   2HB   GLU  21          HB3       GLU  21  13.024   7.217 -19.689
  163   1HG   GLU  21          HG2       GLU  21  11.148   7.440 -17.956
  164   2HG   GLU  21          HG3       GLU  21  12.331   6.967 -16.743
  165    H    GLY  22           H        GLY  22  11.595   5.706 -21.494
  166   1HA   GLY  22          HA1       GLY  22   8.869   6.379 -21.106
  167   2HA   GLY  22          HA2       GLY  22   9.617   5.775 -22.614
  168    H    TRP  23           H        TRP  23  10.332   3.221 -22.076
  169    HA   TRP  23           HA       TRP  23   7.823   1.825 -22.139
  170   1HB   TRP  23          HB2       TRP  23  10.701   0.900 -21.787
  171   2HB   TRP  23          HB3       TRP  23   9.339  -0.211 -21.824
  172    HD1  TRP  23           HD1      TRP  23  11.662   1.540 -24.107
  173    HE1  TRP  23           HE1      TRP  23  11.019   1.156 -26.527
  174    HE3  TRP  23           HE3      TRP  23   6.963  -0.342 -23.384
  175    HZ2  TRP  23           HZ2      TRP  23   8.747   0.022 -28.011
  176    HZ3  TRP  23           HZ3      TRP  23   5.628  -1.160 -25.297
  177    HH2  TRP  23           HH2      TRP  23   6.525  -1.021 -27.604
  178    H    ALA  24           H        ALA  24  10.265   2.268 -19.553
  179    HA   ALA  24           HA       ALA  24   9.092   0.464 -17.734
  180   1HB   ALA  24          HB1       ALA  24  10.506   1.661 -16.054
  181   2HB   ALA  24          HB2       ALA  24  11.397   1.281 -17.532
  182   3HB   ALA  24          HB3       ALA  24  10.812   2.921 -17.277
  183    H    LYS  25           H        LYS  25   8.540   4.011 -18.129
  184    HA   LYS  25           HA       LYS  25   6.698   4.349 -16.032
  185   1HB   LYS  25          HB2       LYS  25   6.866   5.576 -18.806
  186   2HB   LYS  25          HB3       LYS  25   5.606   6.055 -17.662
  187   1HG   LYS  25          HG2       LYS  25   7.197   6.839 -16.051
  188   2HG   LYS  25          HG3       LYS  25   8.559   6.148 -16.950
  189   1HD   LYS  25          HD2       LYS  25   8.164   7.668 -18.824
  190   2HD   LYS  25          HD3       LYS  25   6.762   8.390 -17.989
  191   1HE   LYS  25          HE2       LYS  25   8.148   9.282 -16.232
  192   2HE   LYS  25          HE3       LYS  25   9.508   8.255 -16.706
  193   1HZ   LYS  25          HZ1       LYS  25   9.580   9.508 -18.810
  194   2HZ   LYS  25          HZ2       LYS  25   8.552  10.635 -18.182
  195   3HZ   LYS  25          HZ3       LYS  25  10.052  10.295 -17.497
  196    H    GLN  26           H        GLN  26   6.134   2.863 -19.213
  197    HA   GLN  26           HA       GLN  26   3.290   2.700 -18.796
  198   1HB   GLN  26          HB2       GLN  26   4.787   0.853 -20.674
  199   2HB   GLN  26          HB3       GLN  26   3.113   1.381 -20.732
  200   1HG   GLN  26          HG2       GLN  26   5.614   2.850 -21.501
  201   2HG   GLN  26          HG3       GLN  26   4.184   2.521 -22.460
  202   1HE2  GLN  26          HE22      GLN  26   5.830   4.982 -20.999
  203   2HE2  GLN  26          HE21      GLN  26   4.506   6.107 -20.727
  204    H    TYR  27           H        TYR  27   5.778   0.110 -18.812
  205    HA   TYR  27           HA       TYR  27   3.904  -1.851 -17.937
  206   1HB   TYR  27          HB2       TYR  27   6.942  -1.914 -17.851
  207   2HB   TYR  27          HB3       TYR  27   5.896  -3.299 -17.581
  208    HD1  TYR  27           HD1      TYR  27   4.076  -3.767 -19.494
  209    HD2  TYR  27           HD2      TYR  27   7.762  -1.608 -20.027
  210    HE1  TYR  27           HE1      TYR  27   4.026  -4.298 -21.909
  211    HE2  TYR  27           HE2      TYR  27   7.814  -2.272 -22.414
  212    HH   TYR  27           HH       TYR  27   5.136  -4.117 -23.954
  213    H    LEU  28           H        LEU  28   6.249   0.111 -16.092
  214    HA   LEU  28           HA       LEU  28   5.699  -1.285 -13.592
  215   1HB   LEU  28          HB2       LEU  28   7.105   1.369 -14.072
  216   2HB   LEU  28          HB3       LEU  28   7.133   0.431 -12.614
  217    HG   LEU  28           HG       LEU  28   8.334  -0.463 -15.258
  218   1HD1  LEU  28          HD11      LEU  28   9.514   1.392 -14.053
  219   2HD1  LEU  28          HD12      LEU  28   9.720   0.304 -12.665
  220   3HD1  LEU  28          HD13      LEU  28  10.473  -0.094 -14.223
  221   1HD2  LEU  28          HD21      LEU  28   7.552  -2.430 -13.972
  222   2HD2  LEU  28          HD22      LEU  28   9.305  -2.342 -14.009
  223   3HD2  LEU  28          HD23      LEU  28   8.431  -1.848 -12.546
  224    H    GLY  29           H        GLY  29   3.777   0.808 -15.344
  225   1HA   GLY  29          HA1       GLY  29   1.857   1.889 -14.877
  226   2HA   GLY  29          HA2       GLY  29   1.780   0.875 -13.424
  227    H    ASP  30           H        ASP  30   4.364   3.173 -13.887
  228    HA   ASP  30           HA       ASP  30   5.196   4.829 -12.660
  229   1HB   ASP  30          HB2       ASP  30   3.379   5.995 -13.836
  230   2HB   ASP  30          HB3       ASP  30   2.334   5.785 -12.430
  231    H    GLU  31           H        GLU  31   3.971   2.337 -11.201
  232    HA   GLU  31           HA       GLU  31   3.769   3.202  -8.445
  233   1HB   GLU  31          HB2       GLU  31   4.289   0.466  -9.658
  234   2HB   GLU  31          HB3       GLU  31   3.978   0.770  -7.955
  235   1HG   GLU  31          HG2       GLU  31   2.040   1.486 -10.182
  236   2HG   GLU  31          HG3       GLU  31   2.024  -0.046  -9.317
  237    H    TRP  32           H        TRP  32   6.238   3.337 -10.573
  238    HA   TRP  32           HA       TRP  32   8.393   3.089  -8.584
  239   1HB   TRP  32          HB2       TRP  32   8.518   2.205 -11.502
  240   2HB   TRP  32          HB3       TRP  32   9.845   2.190 -10.361
  241    HD1  TRP  32           HD1      TRP  32   6.318   0.535 -10.428
  242    HE1  TRP  32           HE1      TRP  32   6.522  -1.930  -9.868
  243    HE3  TRP  32           HE3      TRP  32  11.394   0.286  -9.773
  244    HZ2  TRP  32           HZ2      TRP  32   8.618  -3.834  -9.460
  245    HZ3  TRP  32           HZ3      TRP  32  12.478  -1.907  -9.386
  246    HH2  TRP  32           HH2      TRP  32  11.104  -3.992  -9.292
  247    H    LYS  33           H        LYS  33   9.261   5.144  -8.478
  248    HA   LYS  33           HA       LYS  33   8.707   7.219 -10.392
  249   1HB   LYS  33          HB2       LYS  33  10.733   6.955  -8.118
  250   2HB   LYS  33          HB3       LYS  33  10.533   8.418  -9.083
  251   1HG   LYS  33          HG2       LYS  33   8.534   7.179  -7.173
  252   2HG   LYS  33          HG3       LYS  33   9.431   8.663  -6.952
  253   1HD   LYS  33          HD2       LYS  33   7.200   8.161  -8.960
  254   2HD   LYS  33          HD3       LYS  33   7.111   9.153  -7.520
  255   1HE   LYS  33          HE2       LYS  33   8.843   9.739  -9.972
  256   2HE   LYS  33          HE3       LYS  33   7.291  10.484  -9.597
  257   1HZ   LYS  33          HZ1       LYS  33   9.786  10.809  -8.033
  258   2HZ   LYS  33          HZ2       LYS  33   9.019  11.937  -8.914
  259   3HZ   LYS  33          HZ3       LYS  33   8.321  11.381  -7.555
  260    H    VAL  34           H        VAL  34   9.380   6.661 -12.434
  261    HA   VAL  34           HA       VAL  34  11.910   5.376 -12.870
  262    HB   VAL  34           HB       VAL  34  10.212   6.597 -15.055
  263   1HG1  VAL  34          HG11      VAL  34  12.425   5.244 -15.376
  264   2HG1  VAL  34          HG12      VAL  34  11.447   3.833 -14.945
  265   3HG1  VAL  34          HG13      VAL  34  11.001   4.838 -16.347
  266   1HG2  VAL  34          HG21      VAL  34   8.446   5.531 -13.798
  267   2HG2  VAL  34          HG22      VAL  34   8.856   4.467 -15.140
  268   3HG2  VAL  34          HG23      VAL  34   9.442   4.082 -13.512
  269    H    TYR  35           H        TYR  35  13.783   6.329 -13.625
  270    HA   TYR  35           HA       TYR  35  13.786   9.131 -14.613
  271   1HB   TYR  35          HB2       TYR  35  15.580   7.984 -12.426
  272   2HB   TYR  35          HB3       TYR  35  15.858   9.518 -13.229
  273    HD1  TYR  35           HD1      TYR  35  14.038   7.817 -10.580
  274    HD2  TYR  35           HD2      TYR  35  14.248  11.436 -12.924
  275    HE1  TYR  35           HE1      TYR  35  12.720   9.018  -8.856
  276    HE2  TYR  35           HE2      TYR  35  12.895  12.625 -11.228
  277    HH   TYR  35           HH       TYR  35  11.811  12.474  -9.172
  278    H    SER  36           H        SER  36  15.910   9.608 -15.728
  279    HA   SER  36           HA       SER  36  17.660   7.337 -16.191
  280   1HB   SER  36          HB2       SER  36  17.706   7.661 -18.606
  281   2HB   SER  36          HB3       SER  36  16.120   7.106 -18.069
  282    HG   SER  36           HG       SER  36  15.321   9.145 -18.356
  283    H    ALA  37           H        ALA  37  19.729   8.018 -17.113
  284    HA   ALA  37           HA       ALA  37  20.382  10.824 -17.354
  285   1HB   ALA  37          HB1       ALA  37  21.943  10.919 -15.456
  286   2HB   ALA  37          HB2       ALA  37  20.307  10.685 -14.889
  287   3HB   ALA  37          HB3       ALA  37  21.428   9.300 -14.920
  288    H    GLY  38           H        GLY  38  23.131  10.725 -17.061
  289   1HA   GLY  38          HA1       GLY  38  24.404   8.327 -17.817
  290   2HA   GLY  38          HA2       GLY  38  24.117   9.302 -19.274
  291    H    ILE  39           H        ILE  39  26.621   8.910 -18.883
  292    HA   ILE  39           HA       ILE  39  28.122  10.653 -17.218
  293    HB   ILE  39           HB       ILE  39  28.517   8.967 -19.646
  294   1HG1  ILE  39          HG12      ILE  39  30.287   9.372 -17.198
  295   2HG1  ILE  39          HG13      ILE  39  28.852   8.362 -17.165
  296   1HG2  ILE  39          HG21      ILE  39  29.609  10.972 -20.487
  297   2HG2  ILE  39          HG22      ILE  39  30.564  11.104 -18.987
  298   3HG2  ILE  39          HG23      ILE  39  30.799   9.740 -20.107
  299   1HD1  ILE  39          HD11      ILE  39  30.802   6.964 -17.531
  300   2HD1  ILE  39          HD12      ILE  39  29.793   6.948 -18.993
  301   3HD1  ILE  39          HD13      ILE  39  31.289   7.914 -18.936
  302    H    GLU  40           H        GLU  40  26.220  11.353 -20.091
  303    HA   GLU  40           HA       GLU  40  26.641  14.154 -19.647
  304   1HB   GLU  40          HB2       GLU  40  27.137  14.751 -21.944
  305   2HB   GLU  40          HB3       GLU  40  28.435  13.798 -21.235
  306   1HG   GLU  40          HG2       GLU  40  27.635  11.781 -22.413
  307   2HG   GLU  40          HG3       GLU  40  26.272  12.677 -23.083
  308    H    ALA  41           H        ALA  41  25.047  15.389 -21.081
  309    HA   ALA  41           HA       ALA  41  22.876  13.822 -22.262
  310   1HB   ALA  41          HB1       ALA  41  21.199  15.280 -21.044
  311   2HB   ALA  41          HB2       ALA  41  22.047  14.135 -19.981
  312   3HB   ALA  41          HB3       ALA  41  22.504  15.854 -19.998
  313    H    HIS  42           H        HIS  42  22.219  14.891 -24.090
  314    HA   HIS  42           HA       HIS  42  22.786  17.806 -24.385
  315   1HB   HIS  42          HB2       HIS  42  23.240  15.578 -26.416
  316   2HB   HIS  42          HB3       HIS  42  23.150  17.278 -26.849
  317    HD1  HIS  42           HD1      HIS  42  25.074  17.326 -23.746
  318    HD2  HIS  42           HD2      HIS  42  25.727  16.364 -27.793
  319    HE1  HIS  42           HE1      HIS  42  27.587  17.520 -24.133
  320    H    GLY  43           H        GLY  43  20.422  15.797 -23.717
  321   1HA   GLY  43          HA1       GLY  43  18.092  16.268 -23.975
  322   2HA   GLY  43          HA2       GLY  43  18.401  17.019 -25.544
  323    H    LEU  44           H        LEU  44  16.503  15.032 -25.313
  324    HA   LEU  44           HA       LEU  44  17.639  12.465 -26.010
  325   1HB   LEU  44          HB2       LEU  44  15.455  11.640 -26.154
  326   2HB   LEU  44          HB3       LEU  44  15.554  12.659 -24.725
  327    HG   LEU  44           HG       LEU  44  14.191  13.343 -27.374
  328   1HD1  LEU  44          HD11      LEU  44  12.147  13.145 -25.961
  329   2HD1  LEU  44          HD12      LEU  44  13.099  11.646 -25.987
  330   3HD1  LEU  44          HD13      LEU  44  13.159  12.707 -24.571
  331   1HD2  LEU  44          HD21      LEU  44  14.920  15.479 -26.412
  332   2HD2  LEU  44          HD22      LEU  44  13.198  15.285 -26.120
  333   3HD2  LEU  44          HD23      LEU  44  14.337  14.984 -24.794
  334    H    ASN  45           H        ASN  45  17.519  11.409 -27.981
  335    HA   ASN  45           HA       ASN  45  18.079  13.070 -30.268
  336   1HB   ASN  45          HB2       ASN  45  19.109  10.850 -29.690
  337   2HB   ASN  45          HB3       ASN  45  17.580  10.065 -30.061
  338   1HD2  ASN  45          HD22      ASN  45  20.479  10.256 -31.304
  339   2HD2  ASN  45          HD21      ASN  45  20.136  10.431 -33.012
  340    HA   PRO  46           HA       PRO  46  13.767  13.458 -31.665
  341   1HB   PRO  46          HB2       PRO  46  15.113  13.419 -34.376
  342   2HB   PRO  46          HB3       PRO  46  13.781  14.469 -33.797
  343   1HG   PRO  46          HG2       PRO  46  16.319  15.413 -33.870
  344   2HG   PRO  46          HG3       PRO  46  15.283  15.750 -32.445
  345   1HD   PRO  46          HD2       PRO  46  17.460  13.676 -32.740
  346   2HD   PRO  46          HD3       PRO  46  17.085  14.741 -31.351
  347    H    ASN  47           H        ASN  47  16.010  11.028 -33.076
  348    HA   ASN  47           HA       ASN  47  13.866   9.437 -34.242
  349   1HB   ASN  47          HB2       ASN  47  16.797   8.886 -33.691
  350   2HB   ASN  47          HB3       ASN  47  15.704   7.645 -34.287
  351   1HD2  ASN  47          HD22      ASN  47  18.093   8.823 -35.630
  352   2HD2  ASN  47          HD21      ASN  47  17.488   9.398 -37.160
  353    H    ALA  48           H        ALA  48  15.345   9.692 -31.046
  354    HA   ALA  48           HA       ALA  48  14.382   7.176 -30.046
  355   1HB   ALA  48          HB1       ALA  48  14.885   8.039 -27.867
  356   2HB   ALA  48          HB2       ALA  48  16.167   8.662 -28.925
  357   3HB   ALA  48          HB3       ALA  48  14.843   9.718 -28.415
  358    H    VAL  49           H        VAL  49  13.125  10.569 -30.117
  359    HA   VAL  49           HA       VAL  49  10.640   9.961 -28.899
  360    HB   VAL  49           HB       VAL  49  11.103  12.131 -30.994
  361   1HG1  VAL  49          HG11      VAL  49   9.262  13.284 -29.776
  362   2HG1  VAL  49          HG12      VAL  49   8.708  11.755 -30.467
  363   3HG1  VAL  49          HG13      VAL  49   9.066  11.864 -28.729
  364   1HG2  VAL  49          HG21      VAL  49  11.534  13.628 -29.052
  365   2HG2  VAL  49          HG22      VAL  49  11.505  12.216 -27.980
  366   3HG2  VAL  49          HG23      VAL  49  12.781  12.389 -29.208
  367    H    LYS  50           H        LYS  50  11.517  10.043 -32.441
  368    HA   LYS  50           HA       LYS  50   8.976   9.202 -33.342
  369   1HB   LYS  50          HB2       LYS  50  11.748   8.678 -34.514
  370   2HB   LYS  50          HB3       LYS  50  10.271   8.243 -35.343
  371   1HG   LYS  50          HG2       LYS  50  11.086  11.074 -34.560
  372   2HG   LYS  50          HG3       LYS  50  11.198  10.373 -36.164
  373   1HD   LYS  50          HD2       LYS  50   8.658  11.002 -34.605
  374   2HD   LYS  50          HD3       LYS  50   9.258  11.845 -36.016
  375   1HE   LYS  50          HE2       LYS  50   8.309   8.936 -35.990
  376   2HE   LYS  50          HE3       LYS  50   7.337  10.319 -36.482
  377   1HZ   LYS  50          HZ1       LYS  50   8.290   9.239 -38.393
  378   2HZ   LYS  50          HZ2       LYS  50   8.911  10.735 -38.275
  379   3HZ   LYS  50          HZ3       LYS  50   9.814   9.437 -37.851
  380    H    ALA  51           H        ALA  51  11.697   7.153 -32.207
  381    HA   ALA  51           HA       ALA  51  10.469   4.698 -32.929
  382   1HB   ALA  51          HB1       ALA  51  12.398   5.301 -30.630
  383   2HB   ALA  51          HB2       ALA  51  12.082   3.709 -31.350
  384   3HB   ALA  51          HB3       ALA  51  12.874   4.970 -32.305
  385    H    MET  52           H        MET  52  10.314   6.609 -29.856
  386    HA   MET  52           HA       MET  52   8.586   4.689 -28.571
  387   1HB   MET  52          HB2       MET  52   9.056   7.642 -27.975
  388   2HB   MET  52          HB3       MET  52   8.176   6.526 -26.937
  389   1HG   MET  52          HG2       MET  52  11.121   6.507 -27.618
  390   2HG   MET  52          HG3       MET  52  10.360   6.696 -26.050
  391   1HE   MET  52          HE1       MET  52   9.116   3.085 -25.254
  392   2HE   MET  52          HE2       MET  52   8.954   4.817 -24.943
  393   3HE   MET  52          HE3       MET  52   8.196   4.082 -26.391
  394    H    LYS  53           H        LYS  53   7.950   7.599 -30.542
  395    HA   LYS  53           HA       LYS  53   5.130   7.558 -30.156
  396   1HB   LYS  53          HB2       LYS  53   6.916   8.630 -32.348
  397   2HB   LYS  53          HB3       LYS  53   5.177   8.920 -32.323
  398   1HG   LYS  53          HG2       LYS  53   6.840   9.592 -29.867
  399   2HG   LYS  53          HG3       LYS  53   6.834  10.695 -31.252
  400   1HD   LYS  53          HD2       LYS  53   4.645  11.314 -30.952
  401   2HD   LYS  53          HD3       LYS  53   4.183   9.770 -30.207
  402   1HE   LYS  53          HE2       LYS  53   4.049  11.316 -28.451
  403   2HE   LYS  53          HE3       LYS  53   5.538  10.412 -28.184
  404   1HZ   LYS  53          HZ1       LYS  53   6.703  12.353 -29.250
  405   2HZ   LYS  53          HZ2       LYS  53   5.283  13.172 -29.232
  406   3HZ   LYS  53          HZ3       LYS  53   5.985  12.694 -27.826
  407    H    GLU  54           H        GLU  54   7.239   5.548 -32.169
  408    HA   GLU  54           HA       GLU  54   5.177   4.695 -33.940
  409   1HB   GLU  54          HB2       GLU  54   7.652   4.475 -34.378
  410   2HB   GLU  54          HB3       GLU  54   7.682   3.136 -33.229
  411   1HG   GLU  54          HG2       GLU  54   6.027   1.903 -34.595
  412   2HG   GLU  54          HG3       GLU  54   5.863   3.282 -35.683
  413    H    VAL  55           H        VAL  55   5.870   3.995 -30.591
  414    HA   VAL  55           HA       VAL  55   3.960   1.689 -30.675
  415    HB   VAL  55           HB       VAL  55   4.996   0.984 -28.553
  416   1HG1  VAL  55          HG11      VAL  55   7.049   0.106 -29.603
  417   2HG1  VAL  55          HG12      VAL  55   5.690   0.044 -30.728
  418   3HG1  VAL  55          HG13      VAL  55   6.925   1.304 -30.900
  419   1HG2  VAL  55          HG21      VAL  55   7.147   3.066 -29.120
  420   2HG2  VAL  55          HG22      VAL  55   5.890   3.252 -27.868
  421   3HG2  VAL  55          HG23      VAL  55   7.066   1.952 -27.756
  422    H    GLY  56           H        GLY  56   4.003   4.961 -29.961
  423   1HA   GLY  56          HA1       GLY  56   2.094   6.142 -29.359
  424   2HA   GLY  56          HA2       GLY  56   1.360   4.674 -28.687
  425    H    ILE  57           H        ILE  57   4.659   5.902 -27.983
  426    HA   ILE  57           HA       ILE  57   3.850   6.564 -25.197
  427    HB   ILE  57           HB       ILE  57   6.324   5.150 -26.256
  428   1HG1  ILE  57          HG12      ILE  57   4.297   4.279 -24.154
  429   2HG1  ILE  57          HG13      ILE  57   4.280   3.748 -25.830
  430   1HG2  ILE  57          HG21      ILE  57   7.156   6.735 -24.625
  431   2HG2  ILE  57          HG22      ILE  57   5.841   6.346 -23.492
  432   3HG2  ILE  57          HG23      ILE  57   7.120   5.176 -23.824
  433   1HD1  ILE  57          HD11      ILE  57   6.526   2.710 -25.538
  434   2HD1  ILE  57          HD12      ILE  57   6.448   3.094 -23.807
  435   3HD1  ILE  57          HD13      ILE  57   5.259   2.005 -24.534
  436    H    ASP  58           H        ASP  58   5.271   8.249 -24.335
  437    HA   ASP  58           HA       ASP  58   6.555   9.978 -26.372
  438   1HB   ASP  58          HB2       ASP  58   4.453  11.108 -25.835
  439   2HB   ASP  58          HB3       ASP  58   4.756  10.910 -24.094
  440    H    ILE  59           H        ILE  59   8.437  10.835 -25.718
  441    HA   ILE  59           HA       ILE  59   9.278  10.575 -22.903
  442    HB   ILE  59           HB       ILE  59  11.618  10.057 -23.717
  443   1HG1  ILE  59          HG12      ILE  59  10.247   9.098 -26.269
  444   2HG1  ILE  59          HG13      ILE  59  11.105  10.625 -26.166
  445   1HG2  ILE  59          HG21      ILE  59  11.198   7.659 -23.736
  446   2HG2  ILE  59          HG22      ILE  59  10.060   8.424 -22.633
  447   3HG2  ILE  59          HG23      ILE  59   9.510   7.909 -24.233
  448   1HD1  ILE  59          HD11      ILE  59  13.184   9.410 -25.503
  449   2HD1  ILE  59          HD12      ILE  59  12.331   7.867 -25.687
  450   3HD1  ILE  59          HD13      ILE  59  12.573   8.918 -27.086
  451    H    SER  60           H        SER  60   8.383  12.684 -25.231
  452    HA   SER  60           HA       SER  60  10.447  14.670 -25.110
  453   1HB   SER  60          HB2       SER  60   7.496  15.288 -25.341
  454   2HB   SER  60          HB3       SER  60   8.876  16.143 -26.055
  455    HG   SER  60           HG       SER  60   7.667  13.694 -26.736
  456    H    ASN  61           H        ASN  61   7.856  13.682 -22.961
  457    HA   ASN  61           HA       ASN  61   7.846  15.799 -21.101
  458   1HB   ASN  61          HB2       ASN  61   6.727  14.229 -19.613
  459   2HB   ASN  61          HB3       ASN  61   6.117  14.030 -21.245
  460   1HD2  ASN  61          HD22      ASN  61   6.638  12.115 -22.420
  461   2HD2  ASN  61          HD21      ASN  61   7.245  10.676 -21.636
  462    H    GLN  62           H        GLN  62  10.614  13.864 -21.667
  463    HA   GLN  62           HA       GLN  62  11.533  14.228 -18.865
  464   1HB   GLN  62          HB2       GLN  62  12.455  11.862 -18.973
  465   2HB   GLN  62          HB3       GLN  62  10.700  11.996 -18.839
  466   1HG   GLN  62          HG2       GLN  62  10.363  11.495 -21.148
  467   2HG   GLN  62          HG3       GLN  62  12.083  11.721 -21.511
  468   1HE2  GLN  62          HE22      GLN  62  13.336  10.030 -21.638
  469   2HE2  GLN  62          HE21      GLN  62  12.847   8.377 -21.245
  470    H    THR  63           H        THR  63  12.257  16.020 -20.637
  471    HA   THR  63           HA       THR  63  14.411  15.592 -22.316
  472    HB   THR  63           HB       THR  63  14.944  18.055 -21.636
  473    HG1  THR  63           HG1      THR  63  13.912  18.030 -19.601
  474   1HG2  THR  63          HG21      THR  63  13.573  17.412 -23.606
  475   2HG2  THR  63          HG22      THR  63  12.135  17.307 -22.568
  476   3HG2  THR  63          HG23      THR  63  12.940  18.871 -22.826
  477    H    SER  64           H        SER  64  16.511  15.162 -22.122
  478    HA   SER  64           HA       SER  64  17.421  13.759 -20.062
  479   1HB   SER  64          HB2       SER  64  19.120  15.307 -22.045
  480   2HB   SER  64          HB3       SER  64  19.482  13.730 -21.330
  481    HG   SER  64           HG       SER  64  18.490  12.925 -22.941
  482    H    ASP  65           H        ASP  65  19.226  13.873 -18.702
  483    HA   ASP  65           HA       ASP  65  20.521  16.399 -18.095
  484   1HB   ASP  65          HB2       ASP  65  18.437  16.453 -16.659
  485   2HB   ASP  65          HB3       ASP  65  18.979  14.956 -15.894
  486    H    ILE  66           H        ILE  66  22.353  16.014 -16.629
  487    HA   ILE  66           HA       ILE  66  23.625  13.395 -16.994
  488    HB   ILE  66           HB       ILE  66  25.318  14.645 -15.351
  489   1HG1  ILE  66          HG12      ILE  66  23.786  16.731 -15.202
  490   2HG1  ILE  66          HG13      ILE  66  25.516  16.907 -15.402
  491   1HG2  ILE  66          HG21      ILE  66  26.542  15.373 -17.356
  492   2HG2  ILE  66          HG22      ILE  66  25.855  13.749 -17.487
  493   3HG2  ILE  66          HG23      ILE  66  25.062  15.106 -18.322
  494   1HD1  ILE  66          HD11      ILE  66  25.301  17.458 -17.770
  495   2HD1  ILE  66          HD12      ILE  66  23.555  17.174 -17.725
  496   3HD1  ILE  66          HD13      ILE  66  24.261  18.511 -16.800
  497    H    ILE  67           H        ILE  67  24.571  12.369 -15.050
  498    HA   ILE  67           HA       ILE  67  22.571  11.444 -13.310
  499    HB   ILE  67           HB       ILE  67  25.609  11.324 -13.240
  500   1HG1  ILE  67          HG12      ILE  67  23.552   9.133 -13.806
  501   2HG1  ILE  67          HG13      ILE  67  24.234  10.145 -15.070
  502   1HG2  ILE  67          HG21      ILE  67  25.438   9.526 -11.564
  503   2HG2  ILE  67          HG22      ILE  67  24.829  11.034 -10.905
  504   3HG2  ILE  67          HG23      ILE  67  23.683   9.787 -11.445
  505   1HD1  ILE  67          HD11      ILE  67  25.426   8.103 -15.062
  506   2HD1  ILE  67          HD12      ILE  67  26.525   9.358 -14.462
  507   3HD1  ILE  67          HD13      ILE  67  25.778   8.198 -13.332
  508    H    ASP  68           H        ASP  68  21.901  11.975 -11.354
  509    HA   ASP  68           HA       ASP  68  23.292  14.075  -9.769
  510   1HB   ASP  68          HB2       ASP  68  21.159  14.862 -10.933
  511   2HB   ASP  68          HB3       ASP  68  20.282  13.708  -9.917
  512    H    SER  69           H        SER  69  23.543  13.604  -7.640
  513    HA   SER  69           HA       SER  69  23.488  11.014  -6.675
  514   1HB   SER  69          HB2       SER  69  23.424  13.560  -5.034
  515   2HB   SER  69          HB3       SER  69  24.148  12.004  -4.589
  516    HG   SER  69           HG       SER  69  25.705  13.519  -5.352
  517    H    ASP  70           H        ASP  70  20.879  13.359  -6.701
  518    HA   ASP  70           HA       ASP  70  19.470  12.419  -4.389
  519   1HB   ASP  70          HB2       ASP  70  19.229  14.687  -5.355
  520   2HB   ASP  70          HB3       ASP  70  18.472  13.987  -6.793
  521    H    ILE  71           H        ILE  71  19.850  11.082  -7.499
  522    HA   ILE  71           HA       ILE  71  17.472   9.322  -7.146
  523    HB   ILE  71           HB       ILE  71  18.991   9.960  -9.681
  524   1HG1  ILE  71          HG12      ILE  71  16.112  10.812  -9.305
  525   2HG1  ILE  71          HG13      ILE  71  17.361  11.842  -8.623
  526   1HG2  ILE  71          HG21      ILE  71  17.114   8.744 -10.767
  527   2HG2  ILE  71          HG22      ILE  71  17.977   7.723  -9.613
  528   3HG2  ILE  71          HG23      ILE  71  16.404   8.410  -9.171
  529   1HD1  ILE  71          HD11      ILE  71  16.794  12.572 -10.876
  530   2HD1  ILE  71          HD12      ILE  71  18.490  12.060 -10.757
  531   3HD1  ILE  71          HD13      ILE  71  17.285  10.996 -11.535
  532    H    LEU  72           H        LEU  72  20.982   9.494  -8.000
  533    HA   LEU  72           HA       LEU  72  21.607   6.795  -8.202
  534   1HB   LEU  72          HB2       LEU  72  23.142   8.957  -6.702
  535   2HB   LEU  72          HB3       LEU  72  23.765   7.342  -6.896
  536    HG   LEU  72           HG       LEU  72  23.170   9.204  -9.201
  537   1HD1  LEU  72          HD11      LEU  72  25.715   9.304  -9.280
  538   2HD1  LEU  72          HD12      LEU  72  24.997  10.066  -7.859
  539   3HD1  LEU  72          HD13      LEU  72  25.740   8.463  -7.723
  540   1HD2  LEU  72          HD21      LEU  72  24.513   7.536 -10.510
  541   2HD2  LEU  72          HD22      LEU  72  24.627   6.512  -9.070
  542   3HD2  LEU  72          HD23      LEU  72  23.065   6.777  -9.846
  543    H    ASN  73           H        ASN  73  21.706   8.583  -5.114
  544    HA   ASN  73           HA       ASN  73  22.028   6.145  -3.631
  545   1HB   ASN  73          HB2       ASN  73  22.579   7.434  -1.845
  546   2HB   ASN  73          HB3       ASN  73  22.878   8.622  -3.101
  547   1HD2  ASN  73          HD22      ASN  73  20.817  10.118  -3.579
  548   2HD2  ASN  73          HD21      ASN  73  19.888  10.568  -2.168
  549    H    ASN  74           H        ASN  74  19.283   7.172  -5.013
  550    HA   ASN  74           HA       ASN  74  17.455   6.619  -2.707
  551   1HB   ASN  74          HB2       ASN  74  17.611   8.949  -3.535
  552   2HB   ASN  74          HB3       ASN  74  17.269   8.387  -5.165
  553   1HD2  ASN  74          HD22      ASN  74  15.693  10.133  -4.966
  554   2HD2  ASN  74          HD21      ASN  74  14.094   9.741  -4.345
  555    H    ALA  75           H        ALA  75  18.202   5.954  -6.102
  556    HA   ALA  75           HA       ALA  75  15.822   4.610  -6.837
  557   1HB   ALA  75          HB1       ALA  75  18.615   4.405  -7.954
  558   2HB   ALA  75          HB2       ALA  75  17.106   3.852  -8.740
  559   3HB   ALA  75          HB3       ALA  75  17.367   5.575  -8.437
  560    H    ASP  76           H        ASP  76  15.085   2.643  -6.437
  561    HA   ASP  76           HA       ASP  76  16.412   0.907  -4.555
  562   1HB   ASP  76          HB2       ASP  76  13.963   1.053  -4.663
  563   2HB   ASP  76          HB3       ASP  76  13.982   0.460  -6.327
  564    H    LEU  77           H        LEU  77  16.335   1.265  -8.019
  565    HA   LEU  77           HA       LEU  77  18.417  -0.787  -8.293
  566   1HB   LEU  77          HB2       LEU  77  16.368  -2.059  -8.836
  567   2HB   LEU  77          HB3       LEU  77  15.845  -0.783  -9.938
  568    HG   LEU  77           HG       LEU  77  17.798  -1.244 -11.416
  569   1HD1  LEU  77          HD11      LEU  77  19.394  -2.196  -9.755
  570   2HD1  LEU  77          HD12      LEU  77  18.326  -3.602  -9.546
  571   3HD1  LEU  77          HD13      LEU  77  19.130  -3.290 -11.103
  572   1HD2  LEU  77          HD21      LEU  77  16.095  -3.676 -10.783
  573   2HD2  LEU  77          HD22      LEU  77  15.659  -2.323 -11.853
  574   3HD2  LEU  77          HD23      LEU  77  16.996  -3.393 -12.290
  575    H    VAL  78           H        VAL  78  19.901  -0.170  -9.797
  576    HA   VAL  78           HA       VAL  78  19.238   2.071 -11.628
  577    HB   VAL  78           HB       VAL  78  21.929   1.494 -10.319
  578   1HG1  VAL  78          HG11      VAL  78  22.233   2.543 -12.501
  579   2HG1  VAL  78          HG12      VAL  78  20.973   3.745 -12.151
  580   3HG1  VAL  78          HG13      VAL  78  22.501   3.771 -11.259
  581   1HG2  VAL  78          HG21      VAL  78  20.442   2.403  -8.609
  582   2HG2  VAL  78          HG22      VAL  78  21.604   3.634  -9.092
  583   3HG2  VAL  78          HG23      VAL  78  19.935   3.703  -9.700
  584    H    VAL  79           H        VAL  79  20.140   1.708 -13.811
  585    HA   VAL  79           HA       VAL  79  21.334  -0.973 -14.262
  586    HB   VAL  79           HB       VAL  79  19.125   0.174 -15.987
  587   1HG1  VAL  79          HG11      VAL  79  20.628  -1.488 -17.056
  588   2HG1  VAL  79          HG12      VAL  79  20.249  -2.648 -15.767
  589   3HG1  VAL  79          HG13      VAL  79  18.983  -2.103 -16.884
  590   1HG2  VAL  79          HG21      VAL  79  17.571  -1.534 -15.035
  591   2HG2  VAL  79          HG22      VAL  79  18.759  -1.858 -13.755
  592   3HG2  VAL  79          HG23      VAL  79  17.987  -0.262 -13.893
  593    H    THR  80           H        THR  80  23.041  -0.842 -15.731
  594    HA   THR  80           HA       THR  80  23.314   1.715 -17.257
  595    HB   THR  80           HB       THR  80  25.753   0.784 -17.518
  596    HG1  THR  80           HG1      THR  80  25.378  -1.155 -16.342
  597   1HG2  THR  80          HG21      THR  80  24.681   2.126 -15.015
  598   2HG2  THR  80          HG22      THR  80  26.395   2.080 -15.507
  599   3HG2  THR  80          HG23      THR  80  25.197   2.893 -16.529
  600    H    LEU  81           H        LEU  81  22.959   1.665 -19.315
  601    HA   LEU  81           HA       LEU  81  22.485  -0.957 -20.611
  602   1HB   LEU  81          HB2       LEU  81  21.708   1.856 -21.415
  603   2HB   LEU  81          HB3       LEU  81  21.323   0.420 -22.332
  604    HG   LEU  81           HG       LEU  81  19.859  -0.407 -20.562
  605   1HD1  LEU  81          HD11      LEU  81  19.111   1.158 -18.735
  606   2HD1  LEU  81          HD12      LEU  81  20.711   0.502 -18.488
  607   3HD1  LEU  81          HD13      LEU  81  20.522   2.176 -19.079
  608   1HD2  LEU  81          HD21      LEU  81  18.074   1.349 -20.738
  609   2HD2  LEU  81          HD22      LEU  81  19.282   2.463 -21.394
  610   3HD2  LEU  81          HD23      LEU  81  18.836   0.981 -22.276
  611    H    CYS  82           H        CYS  82  25.219   0.066 -20.143
  612    HA   CYS  82           HA       CYS  82  26.279   1.292 -22.485
  613   1HB   CYS  82          HB2       CYS  82  28.431   1.038 -21.278
  614   2HB   CYS  82          HB3       CYS  82  27.180   1.908 -20.398
  615    H    GLY  83           H        GLY  83  25.462  -0.536 -24.025
  616   1HA   GLY  83          HA1       GLY  83  27.695  -2.525 -24.352
  617   2HA   GLY  83          HA2       GLY  83  26.054  -2.819 -24.888
  618    H    ASP  84           H        ASP  84  27.073   0.436 -25.181
  619    HA   ASP  84           HA       ASP  84  27.063   0.524 -28.069
  620   1HB   ASP  84          HB2       ASP  84  27.300   2.924 -27.663
  621   2HB   ASP  84          HB3       ASP  84  26.030   2.249 -26.643
  622    H    ALA  85           H        ALA  85  28.800   1.872 -29.115
  623    HA   ALA  85           HA       ALA  85  31.203   0.394 -28.999
  624   1HB   ALA  85          HB1       ALA  85  31.988   1.944 -30.731
  625   2HB   ALA  85          HB2       ALA  85  30.307   1.472 -31.040
  626   3HB   ALA  85          HB3       ALA  85  30.675   3.071 -30.347
  627    H    ALA  86           H        ALA  86  30.324   3.116 -26.977
  628    HA   ALA  86           HA       ALA  86  33.182   3.805 -26.519
  629   1HB   ALA  86          HB1       ALA  86  31.581   5.646 -26.996
  630   2HB   ALA  86          HB2       ALA  86  30.668   5.211 -25.541
  631   3HB   ALA  86          HB3       ALA  86  32.343   5.771 -25.394
  632    H    ASP  87           H        ASP  87  30.245   2.654 -24.920
  633    HA   ASP  87           HA       ASP  87  29.818   1.790 -22.914
  634   1HB   ASP  87          HB2       ASP  87  30.495  -0.397 -22.592
  635   2HB   ASP  87          HB3       ASP  87  30.375  -0.148 -24.303
  636    H    LYS  88           H        LYS  88  31.236   4.009 -22.336
  637    HA   LYS  88           HA       LYS  88  33.341   3.602 -20.482
  638   1HB   LYS  88          HB2       LYS  88  31.373   5.921 -20.589
  639   2HB   LYS  88          HB3       LYS  88  32.936   5.911 -19.778
  640   1HG   LYS  88          HG2       LYS  88  34.098   5.628 -21.945
  641   2HG   LYS  88          HG3       LYS  88  32.551   5.548 -22.787
  642   1HD   LYS  88          HD2       LYS  88  33.426   7.746 -23.103
  643   2HD   LYS  88          HD3       LYS  88  31.991   7.831 -22.095
  644   1HE   LYS  88          HE2       LYS  88  33.611   9.366 -21.206
  645   2HE   LYS  88          HE3       LYS  88  33.443   8.039 -20.058
  646   1HZ   LYS  88          HZ1       LYS  88  35.522   7.116 -20.941
  647   2HZ   LYS  88          HZ2       LYS  88  35.651   8.341 -22.019
  648   3HZ   LYS  88          HZ3       LYS  88  35.757   8.642 -20.426
  649    H    CYS  89           H        CYS  89  30.041   2.879 -20.131
  650    HA   CYS  89           HA       CYS  89  28.619   2.414 -18.450
  651   1HB   CYS  89          HB2       CYS  89  31.112   1.033 -17.489
  652   2HB   CYS  89          HB3       CYS  89  29.497   0.745 -16.855
  653    HA   PRO  90           HA       PRO  90  29.411   6.143 -15.935
  654   1HB   PRO  90          HB2       PRO  90  26.502   5.620 -15.468
  655   2HB   PRO  90          HB3       PRO  90  27.349   7.171 -15.764
  656   1HG   PRO  90          HG2       PRO  90  25.948   5.895 -17.730
  657   2HG   PRO  90          HG3       PRO  90  27.480   6.750 -18.089
  658   1HD   PRO  90          HD2       PRO  90  26.971   3.825 -17.829
  659   2HD   PRO  90          HD3       PRO  90  28.132   4.701 -18.872
  660    H    MET  91           H        MET  91  29.790   6.409 -13.776
  661    HA   MET  91           HA       MET  91  29.908   4.126 -12.096
  662   1HB   MET  91          HB2       MET  91  30.866   5.640 -10.470
  663   2HB   MET  91          HB3       MET  91  31.608   5.881 -12.045
  664   1HG   MET  91          HG2       MET  91  29.447   7.656 -10.841
  665   2HG   MET  91          HG3       MET  91  31.171   7.968 -10.750
  666   1HE   MET  91          HE1       MET  91  28.785   9.944 -11.816
  667   2HE   MET  91          HE2       MET  91  30.474  10.448 -11.572
  668   3HE   MET  91          HE3       MET  91  29.666  10.768 -13.122
  669    H    THR  92           H        THR  92  28.709   3.572 -10.345
  670    HA   THR  92           HA       THR  92  26.513   5.283  -9.365
  671    HB   THR  92           HB       THR  92  25.378   3.069  -8.960
  672    HG1  THR  92           HG1      THR  92  27.010   1.610  -8.997
  673   1HG2  THR  92          HG21      THR  92  26.145   3.441 -11.884
  674   2HG2  THR  92          HG22      THR  92  24.671   2.686 -11.250
  675   3HG2  THR  92          HG23      THR  92  24.930   4.428 -11.045
  676    HA   PRO  93           HA       PRO  93  28.505   4.529  -5.414
  677   1HB   PRO  93          HB2       PRO  93  26.439   4.393  -3.608
  678   2HB   PRO  93          HB3       PRO  93  26.963   5.915  -4.394
  679   1HG   PRO  93          HG2       PRO  93  24.687   4.089  -5.200
  680   2HG   PRO  93          HG3       PRO  93  24.656   5.868  -5.016
  681   1HD   PRO  93          HD2       PRO  93  24.968   4.667  -7.444
  682   2HD   PRO  93          HD3       PRO  93  25.839   6.179  -7.042
  683    HA   PRO  94           HA       PRO  94  28.333   0.055  -5.394
  684   1HB   PRO  94          HB2       PRO  94  29.989  -0.570  -3.303
  685   2HB   PRO  94          HB3       PRO  94  30.575   0.109  -4.852
  686   1HG   PRO  94          HG2       PRO  94  29.983   1.590  -2.275
  687   2HG   PRO  94          HG3       PRO  94  31.440   1.714  -3.313
  688   1HD   PRO  94          HD2       PRO  94  29.365   3.493  -3.475
  689   2HD   PRO  94          HD3       PRO  94  30.286   2.993  -4.929
  690    H    HIS  95           H        HIS  95  27.294   1.974  -2.665
  691    HA   HIS  95           HA       HIS  95  26.141  -0.047  -1.031
  692   1HB   HIS  95          HB2       HIS  95  26.627   2.316  -0.373
  693   2HB   HIS  95          HB3       HIS  95  25.334   2.866  -1.438
  694    HD1  HIS  95           HD1      HIS  95  25.763   0.761   1.806
  695    HD2  HIS  95           HD2      HIS  95  22.906   2.914  -0.419
  696    HE1  HIS  95           HE1      HIS  95  23.670   0.871   3.246
  697    H    VAL  96           H        VAL  96  25.168   1.143  -4.190
  698    HA   VAL  96           HA       VAL  96  22.350   0.297  -3.697
  699    HB   VAL  96           HB       VAL  96  23.475   2.274  -5.693
  700   1HG1  VAL  96          HG11      VAL  96  21.509   1.187  -6.658
  701   2HG1  VAL  96          HG12      VAL  96  20.593   1.435  -5.153
  702   3HG1  VAL  96          HG13      VAL  96  21.090   2.820  -6.144
  703   1HG2  VAL  96          HG21      VAL  96  23.444   3.149  -3.357
  704   2HG2  VAL  96          HG22      VAL  96  22.187   3.917  -4.321
  705   3HG2  VAL  96          HG23      VAL  96  21.755   2.632  -3.179
  706    H    LYS  97           H        LYS  97  21.433  -1.250  -4.946
  707    HA   LYS  97           HA       LYS  97  23.058  -3.104  -6.386
  708   1HB   LYS  97          HB2       LYS  97  21.054  -3.828  -5.220
  709   2HB   LYS  97          HB3       LYS  97  20.051  -2.676  -6.103
  710   1HG   LYS  97          HG2       LYS  97  19.666  -4.932  -6.903
  711   2HG   LYS  97          HG3       LYS  97  20.335  -3.914  -8.173
  712   1HD   LYS  97          HD2       LYS  97  22.596  -4.942  -7.752
  713   2HD   LYS  97          HD3       LYS  97  21.843  -6.040  -6.580
  714   1HE   LYS  97          HE2       LYS  97  20.594  -7.161  -8.245
  715   2HE   LYS  97          HE3       LYS  97  20.652  -5.778  -9.345
  716   1HZ   LYS  97          HZ1       LYS  97  22.931  -7.572  -8.784
  717   2HZ   LYS  97          HZ2       LYS  97  22.059  -7.443 -10.188
  718   3HZ   LYS  97          HZ3       LYS  97  22.979  -6.199  -9.717
  719    H    ARG  98           H        ARG  98  23.578  -3.154  -8.503
  720    HA   ARG  98           HA       ARG  98  22.067  -1.442 -10.376
  721   1HB   ARG  98          HB2       ARG  98  24.583  -0.749  -9.822
  722   2HB   ARG  98          HB3       ARG  98  24.962  -2.080 -10.922
  723   1HG   ARG  98          HG2       ARG  98  23.104  -0.775 -12.434
  724   2HG   ARG  98          HG3       ARG  98  23.638   0.574 -11.451
  725   1HD   ARG  98          HD2       ARG  98  25.344  -1.197 -13.239
  726   2HD   ARG  98          HD3       ARG  98  24.775   0.441 -13.591
  727    HE   ARG  98           HE       ARG  98  26.183   0.745 -11.244
  728   1HH1  ARG  98          HH21      ARG  98  26.901  -0.259 -14.569
  729   2HH1  ARG  98          HH22      ARG  98  28.607   0.042 -14.428
  730   1HH2  ARG  98          HH11      ARG  98  28.297   1.272 -11.091
  731   2HH2  ARG  98          HH12      ARG  98  29.438   1.016 -12.386
  732    H    GLU  99           H        GLU  99  21.996  -2.306 -12.564
  733    HA   GLU  99           HA       GLU  99  22.750  -5.149 -12.970
  734   1HB   GLU  99          HB2       GLU  99  20.096  -3.751 -13.465
  735   2HB   GLU  99          HB3       GLU  99  20.599  -5.032 -14.550
  736   1HG   GLU  99          HG2       GLU  99  20.348  -5.369 -11.536
  737   2HG   GLU  99          HG3       GLU  99  19.092  -5.779 -12.701
  738    H    HIS 100           H        HIS 100  22.800  -5.514 -15.466
  739    HA   HIS 100           HA       HIS 100  23.706  -3.076 -16.885
  740   1HB   HIS 100          HB2       HIS 100  25.715  -4.064 -15.963
  741   2HB   HIS 100          HB3       HIS 100  25.238  -5.671 -16.519
  742    HD1  HIS 100           HD1      HIS 100  25.251  -2.461 -18.731
  743    HD2  HIS 100           HD2      HIS 100  27.106  -6.217 -18.245
  744    HE1  HIS 100           HE1      HIS 100  26.783  -2.787 -20.743
  745    H    TRP 101           H        TRP 101  22.726  -2.948 -18.773
  746    HA   TRP 101           HA       TRP 101  21.556  -5.368 -20.093
  747   1HB   TRP 101          HB2       TRP 101  20.330  -2.622 -19.604
  748   2HB   TRP 101          HB3       TRP 101  19.732  -3.749 -20.801
  749    HD1  TRP 101           HD1      TRP 101  20.527  -5.225 -17.358
  750    HE1  TRP 101           HE1      TRP 101  18.372  -5.850 -16.201
  751    HE3  TRP 101           HE3      TRP 101  17.225  -3.130 -20.670
  752    HZ2  TRP 101           HZ2      TRP 101  15.526  -5.476 -16.618
  753    HZ3  TRP 101           HZ3      TRP 101  14.783  -3.304 -20.264
  754    HH2  TRP 101           HH2      TRP 101  13.934  -4.460 -18.229
  755    H    GLY 102           H        GLY 102  23.994  -4.928 -20.970
  756   1HA   GLY 102          HA1       GLY 102  24.385  -2.607 -22.573
  757   2HA   GLY 102          HA2       GLY 102  25.388  -4.059 -22.553
  758    H    PHE 103           H        PHE 103  23.632  -2.176 -24.527
  759    HA   PHE 103           HA       PHE 103  23.812  -4.055 -26.704
  760   1HB   PHE 103          HB2       PHE 103  21.452  -3.149 -27.507
  761   2HB   PHE 103          HB3       PHE 103  21.615  -4.612 -26.563
  762    HD1  PHE 103           HD1      PHE 103  21.198  -0.906 -25.914
  763    HD2  PHE 103           HD2      PHE 103  20.091  -4.938 -24.841
  764    HE1  PHE 103           HE1      PHE 103  19.720  -0.040 -24.126
  765    HE2  PHE 103           HE2      PHE 103  18.589  -4.057 -23.078
  766    HZ   PHE 103           HZ       PHE 103  18.450  -1.606 -22.674
  767    H    ASP 104           H        ASP 104  23.711  -2.736 -28.775
  768    HA   ASP 104           HA       ASP 104  25.416  -0.522 -28.336
  769   1HB   ASP 104          HB2       ASP 104  25.660  -2.055 -30.240
  770   2HB   ASP 104          HB3       ASP 104  24.137  -1.470 -30.910
  771    H    ASP 105           H        ASP 105  25.158   1.632 -29.094
  772    HA   ASP 105           HA       ASP 105  22.547   2.745 -28.332
  773   1HB   ASP 105          HB2       ASP 105  24.730   3.832 -27.673
  774   2HB   ASP 105          HB3       ASP 105  24.949   4.301 -29.357
  775    HA   PRO 106           HA       PRO 106  21.417   2.429 -32.612
  776   1HB   PRO 106          HB2       PRO 106  19.043   3.788 -32.656
  777   2HB   PRO 106          HB3       PRO 106  19.240   2.159 -31.954
  778   1HG   PRO 106          HG2       PRO 106  19.225   4.800 -30.487
  779   2HG   PRO 106          HG3       PRO 106  18.352   3.292 -30.062
  780   1HD   PRO 106          HD2       PRO 106  20.733   3.978 -28.921
  781   2HD   PRO 106          HD3       PRO 106  20.352   2.272 -29.296
  782    H    ALA 107           H        ALA 107  21.879   5.600 -31.094
  783    HA   ALA 107           HA       ALA 107  21.864   7.005 -33.636
  784   1HB   ALA 107          HB1       ALA 107  22.663   8.916 -32.348
  785   2HB   ALA 107          HB2       ALA 107  21.282   8.156 -31.534
  786   3HB   ALA 107          HB3       ALA 107  22.937   7.889 -30.930
  787    H    ARG 108           H        ARG 108  23.990   4.791 -32.194
  788    HA   ARG 108           HA       ARG 108  26.347   5.933 -33.613
  789   1HB   ARG 108          HB2       ARG 108  26.302   5.723 -31.046
  790   2HB   ARG 108          HB3       ARG 108  26.449   3.977 -31.286
  791   1HG   ARG 108          HG2       ARG 108  28.617   4.223 -32.293
  792   2HG   ARG 108          HG3       ARG 108  28.379   5.962 -32.549
  793   1HD   ARG 108          HD2       ARG 108  28.335   6.289 -30.068
  794   2HD   ARG 108          HD3       ARG 108  28.760   4.586 -29.848
  795    HE   ARG 108           HE       ARG 108  30.741   5.316 -31.468
  796   1HH1  ARG 108          HH21      ARG 108  29.460   7.115 -28.685
  797   2HH1  ARG 108          HH22      ARG 108  30.942   7.927 -28.352
  798   1HH2  ARG 108          HH11      ARG 108  32.730   6.354 -30.986
  799   2HH2  ARG 108          HH12      ARG 108  32.845   7.460 -29.674
  800    H    ALA 109           H        ALA 109  23.964   3.750 -34.076
  801    HA   ALA 109           HA       ALA 109  25.354   1.529 -35.240
  802   1HB   ALA 109          HB1       ALA 109  22.502   2.549 -35.635
  803   2HB   ALA 109          HB2       ALA 109  23.125   0.975 -36.149
  804   3HB   ALA 109          HB3       ALA 109  23.035   1.364 -34.419
  805    H    GLN 110           H        GLN 110  26.924   3.115 -36.285
  806    HA   GLN 110           HA       GLN 110  26.236   4.992 -38.236
  807   1HB   GLN 110          HB2       GLN 110  28.767   3.378 -37.737
  808   2HB   GLN 110          HB3       GLN 110  28.697   4.710 -38.890
  809   1HG   GLN 110          HG2       GLN 110  28.573   6.341 -37.267
  810   2HG   GLN 110          HG3       GLN 110  27.717   5.333 -36.115
  811   1HE2  GLN 110          HE22      GLN 110  28.888   3.858 -34.744
  812   2HE2  GLN 110          HE21      GLN 110  30.629   3.984 -34.563
  813    H    GLY 111           H        GLY 111  26.017   4.984 -40.361
  814   1HA   GLY 111          HA1       GLY 111  26.916   3.274 -42.314
  815   2HA   GLY 111          HA2       GLY 111  25.339   2.597 -41.850
  816    H    THR 112           H        THR 112  23.664   4.538 -41.393
  817    HA   THR 112           HA       THR 112  23.938   6.995 -42.713
  818    HB   THR 112           HB       THR 112  23.642   5.756 -44.801
  819    HG1  THR 112           HG1      THR 112  22.029   6.936 -45.594
  820   1HG2  THR 112          HG21      THR 112  21.045   4.664 -43.652
  821   2HG2  THR 112          HG22      THR 112  21.595   4.497 -45.330
  822   3HG2  THR 112          HG23      THR 112  22.504   3.720 -44.031
  823    H    GLU 113           H        GLU 113  21.671   8.124 -42.621
  824    HA   GLU 113           HA       GLU 113  20.823   7.921 -39.897
  825   1HB   GLU 113          HB2       GLU 113  19.177   9.618 -40.462
  826   2HB   GLU 113          HB3       GLU 113  20.772  10.032 -41.092
  827   1HG   GLU 113          HG2       GLU 113  20.060   9.241 -43.362
  828   2HG   GLU 113          HG3       GLU 113  18.454   8.892 -42.718
  829    H    GLU 114           H        GLU 114  19.601   6.480 -42.891
  830    HA   GLU 114           HA       GLU 114  17.140   5.557 -41.755
  831   1HB   GLU 114          HB2       GLU 114  17.503   5.828 -44.166
  832   2HB   GLU 114          HB3       GLU 114  18.706   4.527 -44.151
  833   1HG   GLU 114          HG2       GLU 114  16.980   2.907 -43.481
  834   2HG   GLU 114          HG3       GLU 114  15.782   4.200 -43.346
  835    H    GLU 115           H        GLU 115  20.437   4.237 -41.889
  836    HA   GLU 115           HA       GLU 115  19.750   1.612 -40.931
  837   1HB   GLU 115          HB2       GLU 115  21.871   2.202 -42.179
  838   2HB   GLU 115          HB3       GLU 115  22.413   3.087 -40.756
  839   1HG   GLU 115          HG2       GLU 115  23.479   0.976 -40.697
  840   2HG   GLU 115          HG3       GLU 115  22.267   0.954 -39.426
  841    H    LYS 116           H        LYS 116  20.993   4.637 -39.431
  842    HA   LYS 116           HA       LYS 116  20.951   3.788 -36.732
  843   1HB   LYS 116          HB2       LYS 116  20.569   6.516 -38.034
  844   2HB   LYS 116          HB3       LYS 116  20.602   6.278 -36.275
  845   1HG   LYS 116          HG2       LYS 116  22.863   5.227 -36.494
  846   2HG   LYS 116          HG3       LYS 116  22.841   5.599 -38.231
  847   1HD   LYS 116          HD2       LYS 116  22.582   8.034 -37.663
  848   2HD   LYS 116          HD3       LYS 116  22.673   7.604 -35.942
  849   1HE   LYS 116          HE2       LYS 116  24.929   6.470 -36.530
  850   2HE   LYS 116          HE3       LYS 116  24.829   7.331 -38.077
  851   1HZ   LYS 116          HZ1       LYS 116  24.919   8.521 -35.367
  852   2HZ   LYS 116          HZ2       LYS 116  26.094   8.617 -36.499
  853   3HZ   LYS 116          HZ3       LYS 116  24.691   9.414 -36.736
  854    H    TRP 117           H        TRP 117  18.322   5.354 -38.662
  855    HA   TRP 117           HA       TRP 117  16.397   5.319 -36.612
  856   1HB   TRP 117          HB2       TRP 117  16.074   6.678 -38.538
  857   2HB   TRP 117          HB3       TRP 117  16.240   5.306 -39.629
  858    HD1  TRP 117           HD1      TRP 117  14.084   4.818 -40.757
  859    HE1  TRP 117           HE1      TRP 117  11.648   4.527 -40.100
  860    HE3  TRP 117           HE3      TRP 117  14.410   6.181 -35.825
  861    HZ2  TRP 117           HZ2      TRP 117   9.994   4.909 -37.738
  862    HZ3  TRP 117           HZ3      TRP 117  12.423   6.101 -34.386
  863    HH2  TRP 117           HH2      TRP 117  10.197   5.463 -35.320
  864    H    ALA 118           H        ALA 118  17.257   2.715 -38.959
  865    HA   ALA 118           HA       ALA 118  15.082   1.020 -38.196
  866   1HB   ALA 118          HB1       ALA 118  17.779   0.323 -39.428
  867   2HB   ALA 118          HB2       ALA 118  16.365  -0.748 -39.332
  868   3HB   ALA 118          HB3       ALA 118  16.288   0.730 -40.311
  869    H    PHE 119           H        PHE 119  18.467   1.335 -37.115
  870    HA   PHE 119           HA       PHE 119  18.349  -0.769 -35.219
  871   1HB   PHE 119          HB2       PHE 119  20.368   0.675 -36.225
  872   2HB   PHE 119          HB3       PHE 119  20.155   1.581 -34.739
  873    HD1  PHE 119           HD1      PHE 119  20.494   0.375 -32.517
  874    HD2  PHE 119           HD2      PHE 119  21.265  -1.553 -36.293
  875    HE1  PHE 119           HE1      PHE 119  21.799  -1.371 -31.351
  876    HE2  PHE 119           HE2      PHE 119  22.576  -3.305 -35.124
  877    HZ   PHE 119           HZ       PHE 119  22.849  -3.219 -32.650
  878    H    PHE 120           H        PHE 120  17.455   2.666 -34.984
  879    HA   PHE 120           HA       PHE 120  16.932   2.779 -32.197
  880   1HB   PHE 120          HB2       PHE 120  16.095   4.325 -34.604
  881   2HB   PHE 120          HB3       PHE 120  14.929   4.344 -33.306
  882    HD1  PHE 120           HD1      PHE 120  18.025   5.769 -34.501
  883    HD2  PHE 120           HD2      PHE 120  15.679   5.012 -30.962
  884    HE1  PHE 120           HE1      PHE 120  19.278   7.533 -33.294
  885    HE2  PHE 120           HE2      PHE 120  16.958   6.754 -29.752
  886    HZ   PHE 120           HZ       PHE 120  18.716   8.058 -30.935
  887    H    GLN 121           H        GLN 121  14.723   1.740 -34.853
  888    HA   GLN 121           HA       GLN 121  12.581   1.074 -33.074
  889   1HB   GLN 121          HB2       GLN 121  13.352   0.062 -35.844
  890   2HB   GLN 121          HB3       GLN 121  11.867  -0.429 -35.024
  891   1HG   GLN 121          HG2       GLN 121  10.914   1.700 -35.157
  892   2HG   GLN 121          HG3       GLN 121  12.463   2.517 -35.340
  893   1HE2  GLN 121          HE22      GLN 121  13.360   2.812 -37.340
  894   2HE2  GLN 121          HE21      GLN 121  12.607   2.299 -38.835
  895    H    ARG 122           H        ARG 122  15.367  -0.914 -34.269
  896    HA   ARG 122           HA       ARG 122  14.462  -3.304 -32.976
  897   1HB   ARG 122          HB2       ARG 122  17.303  -2.403 -33.662
  898   2HB   ARG 122          HB3       ARG 122  16.882  -4.017 -33.110
  899   1HG   ARG 122          HG2       ARG 122  15.878  -2.743 -35.691
  900   2HG   ARG 122          HG3       ARG 122  17.195  -3.905 -35.549
  901   1HD   ARG 122          HD2       ARG 122  15.560  -5.572 -34.587
  902   2HD   ARG 122          HD3       ARG 122  14.267  -4.404 -34.866
  903    HE   ARG 122           HE       ARG 122  14.340  -4.757 -37.133
  904   1HH1  ARG 122          HH21      ARG 122  17.031  -6.534 -35.636
  905   2HH1  ARG 122          HH22      ARG 122  17.381  -7.467 -37.043
  906   1HH2  ARG 122          HH11      ARG 122  14.808  -5.999 -39.003
  907   2HH2  ARG 122          HH12      ARG 122  16.086  -7.154 -38.997
  908    H    VAL 123           H        VAL 123  16.707  -0.732 -31.744
  909    HA   VAL 123           HA       VAL 123  17.088  -2.097 -29.249
  910    HB   VAL 123           HB       VAL 123  17.523   0.784 -30.133
  911   1HG1  VAL 123          HG11      VAL 123  17.258   0.846 -27.704
  912   2HG1  VAL 123          HG12      VAL 123  18.344  -0.545 -27.508
  913   3HG1  VAL 123          HG13      VAL 123  18.966   1.008 -28.101
  914   1HG2  VAL 123          HG21      VAL 123  19.887   0.109 -30.162
  915   2HG2  VAL 123          HG22      VAL 123  19.470  -1.508 -29.563
  916   3HG2  VAL 123          HG23      VAL 123  18.958  -1.000 -31.180
  917    H    ARG 124           H        ARG 124  14.701   0.387 -30.349
  918    HA   ARG 124           HA       ARG 124  13.467   0.888 -27.857
  919   1HB   ARG 124          HB2       ARG 124  12.994   2.157 -29.910
  920   2HB   ARG 124          HB3       ARG 124  12.393   0.720 -30.707
  921   1HG   ARG 124          HG2       ARG 124  10.722   0.871 -28.485
  922   2HG   ARG 124          HG3       ARG 124  11.041   2.562 -28.842
  923   1HD   ARG 124          HD2       ARG 124   9.071   1.928 -30.046
  924   2HD   ARG 124          HD3       ARG 124  10.382   2.123 -31.211
  925    HE   ARG 124           HE       ARG 124   9.864  -0.628 -30.238
  926   1HH1  ARG 124          HH21      ARG 124   9.305   1.785 -32.731
  927   2HH1  ARG 124          HH22      ARG 124   8.795   0.679 -33.962
  928   1HH2  ARG 124          HH11      ARG 124   8.977  -2.175 -31.789
  929   2HH2  ARG 124          HH12      ARG 124   8.619  -1.617 -33.385
  930    H    ASP 125           H        ASP 125  12.675  -1.569 -30.374
  931    HA   ASP 125           HA       ASP 125  10.525  -2.639 -28.902
  932   1HB   ASP 125          HB2       ASP 125  11.212  -2.879 -31.429
  933   2HB   ASP 125          HB3       ASP 125  12.096  -4.307 -30.894
  934    H    GLU 126           H        GLU 126  13.961  -3.697 -29.066
  935    HA   GLU 126           HA       GLU 126  13.678  -6.011 -27.441
  936   1HB   GLU 126          HB2       GLU 126  15.604  -5.415 -28.934
  937   2HB   GLU 126          HB3       GLU 126  16.088  -4.191 -27.757
  938   1HG   GLU 126          HG2       GLU 126  17.437  -6.103 -27.328
  939   2HG   GLU 126          HG3       GLU 126  16.255  -6.043 -26.026
  940    H    ILE 127           H        ILE 127  14.475  -2.582 -26.588
  941    HA   ILE 127           HA       ILE 127  14.774  -3.014 -23.793
  942    HB   ILE 127           HB       ILE 127  14.033  -0.600 -25.485
  943   1HG1  ILE 127          HG12      ILE 127  16.463  -1.281 -23.769
  944   2HG1  ILE 127          HG13      ILE 127  16.397  -1.506 -25.508
  945   1HG2  ILE 127          HG21      ILE 127  12.920  -0.296 -23.262
  946   2HG2  ILE 127          HG22      ILE 127  14.491  -0.539 -22.472
  947   3HG2  ILE 127          HG23      ILE 127  14.214   0.846 -23.564
  948   1HD1  ILE 127          HD11      ILE 127  17.580   0.524 -25.164
  949   2HD1  ILE 127          HD12      ILE 127  15.961   1.016 -25.701
  950   3HD1  ILE 127          HD13      ILE 127  16.415   1.120 -23.981
  951    H    GLY 128           H        GLY 128  11.851  -2.035 -25.698
  952   1HA   GLY 128          HA1       GLY 128   9.968  -2.032 -23.666
  953   2HA   GLY 128          HA2       GLY 128   9.645  -2.546 -25.336
  954    H    ASN 129           H        ASN 129  11.071  -4.905 -25.554
  955    HA   ASN 129           HA       ASN 129   9.360  -6.751 -24.252
  956   1HB   ASN 129          HB2       ASN 129  11.987  -7.077 -25.745
  957   2HB   ASN 129          HB3       ASN 129  11.299  -8.431 -24.870
  958   1HD2  ASN 129          HD22      ASN 129  10.684  -6.174 -27.569
  959   2HD2  ASN 129          HD21      ASN 129   9.514  -7.198 -28.357
  960    H    ARG 130           H        ARG 130  12.732  -5.811 -23.415
  961    HA   ARG 130           HA       ARG 130  12.609  -7.687 -21.157
  962   1HB   ARG 130          HB2       ARG 130  14.739  -5.594 -21.686
  963   2HB   ARG 130          HB3       ARG 130  14.835  -6.973 -20.583
  964   1HG   ARG 130          HG2       ARG 130  14.767  -6.983 -23.606
  965   2HG   ARG 130          HG3       ARG 130  16.054  -7.559 -22.568
  966   1HD   ARG 130          HD2       ARG 130  14.873  -9.563 -22.017
  967   2HD   ARG 130          HD3       ARG 130  13.319  -8.934 -22.564
  968    HE   ARG 130           HE       ARG 130  14.960  -8.779 -24.806
  969   1HH1  ARG 130          HH11      ARG 130  13.507 -11.364 -22.821
  970   2HH1  ARG 130          HH12      ARG 130  13.521 -12.506 -24.134
  971   1HH2  ARG 130          HH21      ARG 130  14.864 -10.103 -26.431
  972   2HH2  ARG 130          HH22      ARG 130  14.306 -11.766 -26.317
  973    H    LEU 131           H        LEU 131  11.829  -4.243 -21.499
  974    HA   LEU 131           HA       LEU 131  11.738  -3.871 -18.653
  975   1HB   LEU 131          HB2       LEU 131  11.365  -2.186 -20.867
  976   2HB   LEU 131          HB3       LEU 131   9.772  -2.313 -20.170
  977    HG   LEU 131           HG       LEU 131  10.833  -0.453 -19.194
  978   1HD1  LEU 131          HD11      LEU 131  11.048  -2.630 -17.089
  979   2HD1  LEU 131          HD12      LEU 131  10.864  -0.909 -16.793
  980   3HD1  LEU 131          HD13      LEU 131   9.548  -1.822 -17.564
  981   1HD2  LEU 131          HD21      LEU 131  12.997  -0.406 -18.168
  982   2HD2  LEU 131          HD22      LEU 131  13.197  -2.156 -18.343
  983   3HD2  LEU 131          HD23      LEU 131  13.168  -1.103 -19.776
  984    H    LYS 132           H        LYS 132   9.392  -5.064 -21.125
  985    HA   LYS 132           HA       LYS 132   7.229  -5.416 -19.347
  986   1HB   LYS 132          HB2       LYS 132   7.058  -5.628 -21.815
  987   2HB   LYS 132          HB3       LYS 132   7.991  -7.117 -21.761
  988   1HG   LYS 132          HG2       LYS 132   6.281  -8.228 -20.417
  989   2HG   LYS 132          HG3       LYS 132   5.330  -6.723 -20.346
  990   1HD   LYS 132          HD2       LYS 132   5.112  -6.745 -22.824
  991   2HD   LYS 132          HD3       LYS 132   6.055  -8.248 -22.893
  992   1HE   LYS 132          HE2       LYS 132   4.341  -9.382 -21.482
  993   2HE   LYS 132          HE3       LYS 132   3.398  -7.887 -21.426
  994   1HZ   LYS 132          HZ1       LYS 132   2.567  -9.396 -23.113
  995   2HZ   LYS 132          HZ2       LYS 132   3.125  -8.048 -23.834
  996   3HZ   LYS 132          HZ3       LYS 132   3.999  -9.430 -23.886
  997    H    GLU 133           H        GLU 133   9.849  -7.693 -20.241
  998    HA   GLU 133           HA       GLU 133   8.987  -9.704 -18.481
  999   1HB   GLU 133          HB2       GLU 133  11.822  -9.189 -19.395
 1000   2HB   GLU 133          HB3       GLU 133  11.252 -10.613 -18.501
 1001   1HG   GLU 133          HG2       GLU 133   9.561 -11.015 -20.318
 1002   2HG   GLU 133          HG3       GLU 133  10.358  -9.767 -21.272
 1003    H    PHE 134           H        PHE 134  11.225  -6.985 -17.857
 1004    HA   PHE 134           HA       PHE 134  11.944  -7.710 -15.236
 1005   1HB   PHE 134          HB2       PHE 134  13.115  -6.006 -16.420
 1006   2HB   PHE 134          HB3       PHE 134  11.650  -5.039 -16.612
 1007    HD1  PHE 134           HD1      PHE 134  11.094  -3.360 -15.055
 1008    HD2  PHE 134           HD2      PHE 134  13.981  -6.373 -13.974
 1009    HE1  PHE 134           HE1      PHE 134  11.606  -2.103 -12.992
 1010    HE2  PHE 134           HE2      PHE 134  14.451  -5.150 -11.865
 1011    HZ   PHE 134           HZ       PHE 134  13.272  -3.018 -11.369
 1012    H    ALA 135           H        ALA 135   8.993  -6.173 -16.409
 1013    HA   ALA 135           HA       ALA 135   8.109  -5.540 -13.712
 1014   1HB   ALA 135          HB1       ALA 135   6.611  -5.411 -16.375
 1015   2HB   ALA 135          HB2       ALA 135   6.094  -4.666 -14.848
 1016   3HB   ALA 135          HB3       ALA 135   7.554  -4.081 -15.675
 1017    H    GLU 136           H        GLU 136   7.510  -8.009 -16.170
 1018    HA   GLU 136           HA       GLU 136   5.199  -9.102 -14.800
 1019   1HB   GLU 136          HB2       GLU 136   5.165  -8.835 -17.197
 1020   2HB   GLU 136          HB3       GLU 136   6.654  -9.774 -17.385
 1021   1HG   GLU 136          HG2       GLU 136   5.567 -11.809 -16.672
 1022   2HG   GLU 136          HG3       GLU 136   4.094 -10.935 -16.236
 1023    H    THR 137           H        THR 137   8.479 -10.198 -15.642
 1024    HA   THR 137           HA       THR 137   8.084 -12.710 -14.153
 1025    HB   THR 137           HB       THR 137   9.683 -13.676 -15.659
 1026    HG1  THR 137           HG1      THR 137  10.612 -12.454 -17.288
 1027   1HG2  THR 137          HG21      THR 137   7.876 -11.941 -17.392
 1028   2HG2  THR 137          HG22      THR 137   8.553 -13.531 -17.781
 1029   3HG2  THR 137          HG23      THR 137   7.308 -13.400 -16.524
 1030    H    GLY 138           H        GLY 138   9.957  -9.747 -14.279
 1031   1HA   GLY 138          HA1       GLY 138  11.304  -8.879 -12.594
 1032   2HA   GLY 138          HA2       GLY 138  11.393 -10.458 -11.811
 1033    H    LYS 139           H        LYS 139  12.053 -10.557 -15.249
 1034    HA   LYS 139           HA       LYS 139  14.712 -11.495 -14.708
 1035   1HB   LYS 139          HB2       LYS 139  13.239 -10.937 -17.295
 1036   2HB   LYS 139          HB3       LYS 139  14.877 -11.589 -17.227
 1037   1HG   LYS 139          HG2       LYS 139  12.433 -12.901 -15.980
 1038   2HG   LYS 139          HG3       LYS 139  13.172 -13.357 -17.524
 1039   1HD   LYS 139          HD2       LYS 139  15.277 -13.905 -16.208
 1040   2HD   LYS 139          HD3       LYS 139  14.334 -13.595 -14.721
 1041   1HE   LYS 139          HE2       LYS 139  12.689 -15.303 -15.383
 1042   2HE   LYS 139          HE3       LYS 139  13.603 -15.634 -16.861
 1043   1HZ   LYS 139          HZ1       LYS 139  15.453 -16.374 -15.472
 1044   2HZ   LYS 139          HZ2       LYS 139  14.608 -16.072 -14.106
 1045   3HZ   LYS 139          HZ3       LYS 139  14.115 -17.236 -15.132
  Start of MODEL    3
    1   1H    MET   1           H1       MET   1   1.557   2.902   3.583
    2   2H    MET   1           H2       MET   1   3.085   2.310   3.470
    3   3H    MET   1           H3       MET   1   2.850   3.888   3.823
    4    HA   MET   1           HA       MET   1   2.209   2.565   1.282
    5   1HB   MET   1          HB2       MET   1   1.760   5.459   2.147
    6   2HB   MET   1          HB3       MET   1   1.835   4.941   0.466
    7   1HG   MET   1          HG2       MET   1  -0.446   5.078   1.032
    8   2HG   MET   1          HG3       MET   1  -0.051   3.376   0.844
    9   1HE   MET   1          HE1       MET   1  -2.383   2.740   1.906
   10   2HE   MET   1          HE2       MET   1  -2.971   3.368   3.463
   11   3HE   MET   1          HE3       MET   1  -2.765   4.469   2.083
   12    H    GLU   2           H        GLU   2   3.801   2.668  -0.283
   13    HA   GLU   2           HA       GLU   2   6.051   4.481  -0.057
   14   1HB   GLU   2          HB2       GLU   2   6.702   2.568   1.428
   15   2HB   GLU   2          HB3       GLU   2   6.413   1.445   0.106
   16   1HG   GLU   2          HG2       GLU   2   8.797   1.870   0.451
   17   2HG   GLU   2          HG3       GLU   2   8.300   2.371  -1.151
   18    H    ASN   3           H        ASN   3   7.385   4.267  -2.117
   19    HA   ASN   3           HA       ASN   3   6.014   2.911  -4.371
   20   1HB   ASN   3          HB2       ASN   3   5.323   5.411  -4.080
   21   2HB   ASN   3          HB3       ASN   3   6.984   5.795  -4.546
   22   1HD2  ASN   3          HD22      ASN   3   7.687   5.047  -6.776
   23   2HD2  ASN   3          HD21      ASN   3   6.395   4.962  -7.987
   24    H    LYS   4           H        LYS   4   7.582   2.226  -5.944
   25    HA   LYS   4           HA       LYS   4  10.317   2.029  -4.922
   26   1HB   LYS   4          HB2       LYS   4   9.091   1.145  -7.568
   27   2HB   LYS   4          HB3       LYS   4  10.640   0.625  -6.959
   28   1HG   LYS   4          HG2       LYS   4   7.929   0.004  -5.673
   29   2HG   LYS   4          HG3       LYS   4   8.747  -1.034  -6.821
   30   1HD   LYS   4          HD2       LYS   4   9.866  -0.260  -4.099
   31   2HD   LYS   4          HD3       LYS   4   9.054  -1.786  -4.507
   32   1HE   LYS   4          HE2       LYS   4  10.803  -2.091  -6.354
   33   2HE   LYS   4          HE3       LYS   4  11.670  -0.719  -5.643
   34   1HZ   LYS   4          HZ1       LYS   4  11.694  -2.052  -3.528
   35   2HZ   LYS   4          HZ2       LYS   4  11.171  -3.346  -4.388
   36   3HZ   LYS   4          HZ3       LYS   4  12.611  -2.628  -4.752
   37    H    ILE   5           H        ILE   5  12.109   2.429  -6.631
   38    HA   ILE   5           HA       ILE   5  11.676   4.781  -8.330
   39    HB   ILE   5           HB       ILE   5  13.914   4.622  -6.293
   40   1HG1  ILE   5          HG12      ILE   5  12.739   6.870  -5.433
   41   2HG1  ILE   5          HG13      ILE   5  11.291   6.032  -5.956
   42   1HG2  ILE   5          HG21      ILE   5  13.063   6.904  -8.131
   43   2HG2  ILE   5          HG22      ILE   5  14.408   6.970  -6.976
   44   3HG2  ILE   5          HG23      ILE   5  14.492   5.889  -8.360
   45   1HD1  ILE   5          HD11      ILE   5  13.408   5.044  -3.984
   46   2HD1  ILE   5          HD12      ILE   5  11.777   5.610  -3.578
   47   3HD1  ILE   5          HD13      ILE   5  11.999   4.084  -4.453
   48    H    ILE   6           H        ILE   6  13.138   4.638 -10.144
   49    HA   ILE   6           HA       ILE   6  15.223   2.565 -10.113
   50    HB   ILE   6           HB       ILE   6  13.233   1.343 -10.789
   51   1HG1  ILE   6          HG12      ILE   6  15.034   1.764 -13.210
   52   2HG1  ILE   6          HG13      ILE   6  15.475   0.825 -11.778
   53   1HG2  ILE   6          HG21      ILE   6  11.946   1.840 -12.807
   54   2HG2  ILE   6          HG22      ILE   6  11.899   3.236 -11.742
   55   3HG2  ILE   6          HG23      ILE   6  12.978   3.238 -13.160
   56   1HD1  ILE   6          HD11      ILE   6  13.520  -0.671 -12.200
   57   2HD1  ILE   6          HD12      ILE   6  13.210   0.208 -13.717
   58   3HD1  ILE   6          HD13      ILE   6  14.727  -0.678 -13.507
   59    H    TYR   7           H        TYR   7  16.824   2.890 -11.777
   60    HA   TYR   7           HA       TYR   7  16.664   5.492 -13.194
   61   1HB   TYR   7          HB2       TYR   7  17.878   5.299 -10.841
   62   2HB   TYR   7          HB3       TYR   7  19.137   4.502 -11.750
   63    HD1  TYR   7           HD1      TYR   7  17.523   7.341 -13.512
   64    HD2  TYR   7           HD2      TYR   7  20.520   6.225 -10.613
   65    HE1  TYR   7           HE1      TYR   7  18.343   9.651 -13.485
   66    HE2  TYR   7           HE2      TYR   7  21.369   8.548 -10.615
   67    HH   TYR   7           HH       TYR   7  19.778  11.174 -12.457
   68    H    PHE   8           H        PHE   8  17.593   5.457 -15.227
   69    HA   PHE   8           HA       PHE   8  19.056   2.987 -16.102
   70   1HB   PHE   8          HB2       PHE   8  17.250   4.802 -17.752
   71   2HB   PHE   8          HB3       PHE   8  18.074   3.357 -18.316
   72    HD1  PHE   8           HD1      PHE   8  17.547   1.202 -16.672
   73    HD2  PHE   8           HD2      PHE   8  14.948   4.547 -17.414
   74    HE1  PHE   8           HE1      PHE   8  15.599  -0.187 -16.017
   75    HE2  PHE   8           HE2      PHE   8  13.002   3.141 -16.811
   76    HZ   PHE   8           HZ       PHE   8  13.314   0.796 -16.069
   77    H    LEU   9           H        LEU   9  21.071   3.348 -16.873
   78    HA   LEU   9           HA       LEU   9  21.947   6.177 -17.270
   79   1HB   LEU   9          HB2       LEU   9  23.042   3.825 -15.750
   80   2HB   LEU   9          HB3       LEU   9  24.181   4.930 -16.496
   81    HG   LEU   9           HG       LEU   9  23.464   6.791 -15.220
   82   1HD1  LEU   9          HD11      LEU   9  21.076   6.584 -15.027
   83   2HD1  LEU   9          HD12      LEU   9  21.220   5.058 -14.118
   84   3HD1  LEU   9          HD13      LEU   9  21.744   6.601 -13.408
   85   1HD2  LEU   9          HD21      LEU   9  23.973   5.994 -12.928
   86   2HD2  LEU   9          HD22      LEU   9  23.677   4.321 -13.454
   87   3HD2  LEU   9          HD23      LEU   9  25.030   5.240 -14.124
   88    H    CYS  10           H        CYS  10  23.196   6.665 -18.994
   89    HA   CYS  10           HA       CYS  10  24.557   4.558 -20.600
   90   1HB   CYS  10          HB2       CYS  10  22.780   6.781 -21.724
   91   2HB   CYS  10          HB3       CYS  10  23.858   5.779 -22.693
   92    HG   CYS  10           HG       CYS  10  21.995   4.138 -20.654
   93    H    THR  11           H        THR  11  26.170   5.832 -22.158
   94    HA   THR  11           HA       THR  11  27.695   7.726 -20.704
   95    HB   THR  11           HB       THR  11  28.320   8.423 -23.236
   96    HG1  THR  11           HG1      THR  11  27.267   5.788 -23.500
   97   1HG2  THR  11          HG21      THR  11  29.917   7.580 -21.701
   98   2HG2  THR  11          HG22      THR  11  29.229   5.949 -21.764
   99   3HG2  THR  11          HG23      THR  11  30.042   6.657 -23.202
  100    H    GLY  12           H        GLY  12  25.274   8.184 -23.294
  101   1HA   GLY  12          HA1       GLY  12  24.940  11.037 -22.449
  102   2HA   GLY  12          HA2       GLY  12  24.751  10.465 -24.115
  103    H    ASN  13           H        ASN  13  23.021  11.392 -21.553
  104    HA   ASN  13           HA       ASN  13  20.961   9.341 -21.460
  105   1HB   ASN  13          HB2       ASN  13  21.422  10.920 -19.578
  106   2HB   ASN  13          HB3       ASN  13  20.853  12.252 -20.589
  107   1HD2  ASN  13          HD22      ASN  13  19.396   8.870 -20.186
  108   2HD2  ASN  13          HD21      ASN  13  17.878   9.517 -19.582
  109    H    SER  14           H        SER  14  21.115   9.421 -24.017
  110    HA   SER  14           HA       SER  14  19.040  11.322 -25.018
  111   1HB   SER  14          HB2       SER  14  21.689  10.629 -26.334
  112   2HB   SER  14          HB3       SER  14  20.454  11.719 -26.987
  113    HG   SER  14           HG       SER  14  20.827  13.150 -25.415
  114    H    CYS  15           H        CYS  15  20.245   8.047 -25.106
  115    HA   CYS  15           HA       CYS  15  18.323   7.434 -27.310
  116   1HB   CYS  15          HB2       CYS  15  21.119   6.289 -26.892
  117   2HB   CYS  15          HB3       CYS  15  19.940   5.721 -28.089
  118    HG   CYS  15           HG       CYS  15  21.879   7.096 -29.157
  119    H    ARG  16           H        ARG  16  20.229   4.954 -25.668
  120    HA   ARG  16           HA       ARG  16  17.892   3.427 -25.352
  121   1HB   ARG  16          HB2       ARG  16  20.423   3.021 -23.718
  122   2HB   ARG  16          HB3       ARG  16  19.169   1.869 -24.074
  123   1HG   ARG  16          HG2       ARG  16  20.500   1.105 -25.653
  124   2HG   ARG  16          HG3       ARG  16  19.885   2.429 -26.623
  125   1HD   ARG  16          HD2       ARG  16  22.386   2.095 -26.679
  126   2HD   ARG  16          HD3       ARG  16  21.882   3.737 -26.196
  127    HE   ARG  16           HE       ARG  16  22.397   1.806 -24.053
  128   1HH1  ARG  16          HH11      ARG  16  23.872   4.503 -25.967
  129   2HH1  ARG  16          HH12      ARG  16  25.213   4.606 -24.857
  130   1HH2  ARG  16          HH21      ARG  16  24.120   2.073 -22.720
  131   2HH2  ARG  16          HH22      ARG  16  25.297   3.359 -22.983
  132    H    SER  17           H        SER  17  19.651   5.267 -22.760
  133    HA   SER  17           HA       SER  17  17.955   4.330 -20.689
  134   1HB   SER  17          HB2       SER  17  18.880   6.316 -19.439
  135   2HB   SER  17          HB3       SER  17  20.054   5.230 -20.129
  136    HG   SER  17           HG       SER  17  20.845   6.969 -20.989
  137    H    GLN  18           H        GLN  18  17.603   7.126 -22.841
  138    HA   GLN  18           HA       GLN  18  15.307   8.288 -21.590
  139   1HB   GLN  18          HB2       GLN  18  16.609   8.410 -24.328
  140   2HB   GLN  18          HB3       GLN  18  15.039   9.140 -24.095
  141   1HG   GLN  18          HG2       GLN  18  17.429   9.787 -22.319
  142   2HG   GLN  18          HG3       GLN  18  17.067  10.669 -23.801
  143   1HE2  GLN  18          HE22      GLN  18  17.001  11.664 -20.872
  144   2HE2  GLN  18          HE21      GLN  18  15.370  12.324 -20.772
  145    H    MET  19           H        MET  19  15.539   6.155 -24.458
  146    HA   MET  19           HA       MET  19  12.787   5.681 -24.793
  147   1HB   MET  19          HB2       MET  19  15.087   3.760 -25.381
  148   2HB   MET  19          HB3       MET  19  13.429   3.594 -25.957
  149   1HG   MET  19          HG2       MET  19  13.790   6.002 -26.941
  150   2HG   MET  19          HG3       MET  19  15.510   5.620 -26.792
  151   1HE   MET  19          HE1       MET  19  16.023   2.690 -29.282
  152   2HE   MET  19          HE2       MET  19  16.795   3.835 -28.160
  153   3HE   MET  19          HE3       MET  19  15.737   2.546 -27.534
  154    H    ALA  20           H        ALA  20  15.093   3.860 -22.702
  155    HA   ALA  20           HA       ALA  20  13.265   1.863 -21.874
  156   1HB   ALA  20          HB1       ALA  20  14.855   1.489 -20.023
  157   2HB   ALA  20          HB2       ALA  20  15.714   1.711 -21.561
  158   3HB   ALA  20          HB3       ALA  20  15.655   3.034 -20.372
  159    H    GLU  21           H        GLU  21  14.017   5.047 -20.379
  160    HA   GLU  21           HA       GLU  21  12.276   4.767 -18.184
  161   1HB   GLU  21          HB2       GLU  21  13.914   6.559 -18.409
  162   2HB   GLU  21          HB3       GLU  21  12.966   7.287 -19.710
  163   1HG   GLU  21          HG2       GLU  21  11.061   7.534 -18.024
  164   2HG   GLU  21          HG3       GLU  21  12.185   6.999 -16.785
  165    H    GLY  22           H        GLY  22  11.478   5.797 -21.547
  166   1HA   GLY  22          HA1       GLY  22   8.726   6.426 -21.097
  167   2HA   GLY  22          HA2       GLY  22   9.441   5.871 -22.633
  168    H    TRP  23           H        TRP  23  10.223   3.306 -22.134
  169    HA   TRP  23           HA       TRP  23   7.741   1.867 -22.173
  170   1HB   TRP  23          HB2       TRP  23  10.624   0.976 -21.760
  171   2HB   TRP  23          HB3       TRP  23   9.272  -0.145 -21.822
  172    HD1  TRP  23           HD1      TRP  23  11.656   1.578 -24.056
  173    HE1  TRP  23           HE1      TRP  23  11.099   1.121 -26.490
  174    HE3  TRP  23           HE3      TRP  23   6.942  -0.309 -23.444
  175    HZ2  TRP  23           HZ2      TRP  23   8.820   0.099 -28.031
  176    HZ3  TRP  23           HZ3      TRP  23   5.651  -1.123 -25.390
  177    HH2  TRP  23           HH2      TRP  23   6.595  -0.961 -27.678
  178    H    ALA  24           H        ALA  24  10.184   2.313 -19.595
  179    HA   ALA  24           HA       ALA  24   9.028   0.503 -17.780
  180   1HB   ALA  24          HB1       ALA  24  11.356   1.308 -17.653
  181   2HB   ALA  24          HB2       ALA  24  10.775   2.936 -17.321
  182   3HB   ALA  24          HB3       ALA  24  10.521   1.633 -16.130
  183    H    LYS  25           H        LYS  25   8.482   4.053 -18.124
  184    HA   LYS  25           HA       LYS  25   6.871   4.449 -15.857
  185   1HB   LYS  25          HB2       LYS  25   6.810   5.628 -18.655
  186   2HB   LYS  25          HB3       LYS  25   5.621   6.120 -17.443
  187   1HG   LYS  25          HG2       LYS  25   7.288   6.946 -15.945
  188   2HG   LYS  25          HG3       LYS  25   8.606   6.239 -16.896
  189   1HD   LYS  25          HD2       LYS  25   8.125   7.717 -18.775
  190   2HD   LYS  25          HD3       LYS  25   6.732   8.429 -17.919
  191   1HE   LYS  25          HE2       LYS  25   8.134   9.421 -16.243
  192   2HE   LYS  25          HE3       LYS  25   9.501   8.392 -16.689
  193   1HZ   LYS  25          HZ1       LYS  25   8.497  10.695 -18.251
  194   2HZ   LYS  25          HZ2       LYS  25  10.009  10.396 -17.573
  195   3HZ   LYS  25          HZ3       LYS  25   9.529   9.553 -18.850
  196    H    GLN  26           H        GLN  26   5.922   3.120 -19.014
  197    HA   GLN  26           HA       GLN  26   3.162   2.901 -18.250
  198   1HB   GLN  26          HB2       GLN  26   4.638   1.512 -20.522
  199   2HB   GLN  26          HB3       GLN  26   2.888   1.547 -20.266
  200   1HG   GLN  26          HG2       GLN  26   3.235   4.183 -20.229
  201   2HG   GLN  26          HG3       GLN  26   4.734   3.792 -21.089
  202   1HE2  GLN  26          HE22      GLN  26   4.199   1.881 -22.851
  203   2HE2  GLN  26          HE21      GLN  26   2.837   2.241 -23.884
  204    H    TYR  27           H        TYR  27   5.670   0.351 -18.686
  205    HA   TYR  27           HA       TYR  27   3.933  -1.727 -17.818
  206   1HB   TYR  27          HB2       TYR  27   6.973  -1.610 -17.797
  207   2HB   TYR  27          HB3       TYR  27   6.037  -3.060 -17.478
  208    HD1  TYR  27           HD1      TYR  27   7.810  -1.435 -19.969
  209    HD2  TYR  27           HD2      TYR  27   4.112  -3.557 -19.363
  210    HE1  TYR  27           HE1      TYR  27   7.844  -2.160 -22.341
  211    HE2  TYR  27           HE2      TYR  27   4.046  -4.147 -21.761
  212    HH   TYR  27           HH       TYR  27   5.140  -4.014 -23.820
  213    H    LEU  28           H        LEU  28   6.274   0.235 -15.971
  214    HA   LEU  28           HA       LEU  28   5.752  -1.201 -13.480
  215   1HB   LEU  28          HB2       LEU  28   7.259   1.397 -13.956
  216   2HB   LEU  28          HB3       LEU  28   7.310   0.411 -12.525
  217    HG   LEU  28           HG       LEU  28   8.336  -0.475 -15.250
  218   1HD1  LEU  28          HD11      LEU  28   9.907   0.243 -12.754
  219   2HD1  LEU  28          HD12      LEU  28  10.543  -0.164 -14.361
  220   3HD1  LEU  28          HD13      LEU  28   9.632   1.342 -14.125
  221   1HD2  LEU  28          HD21      LEU  28   9.312  -2.395 -14.089
  222   2HD2  LEU  28          HD22      LEU  28   8.579  -1.875 -12.556
  223   3HD2  LEU  28          HD23      LEU  28   7.565  -2.414 -13.908
  224    H    GLY  29           H        GLY  29   3.914   1.050 -15.139
  225   1HA   GLY  29          HA1       GLY  29   2.067   2.219 -14.608
  226   2HA   GLY  29          HA2       GLY  29   1.950   1.133 -13.211
  227    H    ASP  30           H        ASP  30   4.592   3.420 -13.597
  228    HA   ASP  30           HA       ASP  30   5.494   4.952 -12.261
  229   1HB   ASP  30          HB2       ASP  30   3.714   6.285 -13.226
  230   2HB   ASP  30          HB3       ASP  30   2.654   5.906 -11.868
  231    H    GLU  31           H        GLU  31   4.037   2.400 -10.962
  232    HA   GLU  31           HA       GLU  31   4.086   2.990  -8.137
  233   1HB   GLU  31          HB2       GLU  31   4.464   0.300  -9.514
  234   2HB   GLU  31          HB3       GLU  31   4.079   0.587  -7.819
  235   1HG   GLU  31          HG2       GLU  31   1.930   1.701  -8.583
  236   2HG   GLU  31          HG3       GLU  31   2.307   1.153 -10.223
  237    H    TRP  32           H        TRP  32   6.413   2.962 -10.491
  238    HA   TRP  32           HA       TRP  32   8.613   2.886  -8.560
  239   1HB   TRP  32          HB2       TRP  32   8.781   1.939 -11.448
  240   2HB   TRP  32          HB3       TRP  32  10.082   1.953 -10.277
  241    HD1  TRP  32           HD1      TRP  32   6.561   0.263 -10.346
  242    HE1  TRP  32           HE1      TRP  32   6.776  -2.169  -9.705
  243    HE3  TRP  32           HE3      TRP  32  11.646   0.045  -9.671
  244    HZ2  TRP  32           HZ2      TRP  32   8.875  -4.080  -9.355
  245    HZ3  TRP  32           HZ3      TRP  32  12.730  -2.146  -9.270
  246    HH2  TRP  32           HH2      TRP  32  11.360  -4.235  -9.197
  247    H    LYS  33           H        LYS  33   9.351   4.939  -8.492
  248    HA   LYS  33           HA       LYS  33   8.652   6.960 -10.414
  249   1HB   LYS  33          HB2       LYS  33  10.652   6.865  -8.100
  250   2HB   LYS  33          HB3       LYS  33  10.302   8.315  -9.052
  251   1HG   LYS  33          HG2       LYS  33   8.566   6.873  -7.057
  252   2HG   LYS  33          HG3       LYS  33   9.092   8.540  -7.045
  253   1HD   LYS  33          HD2       LYS  33   6.999   7.323  -8.904
  254   2HD   LYS  33          HD3       LYS  33   6.701   8.381  -7.528
  255   1HE   LYS  33          HE2       LYS  33   7.839  10.248  -8.619
  256   2HE   LYS  33          HE3       LYS  33   8.338   9.216  -9.964
  257   1HZ   LYS  33          HZ1       LYS  33   5.530   9.875  -9.306
  258   2HZ   LYS  33          HZ2       LYS  33   6.392  10.511 -10.537
  259   3HZ   LYS  33          HZ3       LYS  33   6.010   8.915 -10.549
  260    H    VAL  34           H        VAL  34   9.380   6.477 -12.428
  261    HA   VAL  34           HA       VAL  34  11.963   5.289 -12.837
  262    HB   VAL  34           HB       VAL  34  10.153   6.409 -14.995
  263   1HG1  VAL  34          HG11      VAL  34  11.075   4.789 -16.352
  264   2HG1  VAL  34          HG12      VAL  34  12.481   5.283 -15.407
  265   3HG1  VAL  34          HG13      VAL  34  11.648   3.775 -15.001
  266   1HG2  VAL  34          HG21      VAL  34   9.037   4.128 -15.083
  267   2HG2  VAL  34          HG22      VAL  34   9.664   3.830 -13.453
  268   3HG2  VAL  34          HG23      VAL  34   8.524   5.165 -13.757
  269    H    TYR  35           H        TYR  35  13.787   6.286 -13.617
  270    HA   TYR  35           HA       TYR  35  13.697   9.048 -14.675
  271   1HB   TYR  35          HB2       TYR  35  15.518   8.072 -12.431
  272   2HB   TYR  35          HB3       TYR  35  15.695   9.604 -13.271
  273    HD1  TYR  35           HD1      TYR  35  14.001   7.838 -10.584
  274    HD2  TYR  35           HD2      TYR  35  13.914  11.393 -13.032
  275    HE1  TYR  35           HE1      TYR  35  12.565   8.962  -8.907
  276    HE2  TYR  35           HE2      TYR  35  12.453  12.509 -11.377
  277    HH   TYR  35           HH       TYR  35  11.339  12.310  -9.334
  278    H    SER  36           H        SER  36  15.840   9.550 -15.766
  279    HA   SER  36           HA       SER  36  17.636   7.289 -16.164
  280   1HB   SER  36          HB2       SER  36  17.669   7.591 -18.587
  281   2HB   SER  36          HB3       SER  36  16.089   7.034 -18.033
  282    HG   SER  36           HG       SER  36  15.283   9.085 -18.309
  283    H    ALA  37           H        ALA  37  19.731   7.992 -17.039
  284    HA   ALA  37           HA       ALA  37  20.360  10.823 -17.138
  285   1HB   ALA  37          HB1       ALA  37  21.281   9.138 -14.759
  286   2HB   ALA  37          HB2       ALA  37  21.852  10.769 -15.163
  287   3HB   ALA  37          HB3       ALA  37  20.179  10.543 -14.712
  288    H    GLY  38           H        GLY  38  23.061  10.781 -16.748
  289   1HA   GLY  38          HA1       GLY  38  24.391   8.453 -17.627
  290   2HA   GLY  38          HA2       GLY  38  24.167   9.558 -19.004
  291    H    ILE  39           H        ILE  39  26.619   9.186 -18.694
  292    HA   ILE  39           HA       ILE  39  28.138  10.747 -16.837
  293    HB   ILE  39           HB       ILE  39  28.533   9.418 -19.517
  294   1HG1  ILE  39          HG12      ILE  39  30.302   9.261 -17.062
  295   2HG1  ILE  39          HG13      ILE  39  28.826   8.322 -17.207
  296   1HG2  ILE  39          HG21      ILE  39  30.570  11.376 -18.433
  297   2HG2  ILE  39          HG22      ILE  39  30.847  10.219 -19.754
  298   3HG2  ILE  39          HG23      ILE  39  29.663  11.493 -19.964
  299   1HD1  ILE  39          HD11      ILE  39  31.181   8.139 -19.154
  300   2HD1  ILE  39          HD12      ILE  39  30.796   6.988 -17.883
  301   3HD1  ILE  39          HD13      ILE  39  29.677   7.196 -19.238
  302    H    GLU  40           H        GLU  40  26.316  11.504 -19.780
  303    HA   GLU  40           HA       GLU  40  26.555  14.337 -19.207
  304   1HB   GLU  40          HB2       GLU  40  27.079  14.965 -21.477
  305   2HB   GLU  40          HB3       GLU  40  28.382  14.015 -20.768
  306   1HG   GLU  40          HG2       GLU  40  27.682  12.022 -22.018
  307   2HG   GLU  40          HG3       GLU  40  26.248  12.857 -22.626
  308    H    ALA  41           H        ALA  41  24.989  15.564 -20.651
  309    HA   ALA  41           HA       ALA  41  22.875  14.012 -21.940
  310   1HB   ALA  41          HB1       ALA  41  21.946  14.227 -19.703
  311   2HB   ALA  41          HB2       ALA  41  22.406  15.944 -19.610
  312   3HB   ALA  41          HB3       ALA  41  21.143  15.431 -20.736
  313    H    HIS  42           H        HIS  42  22.257  15.129 -23.751
  314    HA   HIS  42           HA       HIS  42  22.792  18.058 -23.943
  315   1HB   HIS  42          HB2       HIS  42  23.390  15.892 -26.003
  316   2HB   HIS  42          HB3       HIS  42  23.278  17.597 -26.404
  317    HD1  HIS  42           HD1      HIS  42  25.066  17.621 -23.220
  318    HD2  HIS  42           HD2      HIS  42  25.911  16.764 -27.254
  319    HE1  HIS  42           HE1      HIS  42  27.587  17.891 -23.497
  320    H    GLY  43           H        GLY  43  20.428  15.885 -23.555
  321   1HA   GLY  43          HA1       GLY  43  18.103  16.442 -23.935
  322   2HA   GLY  43          HA2       GLY  43  18.532  17.155 -25.495
  323    H    LEU  44           H        LEU  44  16.613  15.227 -25.443
  324    HA   LEU  44           HA       LEU  44  17.813  12.617 -25.872
  325   1HB   LEU  44          HB2       LEU  44  15.653  11.724 -25.896
  326   2HB   LEU  44          HB3       LEU  44  15.743  12.878 -24.572
  327    HG   LEU  44           HG       LEU  44  14.343  13.253 -27.255
  328   1HD1  LEU  44          HD11      LEU  44  13.318  12.989 -24.390
  329   2HD1  LEU  44          HD12      LEU  44  12.311  13.176 -25.839
  330   3HD1  LEU  44          HD13      LEU  44  13.297  11.714 -25.615
  331   1HD2  LEU  44          HD21      LEU  44  13.329  15.314 -26.233
  332   2HD2  LEU  44          HD22      LEU  44  14.500  15.203 -24.905
  333   3HD2  LEU  44          HD23      LEU  44  15.039  15.494 -26.586
  334    H    ASN  45           H        ASN  45  17.548  11.330 -27.767
  335    HA   ASN  45           HA       ASN  45  18.339  12.848 -30.072
  336   1HB   ASN  45          HB2       ASN  45  19.208  10.591 -29.342
  337   2HB   ASN  45          HB3       ASN  45  17.685   9.878 -29.856
  338   1HD2  ASN  45          HD22      ASN  45  20.802  10.533 -30.826
  339   2HD2  ASN  45          HD21      ASN  45  20.581  10.516 -32.559
  340    HA   PRO  46           HA       PRO  46  14.199  13.425 -31.790
  341   1HB   PRO  46          HB2       PRO  46  15.684  13.228 -34.418
  342   2HB   PRO  46          HB3       PRO  46  14.415  14.393 -33.929
  343   1HG   PRO  46          HG2       PRO  46  17.024  15.125 -33.886
  344   2HG   PRO  46          HG3       PRO  46  15.945  15.581 -32.528
  345   1HD   PRO  46          HD2       PRO  46  17.952  13.326 -32.657
  346   2HD   PRO  46          HD3       PRO  46  17.598  14.463 -31.319
  347    H    ASN  47           H        ASN  47  16.356  10.826 -33.026
  348    HA   ASN  47           HA       ASN  47  14.218   9.370 -34.361
  349   1HB   ASN  47          HB2       ASN  47  16.898   8.397 -33.340
  350   2HB   ASN  47          HB3       ASN  47  15.816   7.497 -34.393
  351   1HD2  ASN  47          HD22      ASN  47  18.344   9.820 -34.247
  352   2HD2  ASN  47          HD21      ASN  47  18.482  10.100 -35.977
  353    H    ALA  48           H        ALA  48  15.620   9.477 -31.099
  354    HA   ALA  48           HA       ALA  48  14.428   7.053 -30.140
  355   1HB   ALA  48          HB1       ALA  48  14.978   7.897 -27.918
  356   2HB   ALA  48          HB2       ALA  48  16.350   8.193 -28.999
  357   3HB   ALA  48          HB3       ALA  48  15.275   9.522 -28.540
  358    H    VAL  49           H        VAL  49  13.440  10.539 -30.113
  359    HA   VAL  49           HA       VAL  49  10.938  10.129 -28.850
  360    HB   VAL  49           HB       VAL  49  11.590  12.233 -30.965
  361   1HG1  VAL  49          HG11      VAL  49   9.512  12.193 -28.724
  362   2HG1  VAL  49          HG12      VAL  49   9.872  13.579 -29.769
  363   3HG1  VAL  49          HG13      VAL  49   9.178  12.116 -30.471
  364   1HG2  VAL  49          HG21      VAL  49  13.253  12.359 -29.167
  365   2HG2  VAL  49          HG22      VAL  49  12.120  13.699 -29.015
  366   3HG2  VAL  49          HG23      VAL  49  11.963  12.290 -27.947
  367    H    LYS  50           H        LYS  50  11.778  10.059 -32.388
  368    HA   LYS  50           HA       LYS  50   9.148   9.439 -33.231
  369   1HB   LYS  50          HB2       LYS  50  11.793   9.615 -34.446
  370   2HB   LYS  50          HB3       LYS  50  11.017   8.161 -35.017
  371   1HG   LYS  50          HG2       LYS  50   9.921  10.988 -35.208
  372   2HG   LYS  50          HG3       LYS  50  10.589  10.019 -36.515
  373   1HD   LYS  50          HD2       LYS  50   7.948   9.589 -35.067
  374   2HD   LYS  50          HD3       LYS  50   8.209  10.049 -36.748
  375   1HE   LYS  50          HE2       LYS  50   9.280   7.814 -37.171
  376   2HE   LYS  50          HE3       LYS  50   8.938   7.364 -35.495
  377   1HZ   LYS  50          HZ1       LYS  50   6.555   7.718 -36.013
  378   2HZ   LYS  50          HZ2       LYS  50   6.937   7.913 -37.595
  379   3HZ   LYS  50          HZ3       LYS  50   7.230   6.484 -36.835
  380    H    ALA  51           H        ALA  51  11.803   7.261 -32.206
  381    HA   ALA  51           HA       ALA  51  10.543   4.832 -32.902
  382   1HB   ALA  51          HB1       ALA  51  12.143   3.812 -31.338
  383   2HB   ALA  51          HB2       ALA  51  12.948   5.063 -32.300
  384   3HB   ALA  51          HB3       ALA  51  12.494   5.393 -30.618
  385    H    MET  52           H        MET  52  10.401   6.750 -29.840
  386    HA   MET  52           HA       MET  52   8.617   4.878 -28.582
  387   1HB   MET  52          HB2       MET  52   9.076   7.833 -27.998
  388   2HB   MET  52          HB3       MET  52   8.197   6.707 -26.968
  389   1HG   MET  52          HG2       MET  52  11.144   6.765 -27.593
  390   2HG   MET  52          HG3       MET  52  10.342   6.850 -26.040
  391   1HE   MET  52          HE1       MET  52   9.248   3.171 -25.410
  392   2HE   MET  52          HE2       MET  52   9.088   4.871 -24.954
  393   3HE   MET  52          HE3       MET  52   8.294   4.249 -26.436
  394    H    LYS  53           H        LYS  53   8.002   7.832 -30.575
  395    HA   LYS  53           HA       LYS  53   5.181   7.666 -30.302
  396   1HB   LYS  53          HB2       LYS  53   7.076   9.024 -32.149
  397   2HB   LYS  53          HB3       LYS  53   5.536   8.588 -32.880
  398   1HG   LYS  53          HG2       LYS  53   5.163  10.744 -32.032
  399   2HG   LYS  53          HG3       LYS  53   4.347   9.649 -30.920
  400   1HD   LYS  53          HD2       LYS  53   6.523   9.855 -29.457
  401   2HD   LYS  53          HD3       LYS  53   6.925  11.205 -30.531
  402   1HE   LYS  53          HE2       LYS  53   4.311  11.789 -29.956
  403   2HE   LYS  53          HE3       LYS  53   4.738  10.919 -28.475
  404   1HZ   LYS  53          HZ1       LYS  53   6.260  13.254 -29.520
  405   2HZ   LYS  53          HZ2       LYS  53   5.070  13.370 -28.418
  406   3HZ   LYS  53          HZ3       LYS  53   6.416  12.565 -28.027
  407    H    GLU  54           H        GLU  54   7.386   5.657 -32.190
  408    HA   GLU  54           HA       GLU  54   5.440   4.671 -34.011
  409   1HB   GLU  54          HB2       GLU  54   8.040   4.587 -34.097
  410   2HB   GLU  54          HB3       GLU  54   7.887   3.149 -33.094
  411   1HG   GLU  54          HG2       GLU  54   8.109   2.537 -35.430
  412   2HG   GLU  54          HG3       GLU  54   6.524   2.062 -34.833
  413    H    VAL  55           H        VAL  55   5.939   4.083 -30.621
  414    HA   VAL  55           HA       VAL  55   4.091   1.736 -30.741
  415    HB   VAL  55           HB       VAL  55   5.112   1.069 -28.578
  416   1HG1  VAL  55          HG11      VAL  55   5.808   0.089 -30.736
  417   2HG1  VAL  55          HG12      VAL  55   7.042   1.348 -30.926
  418   3HG1  VAL  55          HG13      VAL  55   7.165   0.171 -29.610
  419   1HG2  VAL  55          HG21      VAL  55   6.002   3.358 -27.945
  420   2HG2  VAL  55          HG22      VAL  55   7.177   2.062 -27.793
  421   3HG2  VAL  55          HG23      VAL  55   7.264   3.148 -29.183
  422    H    GLY  56           H        GLY  56   4.035   4.999 -30.134
  423   1HA   GLY  56          HA1       GLY  56   2.105   6.146 -29.555
  424   2HA   GLY  56          HA2       GLY  56   1.424   4.688 -28.813
  425    H    ILE  57           H        ILE  57   4.700   5.956 -28.153
  426    HA   ILE  57           HA       ILE  57   3.893   6.718 -25.392
  427    HB   ILE  57           HB       ILE  57   6.388   5.310 -26.432
  428   1HG1  ILE  57          HG12      ILE  57   4.255   4.426 -24.458
  429   2HG1  ILE  57          HG13      ILE  57   4.431   3.833 -26.105
  430   1HG2  ILE  57          HG21      ILE  57   5.826   6.446 -23.661
  431   2HG2  ILE  57          HG22      ILE  57   7.141   5.318 -24.008
  432   3HG2  ILE  57          HG23      ILE  57   7.147   6.896 -24.767
  433   1HD1  ILE  57          HD11      ILE  57   6.279   3.272 -23.770
  434   2HD1  ILE  57          HD12      ILE  57   5.347   2.139 -24.756
  435   3HD1  ILE  57          HD13      ILE  57   6.731   2.951 -25.468
  436    H    ASP  58           H        ASP  58   5.272   8.432 -24.564
  437    HA   ASP  58           HA       ASP  58   6.668  10.089 -26.588
  438   1HB   ASP  58          HB2       ASP  58   4.604  11.294 -26.114
  439   2HB   ASP  58          HB3       ASP  58   4.817  11.059 -24.365
  440    H    ILE  59           H        ILE  59   8.556  10.950 -25.844
  441    HA   ILE  59           HA       ILE  59   9.293  10.642 -23.005
  442    HB   ILE  59           HB       ILE  59  11.665  10.106 -23.725
  443   1HG1  ILE  59          HG12      ILE  59  10.385   9.224 -26.347
  444   2HG1  ILE  59          HG13      ILE  59  11.300  10.714 -26.171
  445   1HG2  ILE  59          HG21      ILE  59   9.534   8.003 -24.313
  446   2HG2  ILE  59          HG22      ILE  59  11.207   7.711 -23.783
  447   3HG2  ILE  59          HG23      ILE  59  10.063   8.495 -22.702
  448   1HD1  ILE  59          HD11      ILE  59  12.394   7.902 -25.687
  449   2HD1  ILE  59          HD12      ILE  59  12.739   8.962 -27.061
  450   3HD1  ILE  59          HD13      ILE  59  13.292   9.411 -25.444
  451    H    SER  60           H        SER  60   8.519  12.794 -25.339
  452    HA   SER  60           HA       SER  60  10.591  14.758 -25.095
  453   1HB   SER  60          HB2       SER  60   7.659  15.407 -25.445
  454   2HB   SER  60          HB3       SER  60   9.078  16.259 -26.085
  455    HG   SER  60           HG       SER  60   7.900  13.816 -26.846
  456    H    ASN  61           H        ASN  61   7.909  13.762 -23.062
  457    HA   ASN  61           HA       ASN  61   7.825  15.858 -21.183
  458   1HB   ASN  61          HB2       ASN  61   6.669  14.265 -19.743
  459   2HB   ASN  61          HB3       ASN  61   6.106  14.091 -21.395
  460   1HD2  ASN  61          HD22      ASN  61   6.660  12.200 -22.584
  461   2HD2  ASN  61          HD21      ASN  61   7.240  10.745 -21.807
  462    H    GLN  62           H        GLN  62  10.595  13.913 -21.667
  463    HA   GLN  62           HA       GLN  62  11.448  14.261 -18.844
  464   1HB   GLN  62          HB2       GLN  62  12.385  11.902 -18.958
  465   2HB   GLN  62          HB3       GLN  62  10.626  12.027 -18.864
  466   1HG   GLN  62          HG2       GLN  62  10.351  11.548 -21.189
  467   2HG   GLN  62          HG3       GLN  62  12.082  11.776 -21.499
  468   1HE2  GLN  62          HE21      GLN  62  13.310  10.080 -21.659
  469   2HE2  GLN  62          HE22      GLN  62  12.820   8.425 -21.279
  470    H    THR  63           H        THR  63  12.217  16.089 -20.532
  471    HA   THR  63           HA       THR  63  14.392  15.671 -22.196
  472    HB   THR  63           HB       THR  63  14.942  18.114 -21.474
  473    HG1  THR  63           HG1      THR  63  13.413  19.105 -20.224
  474   1HG2  THR  63          HG21      THR  63  13.585  17.498 -23.473
  475   2HG2  THR  63          HG22      THR  63  12.131  17.427 -22.455
  476   3HG2  THR  63          HG23      THR  63  12.978  18.971 -22.702
  477    H    SER  64           H        SER  64  16.507  15.335 -21.990
  478    HA   SER  64           HA       SER  64  17.379  13.818 -20.000
  479   1HB   SER  64          HB2       SER  64  19.105  15.492 -21.850
  480   2HB   SER  64          HB3       SER  64  19.473  13.881 -21.210
  481    HG   SER  64           HG       SER  64  18.470  13.105 -22.823
  482    H    ASP  65           H        ASP  65  19.145  13.842 -18.591
  483    HA   ASP  65           HA       ASP  65  20.382  16.329 -17.734
  484   1HB   ASP  65          HB2       ASP  65  18.231  16.230 -16.400
  485   2HB   ASP  65          HB3       ASP  65  18.779  14.695 -15.719
  486    H    ILE  66           H        ILE  66  22.150  15.855 -16.208
  487    HA   ILE  66           HA       ILE  66  23.500  13.290 -16.695
  488    HB   ILE  66           HB       ILE  66  25.100  14.498 -14.922
  489   1HG1  ILE  66          HG12      ILE  66  23.505  16.537 -14.726
  490   2HG1  ILE  66          HG13      ILE  66  25.236  16.764 -14.853
  491   1HG2  ILE  66          HG21      ILE  66  26.371  15.357 -16.836
  492   2HG2  ILE  66          HG22      ILE  66  25.725  13.730 -17.077
  493   3HG2  ILE  66          HG23      ILE  66  24.931  15.111 -17.868
  494   1HD1  ILE  66          HD11      ILE  66  25.092  17.427 -17.200
  495   2HD1  ILE  66          HD12      ILE  66  23.355  17.099 -17.234
  496   3HD1  ILE  66          HD13      ILE  66  23.991  18.405 -16.219
  497    H    ILE  67           H        ILE  67  24.465  12.244 -14.659
  498    HA   ILE  67           HA       ILE  67  22.398  11.271 -12.992
  499    HB   ILE  67           HB       ILE  67  25.423  11.187 -12.764
  500   1HG1  ILE  67          HG12      ILE  67  23.456   8.939 -13.414
  501   2HG1  ILE  67          HG13      ILE  67  24.167   9.950 -14.661
  502   1HG2  ILE  67          HG21      ILE  67  23.332   9.786 -11.034
  503   2HG2  ILE  67          HG22      ILE  67  25.062   9.375 -11.038
  504   3HG2  ILE  67          HG23      ILE  67  24.537  10.960 -10.489
  505   1HD1  ILE  67          HD11      ILE  67  25.439   7.933 -14.541
  506   2HD1  ILE  67          HD12      ILE  67  26.449   9.260 -13.942
  507   3HD1  ILE  67          HD13      ILE  67  25.704   8.112 -12.799
  508    H    ASP  68           H        ASP  68  21.761  11.791 -10.956
  509    HA   ASP  68           HA       ASP  68  22.959  14.151  -9.600
  510   1HB   ASP  68          HB2       ASP  68  21.006  14.913 -10.943
  511   2HB   ASP  68          HB3       ASP  68  19.981  13.755 -10.087
  512    H    SER  69           H        SER  69  22.955  14.035  -7.403
  513    HA   SER  69           HA       SER  69  23.074  11.598  -6.180
  514   1HB   SER  69          HB2       SER  69  22.500  14.231  -4.797
  515   2HB   SER  69          HB3       SER  69  23.392  12.840  -4.152
  516    HG   SER  69           HG       SER  69  24.784  14.506  -4.923
  517    H    ASP  70           H        ASP  70  20.195  13.557  -6.638
  518    HA   ASP  70           HA       ASP  70  18.746  12.598  -4.352
  519   1HB   ASP  70          HB2       ASP  70  18.296  14.755  -5.494
  520   2HB   ASP  70          HB3       ASP  70  17.724  13.869  -6.915
  521    H    ILE  71           H        ILE  71  19.491  11.153  -7.369
  522    HA   ILE  71           HA       ILE  71  17.328   9.128  -7.035
  523    HB   ILE  71           HB       ILE  71  18.696  10.057  -9.570
  524   1HG1  ILE  71          HG12      ILE  71  15.730  10.449  -9.047
  525   2HG1  ILE  71          HG13      ILE  71  16.854  11.643  -8.415
  526   1HG2  ILE  71          HG21      ILE  71  16.384   8.112  -9.091
  527   2HG2  ILE  71          HG22      ILE  71  16.981   8.631 -10.680
  528   3HG2  ILE  71          HG23      ILE  71  18.029   7.695  -9.613
  529   1HD1  ILE  71          HD11      ILE  71  17.813  12.052 -10.591
  530   2HD1  ILE  71          HD12      ILE  71  16.734  10.837 -11.330
  531   3HD1  ILE  71          HD13      ILE  71  16.053  12.311 -10.609
  532    H    LEU  72           H        LEU  72  20.806   9.714  -7.951
  533    HA   LEU  72           HA       LEU  72  21.391   7.043  -8.435
  534   1HB   LEU  72          HB2       LEU  72  23.644   7.565  -8.479
  535   2HB   LEU  72          HB3       LEU  72  22.821   9.073  -8.867
  536    HG   LEU  72           HG       LEU  72  23.131   9.570  -6.316
  537   1HD1  LEU  72          HD11      LEU  72  24.228   7.402  -5.674
  538   2HD1  LEU  72          HD12      LEU  72  25.561   7.800  -6.777
  539   3HD1  LEU  72          HD13      LEU  72  25.233   8.809  -5.364
  540   1HD2  LEU  72          HD21      LEU  72  25.431   9.710  -8.328
  541   2HD2  LEU  72          HD22      LEU  72  24.108  10.877  -8.191
  542   3HD2  LEU  72          HD23      LEU  72  25.274  10.721  -6.874
  543    H    ASN  73           H        ASN  73  21.383   8.651  -5.268
  544    HA   ASN  73           HA       ASN  73  22.178   6.142  -3.988
  545   1HB   ASN  73          HB2       ASN  73  23.031   7.337  -2.306
  546   2HB   ASN  73          HB3       ASN  73  23.023   8.658  -3.455
  547   1HD2  ASN  73          HD22      ASN  73  20.837  10.081  -3.359
  548   2HD2  ASN  73          HD21      ASN  73  20.192  10.302  -1.757
  549    H    ASN  74           H        ASN  74  19.346   7.070  -5.101
  550    HA   ASN  74           HA       ASN  74  17.706   6.382  -2.685
  551   1HB   ASN  74          HB2       ASN  74  17.727   8.781  -3.269
  552   2HB   ASN  74          HB3       ASN  74  17.323   8.376  -4.931
  553   1HD2  ASN  74          HD22      ASN  74  15.552   9.800  -4.800
  554   2HD2  ASN  74          HD21      ASN  74  14.053   9.316  -4.020
  555    H    ALA  75           H        ALA  75  18.192   5.970  -6.164
  556    HA   ALA  75           HA       ALA  75  15.809   4.593  -6.834
  557   1HB   ALA  75          HB1       ALA  75  17.320   5.585  -8.472
  558   2HB   ALA  75          HB2       ALA  75  18.572   4.393  -8.043
  559   3HB   ALA  75          HB3       ALA  75  17.032   3.863  -8.775
  560    H    ASP  76           H        ASP  76  15.127   2.599  -6.403
  561    HA   ASP  76           HA       ASP  76  16.558   0.944  -4.535
  562   1HB   ASP  76          HB2       ASP  76  14.081   1.048  -4.647
  563   2HB   ASP  76          HB3       ASP  76  14.129   0.312  -6.253
  564    H    LEU  77           H        LEU  77  16.470   1.257  -7.987
  565    HA   LEU  77           HA       LEU  77  18.520  -0.825  -8.279
  566   1HB   LEU  77          HB2       LEU  77  16.460  -2.070  -8.788
  567   2HB   LEU  77          HB3       LEU  77  15.907  -0.775  -9.853
  568    HG   LEU  77           HG       LEU  77  17.799  -1.230 -11.408
  569   1HD1  LEU  77          HD11      LEU  77  18.366  -3.641  -9.623
  570   2HD1  LEU  77          HD12      LEU  77  19.128  -3.271 -11.188
  571   3HD1  LEU  77          HD13      LEU  77  19.435  -2.233  -9.807
  572   1HD2  LEU  77          HD21      LEU  77  16.934  -3.358 -12.282
  573   2HD2  LEU  77          HD22      LEU  77  16.090  -3.652 -10.743
  574   3HD2  LEU  77          HD23      LEU  77  15.629  -2.280 -11.775
  575    H    VAL  78           H        VAL  78  20.014  -0.199  -9.757
  576    HA   VAL  78           HA       VAL  78  19.386   2.047 -11.608
  577    HB   VAL  78           HB       VAL  78  22.034   1.354 -10.250
  578   1HG1  VAL  78          HG11      VAL  78  22.427   2.276 -12.487
  579   2HG1  VAL  78          HG12      VAL  78  21.315   3.624 -12.158
  580   3HG1  VAL  78          HG13      VAL  78  22.843   3.478 -11.264
  581   1HG2  VAL  78          HG21      VAL  78  21.789   3.573  -9.128
  582   2HG2  VAL  78          HG22      VAL  78  20.151   3.716  -9.808
  583   3HG2  VAL  78          HG23      VAL  78  20.531   2.439  -8.641
  584    H    VAL  79           H        VAL  79  20.047   1.589 -13.803
  585    HA   VAL  79           HA       VAL  79  21.347  -1.045 -14.247
  586    HB   VAL  79           HB       VAL  79  19.076  -0.028 -15.957
  587   1HG1  VAL  79          HG11      VAL  79  19.007  -2.294 -16.813
  588   2HG1  VAL  79          HG12      VAL  79  20.647  -1.659 -16.978
  589   3HG1  VAL  79          HG13      VAL  79  20.272  -2.805 -15.679
  590   1HG2  VAL  79          HG21      VAL  79  17.603  -1.768 -14.925
  591   2HG2  VAL  79          HG22      VAL  79  18.822  -1.995 -13.653
  592   3HG2  VAL  79          HG23      VAL  79  17.982  -0.438 -13.834
  593    H    THR  80           H        THR  80  23.047  -0.834 -15.613
  594    HA   THR  80           HA       THR  80  23.292   1.702 -17.170
  595    HB   THR  80           HB       THR  80  25.649   0.624 -17.617
  596    HG1  THR  80           HG1      THR  80  25.142  -1.324 -16.412
  597   1HG2  THR  80          HG21      THR  80  25.201   2.742 -16.470
  598   2HG2  THR  80          HG22      THR  80  24.904   1.873 -14.942
  599   3HG2  THR  80          HG23      THR  80  26.520   1.870 -15.692
  600    H    LEU  81           H        LEU  81  22.945   1.666 -19.273
  601    HA   LEU  81           HA       LEU  81  22.168  -0.941 -20.494
  602   1HB   LEU  81          HB2       LEU  81  21.429   1.939 -21.078
  603   2HB   LEU  81          HB3       LEU  81  21.100   0.642 -22.213
  604    HG   LEU  81           HG       LEU  81  19.680  -0.518 -20.574
  605   1HD1  LEU  81          HD11      LEU  81  20.493   0.244 -18.420
  606   2HD1  LEU  81          HD12      LEU  81  20.164   1.944 -18.833
  607   3HD1  LEU  81          HD13      LEU  81  18.835   0.786 -18.594
  608   1HD2  LEU  81          HD21      LEU  81  17.810   1.175 -20.618
  609   2HD2  LEU  81          HD22      LEU  81  18.973   2.382 -21.185
  610   3HD2  LEU  81          HD23      LEU  81  18.607   0.945 -22.168
  611    H    CYS  82           H        CYS  82  25.014   0.026 -20.170
  612    HA   CYS  82           HA       CYS  82  25.949   0.899 -22.744
  613   1HB   CYS  82          HB2       CYS  82  28.150   0.731 -21.721
  614   2HB   CYS  82          HB3       CYS  82  27.024   1.681 -20.763
  615    H    GLY  83           H        GLY  83  25.646  -0.582 -24.440
  616   1HA   GLY  83          HA1       GLY  83  27.302  -3.090 -24.129
  617   2HA   GLY  83          HA2       GLY  83  25.871  -3.014 -25.135
  618    H    ASP  84           H        ASP  84  26.636  -0.170 -25.940
  619    HA   ASP  84           HA       ASP  84  28.155  -0.534 -28.308
  620   1HB   ASP  84          HB2       ASP  84  26.726   1.394 -27.925
  621   2HB   ASP  84          HB3       ASP  84  27.611   1.815 -26.470
  622    H    ALA  85           H        ALA  85  30.308  -0.792 -28.557
  623    HA   ALA  85           HA       ALA  85  32.047  -1.336 -26.410
  624   1HB   ALA  85          HB1       ALA  85  32.724  -0.589 -29.290
  625   2HB   ALA  85          HB2       ALA  85  33.806  -1.400 -28.140
  626   3HB   ALA  85          HB3       ALA  85  32.339  -2.225 -28.698
  627    H    ALA  86           H        ALA  86  31.149   1.792 -27.712
  628    HA   ALA  86           HA       ALA  86  33.524   3.066 -26.399
  629   1HB   ALA  86          HB1       ALA  86  32.898   5.077 -27.556
  630   2HB   ALA  86          HB2       ALA  86  33.105   3.756 -28.738
  631   3HB   ALA  86          HB3       ALA  86  31.465   4.297 -28.251
  632    H    ASP  87           H        ASP  87  30.297   2.224 -25.628
  633    HA   ASP  87           HA       ASP  87  29.732   4.644 -24.103
  634   1HB   ASP  87          HB2       ASP  87  27.906   3.161 -24.806
  635   2HB   ASP  87          HB3       ASP  87  28.510   1.894 -23.719
  636    H    LYS  88           H        LYS  88  31.261   5.149 -22.734
  637    HA   LYS  88           HA       LYS  88  33.125   3.604 -21.485
  638   1HB   LYS  88          HB2       LYS  88  32.007   6.328 -20.959
  639   2HB   LYS  88          HB3       LYS  88  32.841   5.601 -19.609
  640   1HG   LYS  88          HG2       LYS  88  34.432   6.906 -20.820
  641   2HG   LYS  88          HG3       LYS  88  34.848   5.203 -20.946
  642   1HD   LYS  88          HD2       LYS  88  35.251   6.208 -23.073
  643   2HD   LYS  88          HD3       LYS  88  33.842   5.165 -23.250
  644   1HE   LYS  88          HE2       LYS  88  32.403   7.274 -22.896
  645   2HE   LYS  88          HE3       LYS  88  33.896   8.209 -22.960
  646   1HZ   LYS  88          HZ1       LYS  88  32.815   8.110 -25.123
  647   2HZ   LYS  88          HZ2       LYS  88  34.254   7.349 -25.208
  648   3HZ   LYS  88          HZ3       LYS  88  32.867   6.469 -25.130
  649    H    CYS  89           H        CYS  89  29.798   3.410 -20.622
  650    HA   CYS  89           HA       CYS  89  28.610   2.557 -18.987
  651   1HB   CYS  89          HB2       CYS  89  31.136   1.159 -18.104
  652   2HB   CYS  89          HB3       CYS  89  29.553   0.905 -17.400
  653    HA   PRO  90           HA       PRO  90  29.494   6.147 -16.302
  654   1HB   PRO  90          HB2       PRO  90  26.659   5.430 -15.588
  655   2HB   PRO  90          HB3       PRO  90  27.370   7.056 -15.844
  656   1HG   PRO  90          HG2       PRO  90  25.869   5.868 -17.757
  657   2HG   PRO  90          HG3       PRO  90  27.357   6.765 -18.203
  658   1HD   PRO  90          HD2       PRO  90  26.932   3.802 -17.991
  659   2HD   PRO  90          HD3       PRO  90  27.889   4.741 -19.179
  660    H    MET  91           H        MET  91  30.082   6.270 -14.159
  661    HA   MET  91           HA       MET  91  30.226   3.843 -12.609
  662   1HB   MET  91          HB2       MET  91  30.976   6.735 -11.983
  663   2HB   MET  91          HB3       MET  91  31.283   5.368 -10.909
  664   1HG   MET  91          HG2       MET  91  32.417   5.685 -13.715
  665   2HG   MET  91          HG3       MET  91  33.275   5.998 -12.209
  666   1HE   MET  91          HE1       MET  91  34.336   4.140 -14.597
  667   2HE   MET  91          HE2       MET  91  35.258   4.487 -13.115
  668   3HE   MET  91          HE3       MET  91  35.052   2.809 -13.663
  669    H    THR  92           H        THR  92  29.217   3.489 -10.634
  670    HA   THR  92           HA       THR  92  26.816   5.067  -9.919
  671    HB   THR  92           HB       THR  92  25.912   2.718  -9.453
  672    HG1  THR  92           HG1      THR  92  27.770   1.522  -9.369
  673   1HG2  THR  92          HG21      THR  92  25.315   2.280 -11.748
  674   2HG2  THR  92          HG22      THR  92  25.465   4.036 -11.595
  675   3HG2  THR  92          HG23      THR  92  26.776   3.100 -12.344
  676    HA   PRO  93           HA       PRO  93  28.373   4.769  -5.721
  677   1HB   PRO  93          HB2       PRO  93  26.192   4.144  -4.165
  678   2HB   PRO  93          HB3       PRO  93  26.446   5.752  -4.913
  679   1HG   PRO  93          HG2       PRO  93  24.820   3.436  -5.990
  680   2HG   PRO  93          HG3       PRO  93  24.301   5.135  -5.793
  681   1HD   PRO  93          HD2       PRO  93  25.155   4.191  -8.169
  682   2HD   PRO  93          HD3       PRO  93  25.637   5.823  -7.643
  683    HA   PRO  94           HA       PRO  94  29.452   0.587  -5.393
  684   1HB   PRO  94          HB2       PRO  94  30.640   0.364  -2.954
  685   2HB   PRO  94          HB3       PRO  94  31.250   1.472  -4.220
  686   1HG   PRO  94          HG2       PRO  94  29.402   2.146  -1.902
  687   2HG   PRO  94          HG3       PRO  94  30.922   2.974  -2.376
  688   1HD   PRO  94          HD2       PRO  94  28.472   3.873  -3.184
  689   2HD   PRO  94          HD3       PRO  94  29.905   3.966  -4.256
  690    H    HIS  95           H        HIS  95  26.835   1.503  -3.307
  691    HA   HIS  95           HA       HIS  95  26.465  -1.331  -2.414
  692   1HB   HIS  95          HB2       HIS  95  25.964   1.230  -0.857
  693   2HB   HIS  95          HB3       HIS  95  25.624  -0.401  -0.292
  694    HD1  HIS  95           HD1      HIS  95  28.703  -1.334  -1.563
  695    HD2  HIS  95           HD2      HIS  95  27.569   1.494   1.343
  696    HE1  HIS  95           HE1      HIS  95  30.719  -1.031  -0.034
  697    H    VAL  96           H        VAL  96  25.054   0.863  -4.464
  698    HA   VAL  96           HA       VAL  96  22.270   0.155  -3.716
  699    HB   VAL  96           HB       VAL  96  23.329   1.868  -5.990
  700   1HG1  VAL  96          HG11      VAL  96  20.972   2.645  -6.181
  701   2HG1  VAL  96          HG12      VAL  96  21.157   0.944  -6.598
  702   3HG1  VAL  96          HG13      VAL  96  20.482   1.399  -5.016
  703   1HG2  VAL  96          HG21      VAL  96  23.693   2.960  -3.773
  704   2HG2  VAL  96          HG22      VAL  96  22.395   3.767  -4.653
  705   3HG2  VAL  96          HG23      VAL  96  22.003   2.643  -3.337
  706    H    LYS  97           H        LYS  97  21.068  -1.257  -5.059
  707    HA   LYS  97           HA       LYS  97  22.482  -3.388  -6.329
  708   1HB   LYS  97          HB2       LYS  97  20.198  -3.547  -5.278
  709   2HB   LYS  97          HB3       LYS  97  19.546  -2.593  -6.623
  710   1HG   LYS  97          HG2       LYS  97  20.277  -4.358  -8.220
  711   2HG   LYS  97          HG3       LYS  97  20.961  -5.288  -6.875
  712   1HD   LYS  97          HD2       LYS  97  18.710  -5.485  -5.859
  713   2HD   LYS  97          HD3       LYS  97  18.018  -4.540  -7.197
  714   1HE   LYS  97          HE2       LYS  97  18.777  -6.265  -8.812
  715   2HE   LYS  97          HE3       LYS  97  19.506  -7.191  -7.494
  716   1HZ   LYS  97          HZ1       LYS  97  16.606  -6.637  -7.775
  717   2HZ   LYS  97          HZ2       LYS  97  17.338  -8.060  -8.084
  718   3HZ   LYS  97          HZ3       LYS  97  17.289  -7.493  -6.560
  719    H    ARG  98           H        ARG  98  23.083  -3.640  -8.417
  720    HA   ARG  98           HA       ARG  98  22.210  -1.653 -10.422
  721   1HB   ARG  98          HB2       ARG  98  24.410  -0.962  -9.632
  722   2HB   ARG  98          HB3       ARG  98  25.066  -2.574  -9.963
  723   1HG   ARG  98          HG2       ARG  98  24.714  -2.276 -12.371
  724   2HG   ARG  98          HG3       ARG  98  23.892  -0.720 -12.096
  725   1HD   ARG  98          HD2       ARG  98  25.928   0.245 -11.227
  726   2HD   ARG  98          HD3       ARG  98  26.763  -1.313 -11.282
  727    HE   ARG  98           HE       ARG  98  25.807  -0.690 -13.900
  728   1HH1  ARG  98          HH21      ARG  98  28.163   0.746 -11.679
  729   2HH1  ARG  98          HH22      ARG  98  29.442   0.796 -12.848
  730   1HH2  ARG  98          HH11      ARG  98  27.365  -0.452 -15.453
  731   2HH2  ARG  98          HH12      ARG  98  28.968   0.138 -15.090
  732    H    GLU  99           H        GLU  99  22.062  -2.464 -12.541
  733    HA   GLU  99           HA       GLU  99  22.796  -5.285 -13.044
  734   1HB   GLU  99          HB2       GLU  99  20.101  -3.963 -13.562
  735   2HB   GLU  99          HB3       GLU  99  20.632  -5.347 -14.500
  736   1HG   GLU  99          HG2       GLU  99  20.263  -5.298 -11.479
  737   2HG   GLU  99          HG3       GLU  99  19.147  -5.987 -12.650
  738    H    HIS 100           H        HIS 100  22.727  -5.639 -15.497
  739    HA   HIS 100           HA       HIS 100  23.798  -3.268 -16.941
  740   1HB   HIS 100          HB2       HIS 100  25.707  -4.415 -16.019
  741   2HB   HIS 100          HB3       HIS 100  25.069  -5.991 -16.485
  742    HD1  HIS 100           HD1      HIS 100  26.804  -2.942 -18.084
  743    HD2  HIS 100           HD2      HIS 100  25.469  -6.838 -18.960
  744    HE1  HIS 100           HE1      HIS 100  27.813  -3.558 -20.335
  745    H    TRP 101           H        TRP 101  22.588  -3.046 -18.693
  746    HA   TRP 101           HA       TRP 101  21.391  -5.431 -20.069
  747   1HB   TRP 101          HB2       TRP 101  20.214  -2.677 -19.543
  748   2HB   TRP 101          HB3       TRP 101  19.587  -3.791 -20.740
  749    HD1  TRP 101           HD1      TRP 101  20.432  -5.325 -17.345
  750    HE1  TRP 101           HE1      TRP 101  18.293  -5.888 -16.117
  751    HE3  TRP 101           HE3      TRP 101  17.086  -3.152 -20.560
  752    HZ2  TRP 101           HZ2      TRP 101  15.460  -5.384 -16.415
  753    HZ3  TRP 101           HZ3      TRP 101  14.652  -3.271 -20.089
  754    HH2  TRP 101           HH2      TRP 101  13.842  -4.348 -17.992
  755    H    GLY 102           H        GLY 102  23.769  -5.094 -21.004
  756   1HA   GLY 102          HA1       GLY 102  24.186  -2.718 -22.561
  757   2HA   GLY 102          HA2       GLY 102  25.207  -4.154 -22.527
  758    H    PHE 103           H        PHE 103  23.598  -2.283 -24.562
  759    HA   PHE 103           HA       PHE 103  23.742  -4.230 -26.691
  760   1HB   PHE 103          HB2       PHE 103  21.462  -3.048 -27.563
  761   2HB   PHE 103          HB3       PHE 103  21.543  -4.617 -26.795
  762    HD1  PHE 103           HD1      PHE 103  21.327  -1.019 -25.683
  763    HD2  PHE 103           HD2      PHE 103  19.920  -5.064 -25.181
  764    HE1  PHE 103           HE1      PHE 103  19.816  -0.285 -23.854
  765    HE2  PHE 103           HE2      PHE 103  18.409  -4.316 -23.361
  766    HZ   PHE 103           HZ       PHE 103  18.391  -1.919 -22.672
  767    H    ASP 104           H        ASP 104  23.774  -2.973 -28.813
  768    HA   ASP 104           HA       ASP 104  25.634  -0.823 -28.478
  769   1HB   ASP 104          HB2       ASP 104  25.772  -2.502 -30.288
  770   2HB   ASP 104          HB3       ASP 104  24.268  -1.879 -30.976
  771    H    ASP 105           H        ASP 105  25.423   1.281 -29.488
  772    HA   ASP 105           HA       ASP 105  22.879   2.482 -28.630
  773   1HB   ASP 105          HB2       ASP 105  25.059   3.447 -27.894
  774   2HB   ASP 105          HB3       ASP 105  25.364   3.935 -29.567
  775    HA   PRO 106           HA       PRO 106  21.605   2.367 -32.850
  776   1HB   PRO 106          HB2       PRO 106  19.352   3.973 -32.737
  777   2HB   PRO 106          HB3       PRO 106  19.411   2.273 -32.206
  778   1HG   PRO 106          HG2       PRO 106  19.608   4.753 -30.494
  779   2HG   PRO 106          HG3       PRO 106  18.686   3.254 -30.174
  780   1HD   PRO 106          HD2       PRO 106  21.134   3.760 -29.075
  781   2HD   PRO 106          HD3       PRO 106  20.661   2.104 -29.546
  782    H    ALA 107           H        ALA 107  22.324   5.455 -31.286
  783    HA   ALA 107           HA       ALA 107  22.236   6.990 -33.727
  784   1HB   ALA 107          HB1       ALA 107  23.359   8.731 -32.463
  785   2HB   ALA 107          HB2       ALA 107  22.064   8.036 -31.471
  786   3HB   ALA 107          HB3       ALA 107  23.762   7.597 -31.165
  787    H    ARG 108           H        ARG 108  24.405   4.544 -32.616
  788    HA   ARG 108           HA       ARG 108  26.560   5.594 -34.407
  789   1HB   ARG 108          HB2       ARG 108  27.004   3.636 -32.137
  790   2HB   ARG 108          HB3       ARG 108  28.192   4.479 -33.135
  791   1HG   ARG 108          HG2       ARG 108  27.073   6.658 -32.113
  792   2HG   ARG 108          HG3       ARG 108  26.485   5.541 -30.891
  793   1HD   ARG 108          HD2       ARG 108  29.254   6.562 -31.399
  794   2HD   ARG 108          HD3       ARG 108  28.419   6.270 -29.877
  795    HE   ARG 108           HE       ARG 108  29.017   4.045 -29.860
  796   1HH1  ARG 108          HH21      ARG 108  30.596   5.763 -32.560
  797   2HH1  ARG 108          HH22      ARG 108  31.757   4.520 -32.844
  798   1HH2  ARG 108          HH11      ARG 108  30.504   2.436 -30.235
  799   2HH2  ARG 108          HH12      ARG 108  31.711   2.554 -31.493
  800    H    ALA 109           H        ALA 109  24.041   3.698 -34.767
  801    HA   ALA 109           HA       ALA 109  25.223   1.311 -35.864
  802   1HB   ALA 109          HB1       ALA 109  22.936   1.354 -35.003
  803   2HB   ALA 109          HB2       ALA 109  22.471   2.576 -36.202
  804   3HB   ALA 109          HB3       ALA 109  22.930   0.949 -36.737
  805    H    GLN 110           H        GLN 110  26.944   2.678 -37.012
  806    HA   GLN 110           HA       GLN 110  26.338   4.607 -38.919
  807   1HB   GLN 110          HB2       GLN 110  28.751   2.787 -39.149
  808   2HB   GLN 110          HB3       GLN 110  28.599   4.457 -39.667
  809   1HG   GLN 110          HG2       GLN 110  28.843   3.409 -36.825
  810   2HG   GLN 110          HG3       GLN 110  30.042   4.285 -37.742
  811   1HE2  GLN 110          HE22      GLN 110  29.631   5.267 -35.328
  812   2HE2  GLN 110          HE21      GLN 110  28.732   6.765 -35.392
  813    H    GLY 111           H        GLY 111  25.928   4.647 -41.028
  814   1HA   GLY 111          HA1       GLY 111  26.549   2.920 -43.050
  815   2HA   GLY 111          HA2       GLY 111  24.988   2.301 -42.468
  816    H    THR 112           H        THR 112  23.396   4.258 -41.910
  817    HA   THR 112           HA       THR 112  23.594   6.695 -43.294
  818    HB   THR 112           HB       THR 112  23.192   5.375 -45.331
  819    HG1  THR 112           HG1      THR 112  22.181   7.224 -45.555
  820   1HG2  THR 112          HG21      THR 112  22.105   3.374 -44.432
  821   2HG2  THR 112          HG22      THR 112  20.670   4.329 -44.003
  822   3HG2  THR 112          HG23      THR 112  21.124   4.110 -45.703
  823    H    GLU 113           H        GLU 113  21.395   7.869 -43.070
  824    HA   GLU 113           HA       GLU 113  20.620   7.686 -40.335
  825   1HB   GLU 113          HB2       GLU 113  18.995   9.414 -40.864
  826   2HB   GLU 113          HB3       GLU 113  20.566   9.780 -41.576
  827   1HG   GLU 113          HG2       GLU 113  19.731   8.953 -43.792
  828   2HG   GLU 113          HG3       GLU 113  18.150   8.654 -43.066
  829    H    GLU 114           H        GLU 114  19.315   6.193 -43.265
  830    HA   GLU 114           HA       GLU 114  16.862   5.329 -42.075
  831   1HB   GLU 114          HB2       GLU 114  17.266   5.509 -44.520
  832   2HB   GLU 114          HB3       GLU 114  18.381   4.137 -44.429
  833   1HG   GLU 114          HG2       GLU 114  16.551   2.675 -43.656
  834   2HG   GLU 114          HG3       GLU 114  15.439   4.047 -43.630
  835    H    GLU 115           H        GLU 115  20.132   3.929 -42.256
  836    HA   GLU 115           HA       GLU 115  19.427   1.352 -41.190
  837   1HB   GLU 115          HB2       GLU 115  21.502   1.802 -42.513
  838   2HB   GLU 115          HB3       GLU 115  22.101   2.819 -41.210
  839   1HG   GLU 115          HG2       GLU 115  23.174   0.681 -41.069
  840   2HG   GLU 115          HG3       GLU 115  22.131   0.886 -39.671
  841    H    LYS 116           H        LYS 116  20.705   4.420 -39.838
  842    HA   LYS 116           HA       LYS 116  20.764   3.615 -37.122
  843   1HB   LYS 116          HB2       LYS 116  20.461   6.342 -38.447
  844   2HB   LYS 116          HB3       LYS 116  20.556   6.123 -36.683
  845   1HG   LYS 116          HG2       LYS 116  22.708   4.876 -37.007
  846   2HG   LYS 116          HG3       LYS 116  22.639   5.272 -38.736
  847   1HD   LYS 116          HD2       LYS 116  22.686   7.708 -38.131
  848   2HD   LYS 116          HD3       LYS 116  22.826   7.237 -36.416
  849   1HE   LYS 116          HE2       LYS 116  24.837   5.794 -37.145
  850   2HE   LYS 116          HE3       LYS 116  24.769   6.638 -38.695
  851   1HZ   LYS 116          HZ1       LYS 116  26.350   7.617 -37.205
  852   2HZ   LYS 116          HZ2       LYS 116  25.153   8.717 -37.465
  853   3HZ   LYS 116          HZ3       LYS 116  25.219   7.877 -36.042
  854    H    TRP 117           H        TRP 117  18.091   5.273 -38.928
  855    HA   TRP 117           HA       TRP 117  16.258   5.296 -36.795
  856   1HB   TRP 117          HB2       TRP 117  15.829   6.571 -38.765
  857   2HB   TRP 117          HB3       TRP 117  15.957   5.157 -39.804
  858    HD1  TRP 117           HD1      TRP 117  13.733   4.724 -40.843
  859    HE1  TRP 117           HE1      TRP 117  11.312   4.528 -40.099
  860    HE3  TRP 117           HE3      TRP 117  14.297   6.101 -35.932
  861    HZ2  TRP 117           HZ2      TRP 117   9.794   4.816 -37.625
  862    HZ3  TRP 117           HZ3      TRP 117  12.381   6.054 -34.406
  863    HH2  TRP 117           HH2      TRP 117  10.113   5.387 -35.226
  864    H    ALA 118           H        ALA 118  16.964   2.670 -39.162
  865    HA   ALA 118           HA       ALA 118  14.923   0.937 -38.182
  866   1HB   ALA 118          HB1       ALA 118  16.131  -0.804 -39.443
  867   2HB   ALA 118          HB2       ALA 118  15.893   0.677 -40.394
  868   3HB   ALA 118          HB3       ALA 118  17.488   0.324 -39.693
  869    H    PHE 119           H        PHE 119  18.271   1.555 -37.137
  870    HA   PHE 119           HA       PHE 119  18.295  -0.684 -35.312
  871   1HB   PHE 119          HB2       PHE 119  20.278   0.760 -36.412
  872   2HB   PHE 119          HB3       PHE 119  20.129   1.657 -34.916
  873    HD1  PHE 119           HD1      PHE 119  20.452   0.369 -32.699
  874    HD2  PHE 119           HD2      PHE 119  21.322  -1.377 -36.541
  875    HE1  PHE 119           HE1      PHE 119  21.849  -1.350 -31.598
  876    HE2  PHE 119           HE2      PHE 119  22.699  -3.113 -35.435
  877    HZ   PHE 119           HZ       PHE 119  22.972  -3.103 -32.961
  878    H    PHE 120           H        PHE 120  17.445   2.769 -35.040
  879    HA   PHE 120           HA       PHE 120  17.102   2.856 -32.221
  880   1HB   PHE 120          HB2       PHE 120  15.950   4.421 -34.535
  881   2HB   PHE 120          HB3       PHE 120  15.141   4.534 -32.989
  882    HD1  PHE 120           HD1      PHE 120  16.291   5.386 -30.957
  883    HD2  PHE 120           HD2      PHE 120  18.090   5.593 -34.872
  884    HE1  PHE 120           HE1      PHE 120  17.942   7.047 -30.130
  885    HE2  PHE 120           HE2      PHE 120  19.757   7.209 -34.029
  886    HZ   PHE 120           HZ       PHE 120  19.663   7.959 -31.659
  887    H    GLN 121           H        GLN 121  14.620   2.039 -34.731
  888    HA   GLN 121           HA       GLN 121  12.724   1.341 -32.720
  889   1HB   GLN 121          HB2       GLN 121  11.378   0.373 -34.495
  890   2HB   GLN 121          HB3       GLN 121  12.011   1.966 -34.896
  891   1HG   GLN 121          HG2       GLN 121  13.900   0.637 -36.126
  892   2HG   GLN 121          HG3       GLN 121  12.786  -0.728 -36.053
  893   1HE2  GLN 121          HE22      GLN 121  13.298   2.613 -37.198
  894   2HE2  GLN 121          HE21      GLN 121  12.081   2.592 -38.450
  895    H    ARG 122           H        ARG 122  15.312  -0.647 -34.220
  896    HA   ARG 122           HA       ARG 122  14.381  -3.125 -33.077
  897   1HB   ARG 122          HB2       ARG 122  17.123  -2.165 -34.000
  898   2HB   ARG 122          HB3       ARG 122  16.891  -3.748 -33.259
  899   1HG   ARG 122          HG2       ARG 122  15.335  -4.440 -34.963
  900   2HG   ARG 122          HG3       ARG 122  15.329  -2.840 -35.706
  901   1HD   ARG 122          HD2       ARG 122  17.878  -4.482 -35.472
  902   2HD   ARG 122          HD3       ARG 122  16.740  -4.684 -36.818
  903    HE   ARG 122           HE       ARG 122  17.173  -1.961 -36.645
  904   1HH1  ARG 122          HH21      ARG 122  19.079  -4.843 -37.487
  905   2HH1  ARG 122          HH22      ARG 122  20.151  -3.998 -38.542
  906   1HH2  ARG 122          HH11      ARG 122  18.751  -0.804 -37.965
  907   2HH2  ARG 122          HH12      ARG 122  19.894  -1.689 -38.894
  908    H    VAL 123           H        VAL 123  16.729  -0.653 -31.796
  909    HA   VAL 123           HA       VAL 123  17.152  -2.146 -29.375
  910    HB   VAL 123           HB       VAL 123  17.629   0.762 -30.147
  911   1HG1  VAL 123          HG11      VAL 123  17.484   0.752 -27.720
  912   2HG1  VAL 123          HG12      VAL 123  18.510  -0.694 -27.608
  913   3HG1  VAL 123          HG13      VAL 123  19.184   0.846 -28.185
  914   1HG2  VAL 123          HG21      VAL 123  18.984  -0.996 -31.334
  915   2HG2  VAL 123          HG22      VAL 123  19.970   0.061 -30.317
  916   3HG2  VAL 123          HG23      VAL 123  19.561  -1.574 -29.763
  917    H    ARG 124           H        ARG 124  14.837   0.436 -30.299
  918    HA   ARG 124           HA       ARG 124  13.590   0.902 -27.822
  919   1HB   ARG 124          HB2       ARG 124  13.123   2.179 -29.880
  920   2HB   ARG 124          HB3       ARG 124  12.527   0.735 -30.666
  921   1HG   ARG 124          HG2       ARG 124  10.834   0.917 -28.471
  922   2HG   ARG 124          HG3       ARG 124  11.140   2.600 -28.876
  923   1HD   ARG 124          HD2       ARG 124   9.205   1.936 -30.089
  924   2HD   ARG 124          HD3       ARG 124  10.519   2.048 -31.266
  925    HE   ARG 124           HE       ARG 124  10.063  -0.638 -30.152
  926   1HH1  ARG 124          HH11      ARG 124   9.240   1.604 -32.762
  927   2HH1  ARG 124          HH12      ARG 124   8.577   0.386 -33.793
  928   1HH2  ARG 124          HH21      ARG 124   9.000  -2.277 -31.481
  929   2HH2  ARG 124          HH22      ARG 124   8.475  -1.830 -33.056
  930    H    ASP 125           H        ASP 125  12.787  -1.579 -30.328
  931    HA   ASP 125           HA       ASP 125  10.620  -2.627 -28.858
  932   1HB   ASP 125          HB2       ASP 125  11.242  -2.887 -31.368
  933   2HB   ASP 125          HB3       ASP 125  12.233  -4.255 -30.858
  934    H    GLU 126           H        GLU 126  14.055  -3.693 -29.022
  935    HA   GLU 126           HA       GLU 126  13.747  -5.998 -27.389
  936   1HB   GLU 126          HB2       GLU 126  15.678  -5.450 -28.886
  937   2HB   GLU 126          HB3       GLU 126  16.190  -4.233 -27.715
  938   1HG   GLU 126          HG2       GLU 126  17.474  -6.237 -27.327
  939   2HG   GLU 126          HG3       GLU 126  16.370  -6.013 -25.974
  940    H    ILE 127           H        ILE 127  14.509  -2.573 -26.564
  941    HA   ILE 127           HA       ILE 127  14.820  -2.984 -23.759
  942    HB   ILE 127           HB       ILE 127  14.090  -0.586 -25.481
  943   1HG1  ILE 127          HG12      ILE 127  16.524  -1.214 -23.756
  944   2HG1  ILE 127          HG13      ILE 127  16.447  -1.545 -25.481
  945   1HG2  ILE 127          HG21      ILE 127  14.314   0.879 -23.557
  946   2HG2  ILE 127          HG22      ILE 127  12.989  -0.234 -23.269
  947   3HG2  ILE 127          HG23      ILE 127  14.547  -0.512 -22.467
  948   1HD1  ILE 127          HD11      ILE 127  17.636   0.488 -25.261
  949   2HD1  ILE 127          HD12      ILE 127  16.019   0.951 -25.832
  950   3HD1  ILE 127          HD13      ILE 127  16.468   1.172 -24.124
  951    H    GLY 128           H        GLY 128  11.911  -2.042 -25.702
  952   1HA   GLY 128          HA1       GLY 128  10.042  -1.947 -23.645
  953   2HA   GLY 128          HA2       GLY 128   9.694  -2.467 -25.310
  954    H    ASN 129           H        ASN 129  11.079  -4.844 -25.518
  955    HA   ASN 129           HA       ASN 129   9.380  -6.676 -24.163
  956   1HB   ASN 129          HB2       ASN 129  11.990  -7.029 -25.685
  957   2HB   ASN 129          HB3       ASN 129  11.279  -8.370 -24.802
  958   1HD2  ASN 129          HD22      ASN 129  10.731  -6.134 -27.526
  959   2HD2  ASN 129          HD21      ASN 129   9.534  -7.135 -28.306
  960    H    ARG 130           H        ARG 130  12.797  -5.758 -23.463
  961    HA   ARG 130           HA       ARG 130  12.885  -7.577 -21.285
  962   1HB   ARG 130          HB2       ARG 130  14.776  -6.446 -22.739
  963   2HB   ARG 130          HB3       ARG 130  14.697  -5.151 -21.581
  964   1HG   ARG 130          HG2       ARG 130  16.491  -6.873 -21.182
  965   2HG   ARG 130          HG3       ARG 130  15.453  -6.584 -19.802
  966   1HD   ARG 130          HD2       ARG 130  16.107  -9.027 -20.314
  967   2HD   ARG 130          HD3       ARG 130  14.436  -8.635 -19.894
  968    HE   ARG 130           HE       ARG 130  13.809  -9.721 -21.720
  969   1HH1  ARG 130          HH21      ARG 130  16.896  -8.235 -22.843
  970   2HH1  ARG 130          HH22      ARG 130  16.387  -8.449 -24.515
  971   1HH2  ARG 130          HH11      ARG 130  13.389 -10.049 -23.770
  972   2HH2  ARG 130          HH12      ARG 130  14.494  -9.471 -25.047
  973    H    LEU 131           H        LEU 131  11.841  -4.191 -21.472
  974    HA   LEU 131           HA       LEU 131  11.785  -3.825 -18.626
  975   1HB   LEU 131          HB2       LEU 131  11.334  -2.161 -20.839
  976   2HB   LEU 131          HB3       LEU 131   9.750  -2.336 -20.128
  977    HG   LEU 131           HG       LEU 131  10.750  -0.439 -19.186
  978   1HD1  LEU 131          HD11      LEU 131  10.801  -0.869 -16.778
  979   2HD1  LEU 131          HD12      LEU 131   9.515  -1.829 -17.540
  980   3HD1  LEU 131          HD13      LEU 131  11.042  -2.584 -17.060
  981   1HD2  LEU 131          HD21      LEU 131  13.109  -0.999 -19.754
  982   2HD2  LEU 131          HD22      LEU 131  12.922  -0.318 -18.141
  983   3HD2  LEU 131          HD23      LEU 131  13.173  -2.056 -18.328
  984    H    LYS 132           H        LYS 132   9.375  -4.975 -21.057
  985    HA   LYS 132           HA       LYS 132   7.240  -5.374 -19.258
  986   1HB   LYS 132          HB2       LYS 132   7.070  -5.523 -21.735
  987   2HB   LYS 132          HB3       LYS 132   8.000  -7.017 -21.717
  988   1HG   LYS 132          HG2       LYS 132   6.270  -8.148 -20.401
  989   2HG   LYS 132          HG3       LYS 132   5.330  -6.639 -20.305
  990   1HD   LYS 132          HD2       LYS 132   5.126  -6.612 -22.783
  991   2HD   LYS 132          HD3       LYS 132   6.060  -8.119 -22.877
  992   1HE   LYS 132          HE2       LYS 132   4.330  -9.269 -21.501
  993   2HE   LYS 132          HE3       LYS 132   3.397  -7.770 -21.419
  994   1HZ   LYS 132          HZ1       LYS 132   4.001  -9.264 -23.907
  995   2HZ   LYS 132          HZ2       LYS 132   2.564  -9.235 -23.141
  996   3HZ   LYS 132          HZ3       LYS 132   3.137  -7.877 -23.832
  997    H    GLU 133           H        GLU 133   9.859  -7.608 -20.245
  998    HA   GLU 133           HA       GLU 133   8.983  -9.681 -18.541
  999   1HB   GLU 133          HB2       GLU 133  11.777  -9.172 -19.622
 1000   2HB   GLU 133          HB3       GLU 133  11.235 -10.638 -18.775
 1001   1HG   GLU 133          HG2       GLU 133   9.552 -11.073 -20.487
 1002   2HG   GLU 133          HG3       GLU 133   9.985  -9.604 -21.350
 1003    H    PHE 134           H        PHE 134  11.274  -7.013 -17.895
 1004    HA   PHE 134           HA       PHE 134  12.055  -7.871 -15.320
 1005   1HB   PHE 134          HB2       PHE 134  13.259  -6.128 -16.399
 1006   2HB   PHE 134          HB3       PHE 134  11.815  -5.169 -16.667
 1007    HD1  PHE 134           HD1      PHE 134  14.074  -6.411 -13.937
 1008    HD2  PHE 134           HD2      PHE 134  11.107  -3.525 -15.137
 1009    HE1  PHE 134           HE1      PHE 134  14.487  -5.110 -11.866
 1010    HE2  PHE 134           HE2      PHE 134  11.581  -2.174 -13.122
 1011    HZ   PHE 134           HZ       PHE 134  13.256  -2.990 -11.457
 1012    H    ALA 135           H        ALA 135   9.151  -6.144 -16.405
 1013    HA   ALA 135           HA       ALA 135   8.329  -5.559 -13.697
 1014   1HB   ALA 135          HB1       ALA 135   6.290  -4.663 -14.794
 1015   2HB   ALA 135          HB2       ALA 135   7.744  -4.100 -15.648
 1016   3HB   ALA 135          HB3       ALA 135   6.768  -5.414 -16.332
 1017    H    GLU 136           H        GLU 136   7.561  -7.987 -16.150
 1018    HA   GLU 136           HA       GLU 136   5.322  -9.085 -14.667
 1019   1HB   GLU 136          HB2       GLU 136   5.240  -8.792 -17.105
 1020   2HB   GLU 136          HB3       GLU 136   6.666  -9.803 -17.301
 1021   1HG   GLU 136          HG2       GLU 136   4.783 -11.112 -17.916
 1022   2HG   GLU 136          HG3       GLU 136   5.403 -11.766 -16.412
 1023    H    THR 137           H        THR 137   8.525 -10.186 -15.740
 1024    HA   THR 137           HA       THR 137   8.161 -12.753 -14.325
 1025    HB   THR 137           HB       THR 137   9.662 -13.729 -15.835
 1026    HG1  THR 137           HG1      THR 137  10.267 -11.078 -16.592
 1027   1HG2  THR 137          HG21      THR 137   8.653 -13.426 -17.992
 1028   2HG2  THR 137          HG22      THR 137   7.377 -13.326 -16.760
 1029   3HG2  THR 137          HG23      THR 137   7.995 -11.846 -17.543
 1030    H    GLY 138           H        GLY 138  10.048  -9.802 -14.244
 1031   1HA   GLY 138          HA1       GLY 138  11.471  -9.071 -12.569
 1032   2HA   GLY 138          HA2       GLY 138  11.384 -10.649 -11.782
 1033    H    LYS 139           H        LYS 139  12.192 -10.585 -15.221
 1034    HA   LYS 139           HA       LYS 139  14.733 -11.841 -14.785
 1035   1HB   LYS 139          HB2       LYS 139  13.294 -10.684 -17.187
 1036   2HB   LYS 139          HB3       LYS 139  14.978 -11.228 -17.309
 1037   1HG   LYS 139          HG2       LYS 139  14.379 -13.488 -16.588
 1038   2HG   LYS 139          HG3       LYS 139  12.710 -12.992 -16.296
 1039   1HD   LYS 139          HD2       LYS 139  12.650 -12.283 -18.773
 1040   2HD   LYS 139          HD3       LYS 139  14.183 -13.156 -18.956
 1041   1HE   LYS 139          HE2       LYS 139  13.002 -15.219 -18.073
 1042   2HE   LYS 139          HE3       LYS 139  11.504 -14.272 -18.021
 1043   1HZ   LYS 139          HZ1       LYS 139  11.545 -15.467 -20.062
 1044   2HZ   LYS 139          HZ2       LYS 139  11.831 -13.893 -20.458
 1045   3HZ   LYS 139          HZ3       LYS 139  13.055 -14.977 -20.436
  Start of MODEL    4
    1   1H    MET   1           H1       MET   1   6.422   6.214   2.809
    2   2H    MET   1           H2       MET   1   8.039   6.447   2.811
    3   3H    MET   1           H3       MET   1   7.027   7.716   2.564
    4    HA   MET   1           HA       MET   1   6.257   6.774   0.503
    5   1HB   MET   1          HB2       MET   1   8.161   8.360   0.462
    6   2HB   MET   1          HB3       MET   1   9.299   7.018   0.629
    7   1HG   MET   1          HG2       MET   1   8.539   6.101  -1.544
    8   2HG   MET   1          HG3       MET   1   7.361   7.415  -1.688
    9   1HE   MET   1          HE1       MET   1   8.262   7.984  -4.123
   10   2HE   MET   1          HE2       MET   1   9.977   8.259  -4.497
   11   3HE   MET   1          HE3       MET   1   9.432   6.649  -3.989
   12    H    GLU   2           H        GLU   2   5.681   4.851  -0.396
   13    HA   GLU   2           HA       GLU   2   7.561   2.550  -0.165
   14   1HB   GLU   2          HB2       GLU   2   5.493   2.502   1.343
   15   2HB   GLU   2          HB3       GLU   2   4.530   2.385  -0.127
   16   1HG   GLU   2          HG2       GLU   2   4.863   0.192   0.918
   17   2HG   GLU   2          HG3       GLU   2   5.606   0.215  -0.668
   18    H    ASN   3           H        ASN   3   6.420   4.751  -2.299
   19    HA   ASN   3           HA       ASN   3   5.882   3.038  -4.606
   20   1HB   ASN   3          HB2       ASN   3   5.183   5.529  -4.226
   21   2HB   ASN   3          HB3       ASN   3   6.859   5.930  -4.609
   22   1HD2  ASN   3          HD22      ASN   3   7.641   5.233  -6.856
   23   2HD2  ASN   3          HD21      ASN   3   6.391   5.218  -8.113
   24    H    LYS   4           H        LYS   4   7.551   2.265  -5.967
   25    HA   LYS   4           HA       LYS   4  10.284   2.209  -4.883
   26   1HB   LYS   4          HB2       LYS   4   8.811   0.982  -7.240
   27   2HB   LYS   4          HB3       LYS   4  10.554   1.101  -7.330
   28   1HG   LYS   4          HG2       LYS   4   9.921  -1.069  -6.596
   29   2HG   LYS   4          HG3       LYS   4  10.843  -0.264  -5.341
   30   1HD   LYS   4          HD2       LYS   4   7.829  -0.121  -5.153
   31   2HD   LYS   4          HD3       LYS   4   8.591  -1.692  -4.907
   32   1HE   LYS   4          HE2       LYS   4  10.060  -0.753  -3.154
   33   2HE   LYS   4          HE3       LYS   4   9.286   0.831  -3.349
   34   1HZ   LYS   4          HZ1       LYS   4   7.840  -1.630  -2.543
   35   2HZ   LYS   4          HZ2       LYS   4   8.330  -0.454  -1.502
   36   3HZ   LYS   4          HZ3       LYS   4   7.232  -0.092  -2.631
   37    H    ILE   5           H        ILE   5  12.066   2.609  -6.592
   38    HA   ILE   5           HA       ILE   5  11.629   4.982  -8.257
   39    HB   ILE   5           HB       ILE   5  13.893   4.754  -6.243
   40   1HG1  ILE   5          HG12      ILE   5  12.772   7.066  -5.438
   41   2HG1  ILE   5          HG13      ILE   5  11.307   6.237  -5.940
   42   1HG2  ILE   5          HG21      ILE   5  14.463   7.072  -6.949
   43   2HG2  ILE   5          HG22      ILE   5  14.538   5.954  -8.305
   44   3HG2  ILE   5          HG23      ILE   5  13.133   7.016  -8.125
   45   1HD1  ILE   5          HD11      ILE   5  11.825   5.894  -3.542
   46   2HD1  ILE   5          HD12      ILE   5  11.935   4.339  -4.391
   47   3HD1  ILE   5          HD13      ILE   5  13.408   5.220  -3.974
   48    H    ILE   6           H        ILE   6  13.041   4.803 -10.120
   49    HA   ILE   6           HA       ILE   6  15.080   2.692 -10.099
   50    HB   ILE   6           HB       ILE   6  13.057   1.497 -10.761
   51   1HG1  ILE   6          HG12      ILE   6  14.884   1.882 -13.174
   52   2HG1  ILE   6          HG13      ILE   6  15.298   0.937 -11.740
   53   1HG2  ILE   6          HG21      ILE   6  11.766   3.411 -11.728
   54   2HG2  ILE   6          HG22      ILE   6  12.862   3.393 -13.135
   55   3HG2  ILE   6          HG23      ILE   6  11.798   2.017 -12.797
   56   1HD1  ILE   6          HD11      ILE   6  13.317  -0.520 -12.170
   57   2HD1  ILE   6          HD12      ILE   6  13.039   0.362 -13.693
   58   3HD1  ILE   6          HD13      ILE   6  14.534  -0.556 -13.465
   59    H    TYR   7           H        TYR   7  16.664   2.999 -11.774
   60    HA   TYR   7           HA       TYR   7  16.562   5.644 -13.131
   61   1HB   TYR   7          HB2       TYR   7  17.693   5.495 -10.798
   62   2HB   TYR   7          HB3       TYR   7  18.918   4.523 -11.576
   63    HD1  TYR   7           HD1      TYR   7  20.490   6.137 -10.570
   64    HD2  TYR   7           HD2      TYR   7  17.593   7.426 -13.497
   65    HE1  TYR   7           HE1      TYR   7  21.540   8.383 -10.643
   66    HE2  TYR   7           HE2      TYR   7  18.615   9.654 -13.542
   67    HH   TYR   7           HH       TYR   7  20.172  11.074 -12.551
   68    H    PHE   8           H        PHE   8  17.424   5.608 -15.154
   69    HA   PHE   8           HA       PHE   8  18.847   3.143 -16.097
   70   1HB   PHE   8          HB2       PHE   8  17.004   5.032 -17.627
   71   2HB   PHE   8          HB3       PHE   8  17.913   3.699 -18.330
   72    HD1  PHE   8           HD1      PHE   8  17.504   1.325 -17.339
   73    HD2  PHE   8           HD2      PHE   8  14.787   4.623 -16.838
   74    HE1  PHE   8           HE1      PHE   8  15.687  -0.275 -16.779
   75    HE2  PHE   8           HE2      PHE   8  12.970   3.012 -16.317
   76    HZ   PHE   8           HZ       PHE   8  13.423   0.582 -16.222
   77    H    LEU   9           H        LEU   9  20.798   3.476 -17.106
   78    HA   LEU   9           HA       LEU   9  21.762   6.295 -17.286
   79   1HB   LEU   9          HB2       LEU   9  23.086   3.842 -16.097
   80   2HB   LEU   9          HB3       LEU   9  23.884   5.375 -16.389
   81    HG   LEU   9           HG       LEU   9  21.638   4.870 -14.401
   82   1HD1  LEU   9          HD11      LEU   9  24.570   5.652 -14.033
   83   2HD1  LEU   9          HD12      LEU   9  23.378   5.422 -12.742
   84   3HD1  LEU   9          HD13      LEU   9  23.879   4.043 -13.735
   85   1HD2  LEU   9          HD21      LEU   9  21.301   7.122 -15.212
   86   2HD2  LEU   9          HD22      LEU   9  22.115   7.240 -13.661
   87   3HD2  LEU   9          HD23      LEU   9  23.039   7.462 -15.170
   88    H    CYS  10           H        CYS  10  23.213   6.795 -18.875
   89    HA   CYS  10           HA       CYS  10  24.427   4.640 -20.538
   90   1HB   CYS  10          HB2       CYS  10  22.518   6.828 -21.422
   91   2HB   CYS  10          HB3       CYS  10  23.727   6.240 -22.553
   92    HG   CYS  10           HG       CYS  10  21.931   4.135 -20.810
   93    H    THR  11           H        THR  11  26.019   5.582 -22.143
   94    HA   THR  11           HA       THR  11  27.928   7.341 -21.171
   95    HB   THR  11           HB       THR  11  27.109   6.633 -24.019
   96    HG1  THR  11           HG1      THR  11  27.903   4.737 -23.659
   97   1HG2  THR  11          HG21      THR  11  29.789   7.388 -22.845
   98   2HG2  THR  11          HG22      THR  11  29.570   6.647 -24.455
   99   3HG2  THR  11          HG23      THR  11  28.890   8.252 -24.107
  100    H    GLY  12           H        GLY  12  24.879   8.037 -22.939
  101   1HA   GLY  12          HA1       GLY  12  25.064  10.801 -22.086
  102   2HA   GLY  12          HA2       GLY  12  24.968  10.577 -23.845
  103    H    ASN  13           H        ASN  13  22.969  11.573 -21.741
  104    HA   ASN  13           HA       ASN  13  21.011   9.443 -21.537
  105   1HB   ASN  13          HB2       ASN  13  21.493  11.134 -19.713
  106   2HB   ASN  13          HB3       ASN  13  20.703  12.360 -20.715
  107   1HD2  ASN  13          HD21      ASN  13  19.551   8.897 -20.438
  108   2HD2  ASN  13          HD22      ASN  13  18.109   9.308 -19.585
  109    H    SER  14           H        SER  14  21.095   9.567 -24.162
  110    HA   SER  14           HA       SER  14  18.800  11.321 -24.962
  111   1HB   SER  14          HB2       SER  14  21.359  10.881 -26.536
  112   2HB   SER  14          HB3       SER  14  20.017  11.957 -26.965
  113    HG   SER  14           HG       SER  14  20.442  13.160 -25.100
  114    H    CYS  15           H        CYS  15  19.944   8.103 -25.047
  115    HA   CYS  15           HA       CYS  15  18.087   7.488 -27.304
  116   1HB   CYS  15          HB2       CYS  15  20.890   6.327 -26.911
  117   2HB   CYS  15          HB3       CYS  15  19.734   5.895 -28.188
  118    HG   CYS  15           HG       CYS  15  21.744   7.306 -29.036
  119    H    ARG  16           H        ARG  16  19.977   4.948 -25.955
  120    HA   ARG  16           HA       ARG  16  17.836   3.300 -25.388
  121   1HB   ARG  16          HB2       ARG  16  20.542   3.371 -24.000
  122   2HB   ARG  16          HB3       ARG  16  19.452   2.008 -23.976
  123   1HG   ARG  16          HG2       ARG  16  19.776   1.462 -26.206
  124   2HG   ARG  16          HG3       ARG  16  20.496   3.025 -26.623
  125   1HD   ARG  16          HD2       ARG  16  21.762   0.914 -24.823
  126   2HD   ARG  16          HD3       ARG  16  22.191   1.243 -26.506
  127    HE   ARG  16           HE       ARG  16  22.340   3.542 -24.678
  128   1HH1  ARG  16          HH21      ARG  16  24.201   0.770 -25.927
  129   2HH1  ARG  16          HH22      ARG  16  25.727   1.594 -25.712
  130   1HH2  ARG  16          HH11      ARG  16  24.384   4.580 -24.487
  131   2HH2  ARG  16          HH12      ARG  16  25.835   3.710 -24.904
  132    H    SER  17           H        SER  17  19.531   5.424 -23.009
  133    HA   SER  17           HA       SER  17  18.132   4.469 -20.732
  134   1HB   SER  17          HB2       SER  17  18.965   6.702 -19.769
  135   2HB   SER  17          HB3       SER  17  20.170   5.594 -20.384
  136    HG   SER  17           HG       SER  17  20.644   6.937 -21.991
  137    H    GLN  18           H        GLN  18  17.416   7.135 -22.987
  138    HA   GLN  18           HA       GLN  18  15.137   8.126 -21.513
  139   1HB   GLN  18          HB2       GLN  18  16.206   8.529 -24.338
  140   2HB   GLN  18          HB3       GLN  18  14.676   9.224 -23.834
  141   1HG   GLN  18          HG2       GLN  18  17.279   9.703 -22.333
  142   2HG   GLN  18          HG3       GLN  18  16.683  10.757 -23.608
  143   1HE2  GLN  18          HE22      GLN  18  17.060  11.275 -20.602
  144   2HE2  GLN  18          HE21      GLN  18  15.525  11.986 -20.197
  145    H    MET  19           H        MET  19  15.504   5.958 -24.330
  146    HA   MET  19           HA       MET  19  12.708   5.512 -24.747
  147   1HB   MET  19          HB2       MET  19  15.063   3.661 -25.369
  148   2HB   MET  19          HB3       MET  19  13.407   3.466 -25.947
  149   1HG   MET  19          HG2       MET  19  13.714   5.907 -26.876
  150   2HG   MET  19          HG3       MET  19  15.440   5.554 -26.742
  151   1HE   MET  19          HE1       MET  19  15.985   2.703 -29.332
  152   2HE   MET  19          HE2       MET  19  16.755   3.837 -28.197
  153   3HE   MET  19          HE3       MET  19  15.736   2.511 -27.585
  154    H    ALA  20           H        ALA  20  15.103   3.767 -22.691
  155    HA   ALA  20           HA       ALA  20  13.333   1.731 -21.815
  156   1HB   ALA  20          HB1       ALA  20  15.741   2.962 -20.395
  157   2HB   ALA  20          HB2       ALA  20  14.977   1.407 -20.002
  158   3HB   ALA  20          HB3       ALA  20  15.778   1.627 -21.571
  159    H    GLU  21           H        GLU  21  14.085   4.933 -20.345
  160    HA   GLU  21           HA       GLU  21  12.348   4.660 -18.141
  161   1HB   GLU  21          HB2       GLU  21  13.994   6.520 -18.534
  162   2HB   GLU  21          HB3       GLU  21  12.839   7.236 -19.667
  163   1HG   GLU  21          HG2       GLU  21  11.190   6.988 -17.553
  164   2HG   GLU  21          HG3       GLU  21  12.713   6.930 -16.672
  165    H    GLY  22           H        GLY  22  11.613   5.646 -21.520
  166   1HA   GLY  22          HA1       GLY  22   8.918   6.380 -21.219
  167   2HA   GLY  22          HA2       GLY  22   9.674   5.707 -22.690
  168    H    TRP  23           H        TRP  23  10.293   3.181 -22.152
  169    HA   TRP  23           HA       TRP  23   7.774   1.807 -22.187
  170   1HB   TRP  23          HB2       TRP  23  10.641   0.857 -21.784
  171   2HB   TRP  23          HB3       TRP  23   9.269  -0.237 -21.827
  172    HD1  TRP  23           HD1      TRP  23  11.652   1.463 -24.087
  173    HE1  TRP  23           HE1      TRP  23  11.076   1.021 -26.516
  174    HE3  TRP  23           HE3      TRP  23   6.962  -0.469 -23.437
  175    HZ2  TRP  23           HZ2      TRP  23   8.816  -0.058 -28.037
  176    HZ3  TRP  23           HZ3      TRP  23   5.669  -1.305 -25.376
  177    HH2  TRP  23           HH2      TRP  23   6.599  -1.139 -27.669
  178    H    ALA  24           H        ALA  24  10.250   2.206 -19.629
  179    HA   ALA  24           HA       ALA  24   9.096   0.452 -17.764
  180   1HB   ALA  24          HB1       ALA  24  10.526   1.681 -16.127
  181   2HB   ALA  24          HB2       ALA  24  11.404   1.323 -17.619
  182   3HB   ALA  24          HB3       ALA  24  10.785   2.952 -17.347
  183    H    LYS  25           H        LYS  25   8.604   4.013 -18.148
  184    HA   LYS  25           HA       LYS  25   6.903   4.282 -15.929
  185   1HB   LYS  25          HB2       LYS  25   7.982   6.058 -17.486
  186   2HB   LYS  25          HB3       LYS  25   6.538   5.860 -18.492
  187   1HG   LYS  25          HG2       LYS  25   5.128   6.510 -16.525
  188   2HG   LYS  25          HG3       LYS  25   6.591   6.614 -15.524
  189   1HD   LYS  25          HD2       LYS  25   7.467   8.396 -17.107
  190   2HD   LYS  25          HD3       LYS  25   5.926   8.315 -17.963
  191   1HE   LYS  25          HE2       LYS  25   5.754  10.179 -16.526
  192   2HE   LYS  25          HE3       LYS  25   4.759   8.921 -15.793
  193   1HZ   LYS  25          HZ1       LYS  25   7.527   9.580 -14.942
  194   2HZ   LYS  25          HZ2       LYS  25   6.181  10.121 -14.207
  195   3HZ   LYS  25          HZ3       LYS  25   6.517   8.530 -14.169
  196    H    GLN  26           H        GLN  26   6.133   3.062 -19.166
  197    HA   GLN  26           HA       GLN  26   3.299   2.986 -18.672
  198   1HB   GLN  26          HB2       GLN  26   4.663   1.100 -20.604
  199   2HB   GLN  26          HB3       GLN  26   3.016   1.702 -20.609
  200   1HG   GLN  26          HG2       GLN  26   5.551   3.040 -21.475
  201   2HG   GLN  26          HG3       GLN  26   4.069   2.795 -22.372
  202   1HE2  GLN  26          HE22      GLN  26   5.914   5.149 -20.963
  203   2HE2  GLN  26          HE21      GLN  26   4.669   6.354 -20.659
  204    H    TYR  27           H        TYR  27   5.729   0.335 -18.767
  205    HA   TYR  27           HA       TYR  27   3.865  -1.629 -17.907
  206   1HB   TYR  27          HB2       TYR  27   6.908  -1.636 -17.746
  207   2HB   TYR  27          HB3       TYR  27   5.890  -3.031 -17.437
  208    HD1  TYR  27           HD1      TYR  27   4.095  -3.582 -19.380
  209    HD2  TYR  27           HD2      TYR  27   7.840  -1.514 -19.888
  210    HE1  TYR  27           HE1      TYR  27   4.153  -4.282 -21.756
  211    HE2  TYR  27           HE2      TYR  27   7.973  -2.306 -22.231
  212    HH   TYR  27           HH       TYR  27   6.878  -3.455 -23.942
  213    H    LEU  28           H        LEU  28   6.305   0.201 -16.062
  214    HA   LEU  28           HA       LEU  28   5.669  -1.064 -13.524
  215   1HB   LEU  28          HB2       LEU  28   7.216   1.499 -14.087
  216   2HB   LEU  28          HB3       LEU  28   7.231   0.586 -12.611
  217    HG   LEU  28           HG       LEU  28   8.336  -0.383 -15.274
  218   1HD1  LEU  28          HD11      LEU  28  10.505  -0.117 -14.295
  219   2HD1  LEU  28          HD12      LEU  28   9.626   1.408 -14.064
  220   3HD1  LEU  28          HD13      LEU  28   9.817   0.279 -12.706
  221   1HD2  LEU  28          HD21      LEU  28   8.416  -1.781 -12.572
  222   2HD2  LEU  28          HD22      LEU  28   7.468  -2.302 -13.978
  223   3HD2  LEU  28          HD23      LEU  28   9.224  -2.314 -14.062
  224    H    GLY  29           H        GLY  29   3.945   1.228 -15.323
  225   1HA   GLY  29          HA1       GLY  29   2.196   2.575 -14.871
  226   2HA   GLY  29          HA2       GLY  29   1.940   1.558 -13.441
  227    H    ASP  30           H        ASP  30   4.836   3.463 -13.807
  228    HA   ASP  30           HA       ASP  30   5.904   4.889 -12.504
  229   1HB   ASP  30          HB2       ASP  30   4.196   6.358 -13.625
  230   2HB   ASP  30          HB3       ASP  30   3.327   6.397 -12.086
  231    H    GLU  31           H        GLU  31   4.183   2.610 -11.165
  232    HA   GLU  31           HA       GLU  31   4.028   3.289  -8.382
  233   1HB   GLU  31          HB2       GLU  31   4.426   0.594  -9.725
  234   2HB   GLU  31          HB3       GLU  31   4.055   0.829  -8.027
  235   1HG   GLU  31          HG2       GLU  31   2.269   1.781 -10.288
  236   2HG   GLU  31          HG3       GLU  31   2.124   0.208  -9.507
  237    H    TRP  32           H        TRP  32   6.538   3.118 -10.506
  238    HA   TRP  32           HA       TRP  32   8.651   2.932  -8.486
  239   1HB   TRP  32          HB2       TRP  32   8.859   2.059 -11.399
  240   2HB   TRP  32          HB3       TRP  32  10.113   1.956 -10.184
  241    HD1  TRP  32           HD1      TRP  32   6.500   0.499 -10.477
  242    HE1  TRP  32           HE1      TRP  32   6.507  -1.953  -9.902
  243    HE3  TRP  32           HE3      TRP  32  11.516  -0.084  -9.544
  244    HZ2  TRP  32           HZ2      TRP  32   8.445  -4.006  -9.427
  245    HZ3  TRP  32           HZ3      TRP  32  12.414  -2.349  -9.096
  246    HH2  TRP  32           HH2      TRP  32  10.900  -4.334  -9.115
  247    H    LYS  33           H        LYS  33   9.386   5.062  -8.426
  248    HA   LYS  33           HA       LYS  33   8.595   7.059 -10.334
  249   1HB   LYS  33          HB2       LYS  33  10.650   7.040  -8.066
  250   2HB   LYS  33          HB3       LYS  33  10.245   8.469  -9.024
  251   1HG   LYS  33          HG2       LYS  33   8.564   7.004  -6.994
  252   2HG   LYS  33          HG3       LYS  33   9.107   8.664  -6.965
  253   1HD   LYS  33          HD2       LYS  33   6.969   7.521  -8.819
  254   2HD   LYS  33          HD3       LYS  33   6.708   8.524  -7.392
  255   1HE   LYS  33          HE2       LYS  33   7.963  10.390  -8.464
  256   2HE   LYS  33          HE3       LYS  33   8.197   9.397  -9.909
  257   1HZ   LYS  33          HZ1       LYS  33   5.775   9.314 -10.168
  258   2HZ   LYS  33          HZ2       LYS  33   5.575  10.272  -8.849
  259   3HZ   LYS  33          HZ3       LYS  33   6.313  10.864 -10.175
  260    H    VAL  34           H        VAL  34   9.325   6.609 -12.370
  261    HA   VAL  34           HA       VAL  34  11.903   5.449 -12.783
  262    HB   VAL  34           HB       VAL  34  10.197   6.610 -14.988
  263   1HG1  VAL  34          HG11      VAL  34  11.486   3.875 -14.867
  264   2HG1  VAL  34          HG12      VAL  34  11.067   4.868 -16.275
  265   3HG1  VAL  34          HG13      VAL  34  12.461   5.298 -15.261
  266   1HG2  VAL  34          HG21      VAL  34   8.453   5.487 -13.759
  267   2HG2  VAL  34          HG22      VAL  34   8.927   4.454 -15.105
  268   3HG2  VAL  34          HG23      VAL  34   9.495   4.068 -13.474
  269    H    TYR  35           H        TYR  35  13.766   6.433 -13.444
  270    HA   TYR  35           HA       TYR  35  13.789   9.289 -14.275
  271   1HB   TYR  35          HB2       TYR  35  15.494   7.962 -12.123
  272   2HB   TYR  35          HB3       TYR  35  15.898   9.498 -12.866
  273    HD1  TYR  35           HD1      TYR  35  13.824   7.845 -10.372
  274    HD2  TYR  35           HD2      TYR  35  14.461  11.519 -12.540
  275    HE1  TYR  35           HE1      TYR  35  12.498   9.079  -8.676
  276    HE2  TYR  35           HE2      TYR  35  13.126  12.754 -10.866
  277    HH   TYR  35           HH       TYR  35  11.886  12.611  -8.893
  278    H    SER  36           H        SER  36  15.966   9.827 -15.281
  279    HA   SER  36           HA       SER  36  17.462   7.556 -16.370
  280   1HB   SER  36          HB2       SER  36  15.364   8.069 -17.762
  281   2HB   SER  36          HB3       SER  36  16.161   9.601 -18.194
  282    HG   SER  36           HG       SER  36  16.467   7.158 -19.208
  283    H    ALA  37           H        ALA  37  19.547   8.228 -17.024
  284    HA   ALA  37           HA       ALA  37  20.299  11.001 -17.321
  285   1HB   ALA  37          HB1       ALA  37  21.271   9.569 -14.816
  286   2HB   ALA  37          HB2       ALA  37  21.811  11.162 -15.393
  287   3HB   ALA  37          HB3       ALA  37  20.154  10.954 -14.867
  288    H    GLY  38           H        GLY  38  23.018  10.946 -16.987
  289   1HA   GLY  38          HA1       GLY  38  24.371   8.557 -17.664
  290   2HA   GLY  38          HA2       GLY  38  24.049   9.478 -19.147
  291    H    ILE  39           H        ILE  39  26.578   9.236 -18.874
  292    HA   ILE  39           HA       ILE  39  28.051  10.953 -17.188
  293    HB   ILE  39           HB       ILE  39  28.419   9.479 -19.768
  294   1HG1  ILE  39          HG12      ILE  39  30.166   9.649 -17.286
  295   2HG1  ILE  39          HG13      ILE  39  28.811   8.538 -17.488
  296   1HG2  ILE  39          HG21      ILE  39  30.658  10.357 -20.224
  297   2HG2  ILE  39          HG22      ILE  39  29.434  11.587 -20.432
  298   3HG2  ILE  39          HG23      ILE  39  30.439  11.587 -18.956
  299   1HD1  ILE  39          HD11      ILE  39  29.903   7.523 -19.458
  300   2HD1  ILE  39          HD12      ILE  39  31.343   8.546 -19.192
  301   3HD1  ILE  39          HD13      ILE  39  30.871   7.367 -17.975
  302    H    GLU  40           H        GLU  40  26.085  11.708 -20.021
  303    HA   GLU  40           HA       GLU  40  26.408  14.508 -19.464
  304   1HB   GLU  40          HB2       GLU  40  26.898  15.196 -21.730
  305   2HB   GLU  40          HB3       GLU  40  28.213  14.230 -21.070
  306   1HG   GLU  40          HG2       GLU  40  27.444  12.253 -22.343
  307   2HG   GLU  40          HG3       GLU  40  26.057  13.149 -22.955
  308    H    ALA  41           H        ALA  41  24.777  15.772 -20.814
  309    HA   ALA  41           HA       ALA  41  22.725  14.264 -22.203
  310   1HB   ALA  41          HB1       ALA  41  22.079  15.899 -19.696
  311   2HB   ALA  41          HB2       ALA  41  20.886  15.238 -20.831
  312   3HB   ALA  41          HB3       ALA  41  21.899  14.140 -19.863
  313    H    HIS  42           H        HIS  42  21.884  15.597 -23.784
  314    HA   HIS  42           HA       HIS  42  22.103  18.558 -23.493
  315   1HB   HIS  42          HB2       HIS  42  22.752  16.886 -25.963
  316   2HB   HIS  42          HB3       HIS  42  22.490  18.621 -25.995
  317    HD1  HIS  42           HD1      HIS  42  24.500  18.281 -23.003
  318    HD2  HIS  42           HD2      HIS  42  25.122  18.023 -27.158
  319    HE1  HIS  42           HE1      HIS  42  26.981  18.737 -23.385
  320    H    GLY  43           H        GLY  43  20.062  15.941 -23.611
  321   1HA   GLY  43          HA1       GLY  43  17.601  16.646 -23.877
  322   2HA   GLY  43          HA2       GLY  43  18.105  17.092 -25.521
  323    H    LEU  44           H        LEU  44  16.518  15.372 -26.104
  324    HA   LEU  44           HA       LEU  44  17.743  12.682 -26.022
  325   1HB   LEU  44          HB2       LEU  44  15.640  11.633 -25.902
  326   2HB   LEU  44          HB3       LEU  44  15.728  12.802 -24.587
  327    HG   LEU  44           HG       LEU  44  14.146  12.988 -27.174
  328   1HD1  LEU  44          HD11      LEU  44  12.231  12.759 -25.728
  329   2HD1  LEU  44          HD12      LEU  44  13.370  11.481 -25.293
  330   3HD1  LEU  44          HD13      LEU  44  13.220  12.908 -24.261
  331   1HD2  LEU  44          HD21      LEU  44  14.328  15.076 -24.955
  332   2HD2  LEU  44          HD22      LEU  44  14.707  15.302 -26.686
  333   3HD2  LEU  44          HD23      LEU  44  13.048  15.025 -26.186
  334    H    ASN  45           H        ASN  45  17.433  11.343 -27.854
  335    HA   ASN  45           HA       ASN  45  18.127  12.852 -30.180
  336   1HB   ASN  45          HB2       ASN  45  19.071  10.635 -29.420
  337   2HB   ASN  45          HB3       ASN  45  17.571   9.866 -29.920
  338   1HD2  ASN  45          HD22      ASN  45  20.665  10.599 -30.902
  339   2HD2  ASN  45          HD21      ASN  45  20.445  10.528 -32.635
  340    HA   PRO  46           HA       PRO  46  13.980  13.267 -31.923
  341   1HB   PRO  46          HB2       PRO  46  15.483  13.036 -34.541
  342   2HB   PRO  46          HB3       PRO  46  14.179  14.181 -34.089
  343   1HG   PRO  46          HG2       PRO  46  16.767  14.984 -34.058
  344   2HG   PRO  46          HG3       PRO  46  15.670  15.450 -32.718
  345   1HD   PRO  46          HD2       PRO  46  17.739  13.247 -32.775
  346   2HD   PRO  46          HD3       PRO  46  17.349  14.413 -31.471
  347    H    ASN  47           H        ASN  47  16.218  10.690 -33.064
  348    HA   ASN  47           HA       ASN  47  14.109   9.144 -34.356
  349   1HB   ASN  47          HB2       ASN  47  16.833   8.297 -33.351
  350   2HB   ASN  47          HB3       ASN  47  15.771   7.329 -34.364
  351   1HD2  ASN  47          HD22      ASN  47  18.232   9.705 -34.320
  352   2HD2  ASN  47          HD21      ASN  47  18.330   9.957 -36.056
  353    H    ALA  48           H        ALA  48  15.539   9.374 -31.111
  354    HA   ALA  48           HA       ALA  48  14.435   6.935 -30.082
  355   1HB   ALA  48          HB1       ALA  48  15.149   9.480 -28.534
  356   2HB   ALA  48          HB2       ALA  48  14.958   7.847 -27.887
  357   3HB   ALA  48          HB3       ALA  48  16.310   8.220 -28.969
  358    H    VAL  49           H        VAL  49  13.375  10.385 -30.093
  359    HA   VAL  49           HA       VAL  49  10.882   9.993 -28.864
  360    HB   VAL  49           HB       VAL  49  11.627  12.023 -31.016
  361   1HG1  VAL  49          HG11      VAL  49   9.310  12.009 -29.032
  362   2HG1  VAL  49          HG12      VAL  49   9.785  13.389 -30.044
  363   3HG1  VAL  49          HG13      VAL  49   9.185  11.913 -30.801
  364   1HG2  VAL  49          HG21      VAL  49  11.662  12.228 -27.976
  365   2HG2  VAL  49          HG22      VAL  49  13.091  12.165 -29.031
  366   3HG2  VAL  49          HG23      VAL  49  12.002  13.549 -29.111
  367    H    LYS  50           H        LYS  50  11.655   9.944 -32.430
  368    HA   LYS  50           HA       LYS  50   9.055   9.201 -33.265
  369   1HB   LYS  50          HB2       LYS  50  11.799   8.657 -34.488
  370   2HB   LYS  50          HB3       LYS  50  10.318   8.191 -35.289
  371   1HG   LYS  50          HG2       LYS  50  11.061  11.049 -34.526
  372   2HG   LYS  50          HG3       LYS  50  11.230  10.334 -36.123
  373   1HD   LYS  50          HD2       LYS  50   8.616  10.877 -34.650
  374   2HD   LYS  50          HD3       LYS  50   9.273  11.758 -36.029
  375   1HE   LYS  50          HE2       LYS  50   9.135   9.665 -37.408
  376   2HE   LYS  50          HE3       LYS  50   8.373   8.838 -36.043
  377   1HZ   LYS  50          HZ1       LYS  50   6.550  10.446 -36.182
  378   2HZ   LYS  50          HZ2       LYS  50   7.259  11.199 -37.449
  379   3HZ   LYS  50          HZ3       LYS  50   6.732   9.667 -37.602
  380    H    ALA  51           H        ALA  51  11.754   7.085 -32.207
  381    HA   ALA  51           HA       ALA  51  10.513   4.653 -32.940
  382   1HB   ALA  51          HB1       ALA  51  12.474   5.208 -30.664
  383   2HB   ALA  51          HB2       ALA  51  12.128   3.629 -31.397
  384   3HB   ALA  51          HB3       ALA  51  12.914   4.894 -32.353
  385    H    MET  52           H        MET  52  10.373   6.538 -29.856
  386    HA   MET  52           HA       MET  52   8.617   4.628 -28.595
  387   1HB   MET  52          HB2       MET  52   9.115   7.568 -27.974
  388   2HB   MET  52          HB3       MET  52   8.219   6.450 -26.951
  389   1HG   MET  52          HG2       MET  52  11.163   6.387 -27.643
  390   2HG   MET  52          HG3       MET  52  10.413   6.584 -26.074
  391   1HE   MET  52          HE1       MET  52   9.107   2.988 -25.282
  392   2HE   MET  52          HE2       MET  52   9.011   4.716 -24.923
  393   3HE   MET  52          HE3       MET  52   8.200   4.042 -26.374
  394    H    LYS  53           H        LYS  53   7.993   7.599 -30.530
  395    HA   LYS  53           HA       LYS  53   5.177   7.504 -30.184
  396   1HB   LYS  53          HB2       LYS  53   6.921   8.539 -32.427
  397   2HB   LYS  53          HB3       LYS  53   5.181   8.785 -32.400
  398   1HG   LYS  53          HG2       LYS  53   6.708   9.611 -29.927
  399   2HG   LYS  53          HG3       LYS  53   6.960  10.563 -31.388
  400   1HD   LYS  53          HD2       LYS  53   5.257  11.603 -30.060
  401   2HD   LYS  53          HD3       LYS  53   4.536  10.998 -31.557
  402   1HE   LYS  53          HE2       LYS  53   3.665   9.015 -30.323
  403   2HE   LYS  53          HE3       LYS  53   4.409   9.619 -28.835
  404   1HZ   LYS  53          HZ1       LYS  53   2.263  10.992 -30.354
  405   2HZ   LYS  53          HZ2       LYS  53   2.066  10.195 -28.949
  406   3HZ   LYS  53          HZ3       LYS  53   2.949  11.564 -28.987
  407    H    GLU  54           H        GLU  54   7.299   5.493 -32.161
  408    HA   GLU  54           HA       GLU  54   5.280   4.574 -33.945
  409   1HB   GLU  54          HB2       GLU  54   7.844   4.474 -34.188
  410   2HB   GLU  54          HB3       GLU  54   7.768   3.052 -33.147
  411   1HG   GLU  54          HG2       GLU  54   7.856   2.356 -35.445
  412   2HG   GLU  54          HG3       GLU  54   6.279   1.941 -34.796
  413    H    VAL  55           H        VAL  55   5.890   3.928 -30.578
  414    HA   VAL  55           HA       VAL  55   4.040   1.579 -30.689
  415    HB   VAL  55           HB       VAL  55   5.077   0.886 -28.560
  416   1HG1  VAL  55          HG11      VAL  55   5.801  -0.034 -30.735
  417   2HG1  VAL  55          HG12      VAL  55   7.018   1.247 -30.890
  418   3HG1  VAL  55          HG13      VAL  55   7.150   0.043 -29.600
  419   1HG2  VAL  55          HG21      VAL  55   7.109   1.894 -27.727
  420   2HG2  VAL  55          HG22      VAL  55   7.210   2.992 -29.105
  421   3HG2  VAL  55          HG23      VAL  55   5.929   3.188 -27.879
  422    H    GLY  56           H        GLY  56   4.010   4.846 -30.012
  423   1HA   GLY  56          HA1       GLY  56   2.065   5.976 -29.419
  424   2HA   GLY  56          HA2       GLY  56   1.400   4.510 -28.678
  425    H    ILE  57           H        ILE  57   4.684   5.827 -28.065
  426    HA   ILE  57           HA       ILE  57   3.886   6.663 -25.325
  427    HB   ILE  57           HB       ILE  57   6.331   5.132 -26.298
  428   1HG1  ILE  57          HG12      ILE  57   4.309   4.410 -24.137
  429   2HG1  ILE  57          HG13      ILE  57   4.257   3.794 -25.784
  430   1HG2  ILE  57          HG21      ILE  57   5.880   6.461 -23.589
  431   2HG2  ILE  57          HG22      ILE  57   7.154   5.274 -23.891
  432   3HG2  ILE  57          HG23      ILE  57   7.184   6.796 -24.752
  433   1HD1  ILE  57          HD11      ILE  57   6.452   3.206 -23.770
  434   2HD1  ILE  57          HD12      ILE  57   5.224   2.104 -24.402
  435   3HD1  ILE  57          HD13      ILE  57   6.477   2.721 -25.480
  436    H    ASP  58           H        ASP  58   5.377   8.390 -24.601
  437    HA   ASP  58           HA       ASP  58   6.836   9.817 -26.724
  438   1HB   ASP  58          HB2       ASP  58   4.843  11.181 -26.627
  439   2HB   ASP  58          HB3       ASP  58   4.828  11.134 -24.851
  440    H    ILE  59           H        ILE  59   8.654  10.745 -25.922
  441    HA   ILE  59           HA       ILE  59   9.281  10.401 -23.044
  442    HB   ILE  59           HB       ILE  59  11.642   9.863 -23.770
  443   1HG1  ILE  59          HG12      ILE  59  10.384   9.092 -26.438
  444   2HG1  ILE  59          HG13      ILE  59  11.315  10.564 -26.202
  445   1HG2  ILE  59          HG21      ILE  59  11.123   7.472 -23.941
  446   2HG2  ILE  59          HG22      ILE  59   9.974   8.236 -22.849
  447   3HG2  ILE  59          HG23      ILE  59   9.470   7.834 -24.490
  448   1HD1  ILE  59          HD11      ILE  59  12.378   7.730 -25.798
  449   2HD1  ILE  59          HD12      ILE  59  12.719   8.817 -27.149
  450   3HD1  ILE  59          HD13      ILE  59  13.293   9.223 -25.535
  451    H    SER  60           H        SER  60   8.825  12.579 -25.568
  452    HA   SER  60           HA       SER  60  10.909  14.467 -25.173
  453   1HB   SER  60          HB2       SER  60   8.036  15.186 -25.807
  454   2HB   SER  60          HB3       SER  60   9.525  15.980 -26.349
  455    HG   SER  60           HG       SER  60   8.331  13.548 -27.128
  456    H    ASN  61           H        ASN  61   7.818  13.933 -23.540
  457    HA   ASN  61           HA       ASN  61   7.841  16.065 -21.716
  458   1HB   ASN  61          HB2       ASN  61   6.265  14.794 -20.420
  459   2HB   ASN  61          HB3       ASN  61   5.925  14.493 -22.119
  460   1HD2  ASN  61          HD22      ASN  61   6.524  12.404 -23.028
  461   2HD2  ASN  61          HD21      ASN  61   6.826  11.009 -22.011
  462    H    GLN  62           H        GLN  62  10.119  13.390 -21.737
  463    HA   GLN  62           HA       GLN  62  10.382  13.324 -18.803
  464   1HB   GLN  62          HB2       GLN  62  12.068  12.016 -20.971
  465   2HB   GLN  62          HB3       GLN  62  12.143  11.678 -19.244
  466   1HG   GLN  62          HG2       GLN  62   9.807  10.857 -19.291
  467   2HG   GLN  62          HG3       GLN  62   9.726  11.162 -21.023
  468   1HE2  GLN  62          HE22      GLN  62  12.625  10.141 -21.474
  469   2HE2  GLN  62          HE21      GLN  62  12.378   8.406 -21.440
  470    H    THR  63           H        THR  63  12.139  14.478 -21.646
  471    HA   THR  63           HA       THR  63  14.006  15.614 -22.026
  472    HB   THR  63           HB       THR  63  14.602  17.547 -20.664
  473    HG1  THR  63           HG1      THR  63  13.008  16.286 -18.811
  474   1HG2  THR  63          HG21      THR  63  12.769  17.708 -22.326
  475   2HG2  THR  63          HG22      THR  63  11.587  17.336 -21.054
  476   3HG2  THR  63          HG23      THR  63  12.556  18.821 -20.966
  477    H    SER  64           H        SER  64  16.356  16.224 -20.931
  478    HA   SER  64           HA       SER  64  17.233  13.684 -19.676
  479   1HB   SER  64          HB2       SER  64  18.518  15.269 -21.933
  480   2HB   SER  64          HB3       SER  64  19.095  13.749 -21.242
  481    HG   SER  64           HG       SER  64  18.006  12.958 -22.785
  482    H    ASP  65           H        ASP  65  19.248  13.810 -18.529
  483    HA   ASP  65           HA       ASP  65  20.385  16.400 -17.850
  484   1HB   ASP  65          HB2       ASP  65  18.277  16.265 -16.443
  485   2HB   ASP  65          HB3       ASP  65  18.931  14.806 -15.696
  486    H    ILE  66           H        ILE  66  22.201  16.095 -16.325
  487    HA   ILE  66           HA       ILE  66  23.617  13.546 -16.711
  488    HB   ILE  66           HB       ILE  66  25.262  14.844 -15.091
  489   1HG1  ILE  66          HG12      ILE  66  23.615  16.850 -14.866
  490   2HG1  ILE  66          HG13      ILE  66  25.336  17.116 -15.057
  491   1HG2  ILE  66          HG21      ILE  66  25.790  14.041 -17.264
  492   2HG2  ILE  66          HG22      ILE  66  24.929  15.390 -18.040
  493   3HG2  ILE  66          HG23      ILE  66  26.414  15.685 -17.092
  494   1HD1  ILE  66          HD11      ILE  66  24.000  18.700 -16.405
  495   2HD1  ILE  66          HD12      ILE  66  25.092  17.732 -17.406
  496   3HD1  ILE  66          HD13      ILE  66  23.363  17.358 -17.373
  497    H    ILE  67           H        ILE  67  24.565  12.534 -14.768
  498    HA   ILE  67           HA       ILE  67  22.528  11.548 -13.125
  499    HB   ILE  67           HB       ILE  67  25.558  11.375 -13.044
  500   1HG1  ILE  67          HG12      ILE  67  23.403   9.330 -13.748
  501   2HG1  ILE  67          HG13      ILE  67  24.186  10.352 -14.944
  502   1HG2  ILE  67          HG21      ILE  67  25.349   9.471 -11.485
  503   2HG2  ILE  67          HG22      ILE  67  24.805  10.955 -10.729
  504   3HG2  ILE  67          HG23      ILE  67  23.603   9.784 -11.326
  505   1HD1  ILE  67          HD11      ILE  67  26.404   9.377 -14.282
  506   2HD1  ILE  67          HD12      ILE  67  25.510   8.184 -13.298
  507   3HD1  ILE  67          HD13      ILE  67  25.252   8.265 -15.045
  508    H    ASP  68           H        ASP  68  22.103  11.728 -10.940
  509    HA   ASP  68           HA       ASP  68  23.399  13.891  -9.390
  510   1HB   ASP  68          HB2       ASP  68  21.287  14.776 -10.511
  511   2HB   ASP  68          HB3       ASP  68  20.374  13.628  -9.524
  512    H    SER  69           H        SER  69  23.703  13.349  -7.293
  513    HA   SER  69           HA       SER  69  23.588  10.757  -6.366
  514   1HB   SER  69          HB2       SER  69  23.555  13.272  -4.676
  515   2HB   SER  69          HB3       SER  69  24.259  11.696  -4.262
  516    HG   SER  69           HG       SER  69  25.834  13.207  -4.993
  517    H    ASP  70           H        ASP  70  21.022  13.158  -6.325
  518    HA   ASP  70           HA       ASP  70  19.557  12.133  -4.080
  519   1HB   ASP  70          HB2       ASP  70  19.397  14.460  -4.928
  520   2HB   ASP  70          HB3       ASP  70  18.637  13.857  -6.407
  521    H    ILE  71           H        ILE  71  19.993  10.922  -7.230
  522    HA   ILE  71           HA       ILE  71  17.559   9.217  -7.011
  523    HB   ILE  71           HB       ILE  71  19.126   9.936  -9.502
  524   1HG1  ILE  71          HG12      ILE  71  16.257  10.827  -9.100
  525   2HG1  ILE  71          HG13      ILE  71  17.520  11.800  -8.363
  526   1HG2  ILE  71          HG21      ILE  71  16.506   8.411  -9.068
  527   2HG2  ILE  71          HG22      ILE  71  17.214   8.818 -10.647
  528   3HG2  ILE  71          HG23      ILE  71  18.066   7.722  -9.556
  529   1HD1  ILE  71          HD11      ILE  71  18.662  12.105 -10.475
  530   2HD1  ILE  71          HD12      ILE  71  17.442  11.107 -11.315
  531   3HD1  ILE  71          HD13      ILE  71  16.979  12.655 -10.574
  532    H    LEU  72           H        LEU  72  21.079   9.340  -7.849
  533    HA   LEU  72           HA       LEU  72  21.623   6.632  -8.133
  534   1HB   LEU  72          HB2       LEU  72  23.237   8.697  -6.584
  535   2HB   LEU  72          HB3       LEU  72  23.821   7.080  -6.889
  536    HG   LEU  72           HG       LEU  72  23.174   9.075  -9.069
  537   1HD1  LEU  72          HD11      LEU  72  25.711   9.176  -9.219
  538   2HD1  LEU  72          HD12      LEU  72  25.042   9.850  -7.730
  539   3HD1  LEU  72          HD13      LEU  72  25.785   8.239  -7.722
  540   1HD2  LEU  72          HD21      LEU  72  24.456   7.462 -10.503
  541   2HD2  LEU  72          HD22      LEU  72  24.596   6.358  -9.124
  542   3HD2  LEU  72          HD23      LEU  72  23.012   6.703  -9.837
  543    H    ASN  73           H        ASN  73  21.797   8.344  -4.995
  544    HA   ASN  73           HA       ASN  73  22.079   5.861  -3.582
  545   1HB   ASN  73          HB2       ASN  73  22.712   7.089  -1.792
  546   2HB   ASN  73          HB3       ASN  73  22.953   8.337  -2.999
  547   1HD2  ASN  73          HD22      ASN  73  20.880   9.835  -3.326
  548   2HD2  ASN  73          HD21      ASN  73  19.995  10.214  -1.865
  549    H    ASN  74           H        ASN  74  19.343   7.017  -4.906
  550    HA   ASN  74           HA       ASN  74  17.526   6.425  -2.603
  551   1HB   ASN  74          HB2       ASN  74  17.720   8.773  -3.383
  552   2HB   ASN  74          HB3       ASN  74  17.340   8.252  -5.019
  553   1HD2  ASN  74          HD22      ASN  74  15.776   9.996  -4.785
  554   2HD2  ASN  74          HD21      ASN  74  14.189   9.618  -4.126
  555    H    ALA  75           H        ALA  75  18.228   5.822  -6.020
  556    HA   ALA  75           HA       ALA  75  15.796   4.583  -6.767
  557   1HB   ALA  75          HB1       ALA  75  17.376   5.530  -8.353
  558   2HB   ALA  75          HB2       ALA  75  18.561   4.273  -7.931
  559   3HB   ALA  75          HB3       ALA  75  17.012   3.838  -8.705
  560    H    ASP  76           H        ASP  76  14.982   2.646  -6.372
  561    HA   ASP  76           HA       ASP  76  16.231   0.790  -4.575
  562   1HB   ASP  76          HB2       ASP  76  13.782   1.025  -4.757
  563   2HB   ASP  76          HB3       ASP  76  13.841   0.454  -6.427
  564    H    LEU  77           H        LEU  77  16.233   1.263  -8.031
  565    HA   LEU  77           HA       LEU  77  18.310  -0.788  -8.329
  566   1HB   LEU  77          HB2       LEU  77  16.278  -2.065  -8.899
  567   2HB   LEU  77          HB3       LEU  77  15.744  -0.777  -9.981
  568    HG   LEU  77           HG       LEU  77  17.694  -1.206 -11.472
  569   1HD1  LEU  77          HD11      LEU  77  19.294  -2.179  -9.821
  570   2HD1  LEU  77          HD12      LEU  77  18.234  -3.596  -9.647
  571   3HD1  LEU  77          HD13      LEU  77  19.040  -3.245 -11.194
  572   1HD2  LEU  77          HD21      LEU  77  15.555  -2.294 -11.910
  573   2HD2  LEU  77          HD22      LEU  77  16.900  -3.343 -12.374
  574   3HD2  LEU  77          HD23      LEU  77  16.015  -3.657 -10.863
  575    H    VAL  78           H        VAL  78  19.791  -0.181  -9.862
  576    HA   VAL  78           HA       VAL  78  19.153   2.124 -11.633
  577    HB   VAL  78           HB       VAL  78  21.834   1.389 -10.385
  578   1HG1  VAL  78          HG11      VAL  78  22.153   2.447 -12.570
  579   2HG1  VAL  78          HG12      VAL  78  21.005   3.736 -12.158
  580   3HG1  VAL  78          HG13      VAL  78  22.552   3.612 -11.305
  581   1HG2  VAL  78          HG21      VAL  78  19.999   3.721  -9.715
  582   2HG2  VAL  78          HG22      VAL  78  20.406   2.361  -8.650
  583   3HG2  VAL  78          HG23      VAL  78  21.658   3.506  -9.115
  584    H    VAL  79           H        VAL  79  19.917   1.756 -13.865
  585    HA   VAL  79           HA       VAL  79  21.112  -0.911 -14.394
  586    HB   VAL  79           HB       VAL  79  18.836   0.219 -16.038
  587   1HG1  VAL  79          HG11      VAL  79  18.709  -2.045 -16.958
  588   2HG1  VAL  79          HG12      VAL  79  20.354  -1.429 -17.139
  589   3HG1  VAL  79          HG13      VAL  79  19.989  -2.596 -15.858
  590   1HG2  VAL  79          HG21      VAL  79  17.778  -0.243 -13.909
  591   2HG2  VAL  79          HG22      VAL  79  17.342  -1.516 -15.047
  592   3HG2  VAL  79          HG23      VAL  79  18.574  -1.829 -13.808
  593    H    THR  80           H        THR  80  22.838  -0.689 -15.760
  594    HA   THR  80           HA       THR  80  23.092   1.842 -17.328
  595    HB   THR  80           HB       THR  80  25.431   0.701 -17.782
  596    HG1  THR  80           HG1      THR  80  24.937  -1.197 -16.549
  597   1HG2  THR  80          HG21      THR  80  24.691   2.108 -15.187
  598   2HG2  THR  80          HG22      THR  80  26.348   1.912 -15.808
  599   3HG2  THR  80          HG23      THR  80  25.174   2.856 -16.727
  600    H    LEU  81           H        LEU  81  22.910   1.805 -19.500
  601    HA   LEU  81           HA       LEU  81  22.247  -0.824 -20.749
  602   1HB   LEU  81          HB2       LEU  81  21.316   1.999 -21.319
  603   2HB   LEU  81          HB3       LEU  81  21.136   0.698 -22.485
  604    HG   LEU  81           HG       LEU  81  19.808  -0.614 -20.858
  605   1HD1  LEU  81          HD11      LEU  81  19.875   1.934 -19.171
  606   2HD1  LEU  81          HD12      LEU  81  18.745   0.575 -18.952
  607   3HD1  LEU  81          HD13      LEU  81  20.451   0.319 -18.691
  608   1HD2  LEU  81          HD21      LEU  81  18.624   0.688 -22.518
  609   2HD2  LEU  81          HD22      LEU  81  17.757   0.772 -20.999
  610   3HD2  LEU  81          HD23      LEU  81  18.729   2.162 -21.512
  611    H    CYS  82           H        CYS  82  24.968   0.822 -20.438
  612    HA   CYS  82           HA       CYS  82  26.004   1.273 -23.045
  613   1HB   CYS  82          HB2       CYS  82  28.181   0.997 -21.907
  614   2HB   CYS  82          HB3       CYS  82  27.118   2.195 -21.170
  615    H    GLY  83           H        GLY  83  26.476  -0.219 -24.598
  616   1HA   GLY  83          HA1       GLY  83  27.768  -2.738 -23.802
  617   2HA   GLY  83          HA2       GLY  83  26.285  -2.907 -24.742
  618    H    ASP  84           H        ASP  84  27.712  -0.054 -25.861
  619    HA   ASP  84           HA       ASP  84  28.942  -1.400 -28.186
  620   1HB   ASP  84          HB2       ASP  84  27.655   0.572 -28.693
  621   2HB   ASP  84          HB3       ASP  84  28.461   1.493 -27.428
  622    H    ALA  85           H        ALA  85  31.147  -1.093 -28.678
  623    HA   ALA  85           HA       ALA  85  32.924  -1.566 -26.548
  624   1HB   ALA  85          HB1       ALA  85  34.663  -1.509 -28.291
  625   2HB   ALA  85          HB2       ALA  85  33.236  -2.395 -28.854
  626   3HB   ALA  85          HB3       ALA  85  33.533  -0.731 -29.417
  627    H    ALA  86           H        ALA  86  31.850   1.554 -27.732
  628    HA   ALA  86           HA       ALA  86  34.108   2.885 -26.293
  629   1HB   ALA  86          HB1       ALA  86  34.077   3.332 -28.740
  630   2HB   ALA  86          HB2       ALA  86  32.414   3.967 -28.564
  631   3HB   ALA  86          HB3       ALA  86  33.765   4.782 -27.755
  632    H    ASP  87           H        ASP  87  31.171   1.893 -25.495
  633    HA   ASP  87           HA       ASP  87  29.921   4.361 -24.586
  634   1HB   ASP  87          HB2       ASP  87  29.543   1.416 -23.914
  635   2HB   ASP  87          HB3       ASP  87  28.892   2.707 -22.900
  636    H    LYS  88           H        LYS  88  31.247   5.602 -23.434
  637    HA   LYS  88           HA       LYS  88  33.262   4.872 -21.672
  638   1HB   LYS  88          HB2       LYS  88  31.307   7.187 -21.317
  639   2HB   LYS  88          HB3       LYS  88  32.858   7.056 -20.531
  640   1HG   LYS  88          HG2       LYS  88  32.382   7.313 -23.543
  641   2HG   LYS  88          HG3       LYS  88  32.917   8.595 -22.461
  642   1HD   LYS  88          HD2       LYS  88  34.473   6.059 -23.151
  643   2HD   LYS  88          HD3       LYS  88  34.790   7.692 -23.749
  644   1HE   LYS  88          HE2       LYS  88  35.167   8.482 -21.404
  645   2HE   LYS  88          HE3       LYS  88  34.914   6.844 -20.812
  646   1HZ   LYS  88          HZ1       LYS  88  37.098   7.672 -22.643
  647   2HZ   LYS  88          HZ2       LYS  88  37.264   7.334 -21.060
  648   3HZ   LYS  88          HZ3       LYS  88  36.864   6.148 -22.101
  649    H    CYS  89           H        CYS  89  29.785   4.893 -21.090
  650    HA   CYS  89           HA       CYS  89  28.447   4.326 -19.539
  651   1HB   CYS  89          HB2       CYS  89  29.667   2.154 -20.119
  652   2HB   CYS  89          HB3       CYS  89  30.336   2.242 -18.486
  653    HA   PRO  90           HA       PRO  90  29.561   6.669 -15.843
  654   1HB   PRO  90          HB2       PRO  90  27.118   6.563 -14.557
  655   2HB   PRO  90          HB3       PRO  90  27.551   7.702 -15.861
  656   1HG   PRO  90          HG2       PRO  90  26.072   5.085 -16.055
  657   2HG   PRO  90          HG3       PRO  90  25.671   6.657 -16.843
  658   1HD   PRO  90          HD2       PRO  90  26.908   4.656 -18.164
  659   2HD   PRO  90          HD3       PRO  90  27.355   6.367 -18.460
  660    H    MET  91           H        MET  91  29.227   6.297 -13.366
  661    HA   MET  91           HA       MET  91  29.409   3.454 -12.653
  662   1HB   MET  91          HB2       MET  91  31.671   4.489 -12.819
  663   2HB   MET  91          HB3       MET  91  31.184   5.728 -11.666
  664   1HG   MET  91          HG2       MET  91  32.556   3.952 -10.643
  665   2HG   MET  91          HG3       MET  91  30.981   4.110  -9.890
  666   1HE   MET  91          HE1       MET  91  32.014   2.186 -13.281
  667   2HE   MET  91          HE2       MET  91  33.346   1.955 -12.124
  668   3HE   MET  91          HE3       MET  91  32.328   0.578 -12.595
  669    H    THR  92           H        THR  92  28.772   3.028 -10.415
  670    HA   THR  92           HA       THR  92  26.787   4.959  -9.365
  671    HB   THR  92           HB       THR  92  25.533   2.764  -8.926
  672    HG1  THR  92           HG1      THR  92  27.064   1.215  -9.149
  673   1HG2  THR  92          HG21      THR  92  25.043   4.264 -10.890
  674   2HG2  THR  92          HG22      THR  92  26.185   3.300 -11.857
  675   3HG2  THR  92          HG23      THR  92  24.717   2.551 -11.200
  676    HA   PRO  93           HA       PRO  93  28.571   4.160  -5.345
  677   1HB   PRO  93          HB2       PRO  93  26.403   4.007  -3.654
  678   2HB   PRO  93          HB3       PRO  93  27.009   5.539  -4.357
  679   1HG   PRO  93          HG2       PRO  93  24.748   3.791  -5.352
  680   2HG   PRO  93          HG3       PRO  93  24.738   5.565  -5.111
  681   1HD   PRO  93          HD2       PRO  93  25.155   4.451  -7.552
  682   2HD   PRO  93          HD3       PRO  93  26.070   5.904  -7.052
  683    HA   PRO  94           HA       PRO  94  28.453  -0.260  -5.462
  684   1HB   PRO  94          HB2       PRO  94  29.981  -0.968  -3.302
  685   2HB   PRO  94          HB3       PRO  94  30.648  -0.174  -4.761
  686   1HG   PRO  94          HG2       PRO  94  29.831   1.121  -2.144
  687   2HG   PRO  94          HG3       PRO  94  31.352   1.352  -3.067
  688   1HD   PRO  94          HD2       PRO  94  29.236   3.079  -3.272
  689   2HD   PRO  94          HD3       PRO  94  30.272   2.692  -4.684
  690    H    HIS  95           H        HIS  95  27.217   1.421  -2.623
  691    HA   HIS  95           HA       HIS  95  26.027  -0.953  -1.441
  692   1HB   HIS  95          HB2       HIS  95  25.207   0.520   0.256
  693   2HB   HIS  95          HB3       HIS  95  26.890   0.892  -0.062
  694    HD1  HIS  95           HD1      HIS  95  23.374   2.382  -0.644
  695    HD2  HIS  95           HD2      HIS  95  27.458   3.397  -0.761
  696    HE1  HIS  95           HE1      HIS  95  23.476   4.911  -0.917
  697    H    VAL  96           H        VAL  96  25.183   0.591  -4.254
  698    HA   VAL  96           HA       VAL  96  22.278   0.081  -3.781
  699    HB   VAL  96           HB       VAL  96  23.499   2.006  -5.772
  700   1HG1  VAL  96          HG11      VAL  96  20.590   1.377  -5.109
  701   2HG1  VAL  96          HG12      VAL  96  21.145   2.708  -6.142
  702   3HG1  VAL  96          HG13      VAL  96  21.422   1.043  -6.644
  703   1HG2  VAL  96          HG21      VAL  96  23.630   2.895  -3.460
  704   2HG2  VAL  96          HG22      VAL  96  22.370   3.732  -4.358
  705   3HG2  VAL  96          HG23      VAL  96  21.923   2.480  -3.186
  706    H    LYS  97           H        LYS  97  21.331  -1.432  -5.060
  707    HA   LYS  97           HA       LYS  97  22.936  -3.259  -6.570
  708   1HB   LYS  97          HB2       LYS  97  20.936  -4.011  -5.406
  709   2HB   LYS  97          HB3       LYS  97  19.930  -2.837  -6.258
  710   1HG   LYS  97          HG2       LYS  97  19.555  -5.075  -7.120
  711   2HG   LYS  97          HG3       LYS  97  20.222  -4.020  -8.360
  712   1HD   LYS  97          HD2       LYS  97  22.483  -5.050  -7.971
  713   2HD   LYS  97          HD3       LYS  97  21.739  -6.181  -6.826
  714   1HE   LYS  97          HE2       LYS  97  20.502  -7.272  -8.517
  715   2HE   LYS  97          HE3       LYS  97  20.529  -5.857  -9.575
  716   1HZ   LYS  97          HZ1       LYS  97  22.861  -6.231  -9.977
  717   2HZ   LYS  97          HZ2       LYS  97  22.836  -7.637  -9.093
  718   3HZ   LYS  97          HZ3       LYS  97  21.953  -7.467 -10.486
  719    H    ARG  98           H        ARG  98  23.436  -3.227  -8.692
  720    HA   ARG  98           HA       ARG  98  21.898  -1.463 -10.491
  721   1HB   ARG  98          HB2       ARG  98  24.393  -0.740  -9.958
  722   2HB   ARG  98          HB3       ARG  98  24.805  -2.074 -11.038
  723   1HG   ARG  98          HG2       ARG  98  22.904  -0.760 -12.551
  724   2HG   ARG  98          HG3       ARG  98  23.534   0.578 -11.614
  725   1HD   ARG  98          HD2       ARG  98  25.095  -1.308 -13.417
  726   2HD   ARG  98          HD3       ARG  98  24.599   0.352 -13.782
  727    HE   ARG  98           HE       ARG  98  26.095   0.548 -11.440
  728   1HH1  ARG  98          HH21      ARG  98  26.640  -0.340 -14.836
  729   2HH1  ARG  98          HH22      ARG  98  28.354  -0.079 -14.763
  730   1HH2  ARG  98          HH11      ARG  98  28.239   0.935 -11.337
  731   2HH2  ARG  98          HH12      ARG  98  29.317   0.689 -12.686
  732    H    GLU  99           H        GLU  99  21.785  -2.288 -12.694
  733    HA   GLU  99           HA       GLU  99  22.562  -5.122 -13.140
  734   1HB   GLU  99          HB2       GLU  99  19.917  -3.718 -13.633
  735   2HB   GLU  99          HB3       GLU  99  20.426  -4.992 -14.728
  736   1HG   GLU  99          HG2       GLU  99  20.192  -5.364 -11.716
  737   2HG   GLU  99          HG3       GLU  99  18.904  -5.724 -12.861
  738    H    HIS 100           H        HIS 100  22.714  -5.496 -15.564
  739    HA   HIS 100           HA       HIS 100  23.718  -3.100 -17.014
  740   1HB   HIS 100          HB2       HIS 100  25.654  -4.134 -16.011
  741   2HB   HIS 100          HB3       HIS 100  25.115  -5.746 -16.480
  742    HD1  HIS 100           HD1      HIS 100  26.656  -2.588 -18.100
  743    HD2  HIS 100           HD2      HIS 100  25.695  -6.610 -18.901
  744    HE1  HIS 100           HE1      HIS 100  27.761  -3.162 -20.316
  745    H    TRP 101           H        TRP 101  22.494  -2.954 -18.750
  746    HA   TRP 101           HA       TRP 101  21.469  -5.399 -20.147
  747   1HB   TRP 101          HB2       TRP 101  20.150  -2.694 -19.699
  748   2HB   TRP 101          HB3       TRP 101  19.576  -3.897 -20.835
  749    HD1  TRP 101           HD1      TRP 101  20.483  -5.380 -17.466
  750    HE1  TRP 101           HE1      TRP 101  18.384  -5.905 -16.156
  751    HE3  TRP 101           HE3      TRP 101  17.059  -3.159 -20.556
  752    HZ2  TRP 101           HZ2      TRP 101  15.545  -5.331 -16.336
  753    HZ3  TRP 101           HZ3      TRP 101  14.643  -3.256 -20.010
  754    HH2  TRP 101           HH2      TRP 101  13.891  -4.280 -17.858
  755    H    GLY 102           H        GLY 102  23.893  -4.849 -20.944
  756   1HA   GLY 102          HA1       GLY 102  24.221  -2.503 -22.575
  757   2HA   GLY 102          HA2       GLY 102  25.309  -3.886 -22.486
  758    H    PHE 103           H        PHE 103  23.842  -2.142 -24.651
  759    HA   PHE 103           HA       PHE 103  24.117  -4.110 -26.693
  760   1HB   PHE 103          HB2       PHE 103  21.753  -3.300 -27.669
  761   2HB   PHE 103          HB3       PHE 103  21.951  -4.760 -26.733
  762    HD1  PHE 103           HD1      PHE 103  21.219  -1.103 -26.148
  763    HD2  PHE 103           HD2      PHE 103  20.435  -5.190 -25.018
  764    HE1  PHE 103           HE1      PHE 103  19.626  -0.330 -24.405
  765    HE2  PHE 103           HE2      PHE 103  18.815  -4.411 -23.311
  766    HZ   PHE 103           HZ       PHE 103  18.469  -1.975 -22.948
  767    H    ASP 104           H        ASP 104  24.052  -2.930 -28.809
  768    HA   ASP 104           HA       ASP 104  25.652  -0.664 -28.734
  769   1HB   ASP 104          HB2       ASP 104  25.530  -2.230 -30.614
  770   2HB   ASP 104          HB3       ASP 104  23.875  -1.714 -30.963
  771    H    ASP 105           H        ASP 105  25.317   1.446 -29.373
  772    HA   ASP 105           HA       ASP 105  22.830   2.722 -28.398
  773   1HB   ASP 105          HB2       ASP 105  24.803   3.758 -27.604
  774   2HB   ASP 105          HB3       ASP 105  25.569   3.661 -29.177
  775    HA   PRO 106           HA       PRO 106  21.687   2.530 -32.733
  776   1HB   PRO 106          HB2       PRO 106  19.301   3.904 -32.654
  777   2HB   PRO 106          HB3       PRO 106  19.502   2.200 -32.158
  778   1HG   PRO 106          HG2       PRO 106  19.458   4.652 -30.372
  779   2HG   PRO 106          HG3       PRO 106  18.607   3.102 -30.126
  780   1HD   PRO 106          HD2       PRO 106  20.968   3.687 -28.916
  781   2HD   PRO 106          HD3       PRO 106  20.632   2.026 -29.493
  782    H    ALA 107           H        ALA 107  22.168   5.561 -30.970
  783    HA   ALA 107           HA       ALA 107  22.013   7.243 -33.297
  784   1HB   ALA 107          HB1       ALA 107  23.201   8.909 -31.916
  785   2HB   ALA 107          HB2       ALA 107  21.811   8.209 -31.083
  786   3HB   ALA 107          HB3       ALA 107  23.461   7.686 -30.661
  787    H    ARG 108           H        ARG 108  24.360   4.857 -32.395
  788    HA   ARG 108           HA       ARG 108  26.273   6.094 -34.321
  789   1HB   ARG 108          HB2       ARG 108  28.110   5.557 -33.063
  790   2HB   ARG 108          HB3       ARG 108  26.943   6.169 -31.893
  791   1HG   ARG 108          HG2       ARG 108  26.406   3.723 -31.339
  792   2HG   ARG 108          HG3       ARG 108  27.770   3.278 -32.364
  793   1HD   ARG 108          HD2       ARG 108  28.574   3.292 -30.162
  794   2HD   ARG 108          HD3       ARG 108  29.243   4.754 -30.901
  795    HE   ARG 108           HE       ARG 108  26.927   5.661 -29.739
  796   1HH1  ARG 108          HH21      ARG 108  29.512   3.600 -28.282
  797   2HH1  ARG 108          HH22      ARG 108  28.926   3.972 -26.681
  798   1HH2  ARG 108          HH11      ARG 108  26.322   6.047 -27.685
  799   2HH2  ARG 108          HH12      ARG 108  27.171   5.307 -26.320
  800    H    ALA 109           H        ALA 109  23.997   3.942 -34.408
  801    HA   ALA 109           HA       ALA 109  25.260   1.644 -35.592
  802   1HB   ALA 109          HB1       ALA 109  23.037   1.498 -34.565
  803   2HB   ALA 109          HB2       ALA 109  22.400   2.699 -35.713
  804   3HB   ALA 109          HB3       ALA 109  22.944   1.117 -36.296
  805    H    GLN 110           H        GLN 110  26.666   3.410 -36.737
  806    HA   GLN 110           HA       GLN 110  25.668   5.087 -38.735
  807   1HB   GLN 110          HB2       GLN 110  28.061   5.439 -39.253
  808   2HB   GLN 110          HB3       GLN 110  27.701   5.496 -37.534
  809   1HG   GLN 110          HG2       GLN 110  28.450   2.894 -37.649
  810   2HG   GLN 110          HG3       GLN 110  29.295   3.463 -39.081
  811   1HE2  GLN 110          HE22      GLN 110  28.875   3.964 -35.536
  812   2HE2  GLN 110          HE21      GLN 110  30.451   4.682 -35.281
  813    H    GLY 111           H        GLY 111  25.850   5.103 -40.897
  814   1HA   GLY 111          HA1       GLY 111  26.767   3.407 -42.808
  815   2HA   GLY 111          HA2       GLY 111  25.238   2.636 -42.312
  816    H    THR 112           H        THR 112  23.511   4.549 -41.767
  817    HA   THR 112           HA       THR 112  23.640   6.990 -43.137
  818    HB   THR 112           HB       THR 112  23.242   5.752 -45.191
  819    HG1  THR 112           HG1      THR 112  21.507   6.825 -45.867
  820   1HG2  THR 112          HG21      THR 112  20.812   4.497 -43.860
  821   2HG2  THR 112          HG22      THR 112  21.241   4.368 -45.576
  822   3HG2  THR 112          HG23      THR 112  22.293   3.649 -44.354
  823    H    GLU 113           H        GLU 113  21.431   8.111 -42.879
  824    HA   GLU 113           HA       GLU 113  20.693   7.885 -40.126
  825   1HB   GLU 113          HB2       GLU 113  19.046   9.604 -40.613
  826   2HB   GLU 113          HB3       GLU 113  20.613  10.006 -41.313
  827   1HG   GLU 113          HG2       GLU 113  19.792   9.233 -43.551
  828   2HG   GLU 113          HG3       GLU 113  18.215   8.889 -42.836
  829    H    GLU 114           H        GLU 114  19.382   6.454 -43.085
  830    HA   GLU 114           HA       GLU 114  16.942   5.541 -41.899
  831   1HB   GLU 114          HB2       GLU 114  17.281   5.801 -44.323
  832   2HB   GLU 114          HB3       GLU 114  18.465   4.486 -44.315
  833   1HG   GLU 114          HG2       GLU 114  16.730   2.892 -43.603
  834   2HG   GLU 114          HG3       GLU 114  15.551   4.200 -43.463
  835    H    GLU 115           H        GLU 115  20.233   4.218 -42.085
  836    HA   GLU 115           HA       GLU 115  19.562   1.595 -41.113
  837   1HB   GLU 115          HB2       GLU 115  21.648   2.180 -42.431
  838   2HB   GLU 115          HB3       GLU 115  22.236   3.058 -41.021
  839   1HG   GLU 115          HG2       GLU 115  23.301   0.970 -40.953
  840   2HG   GLU 115          HG3       GLU 115  22.071   0.887 -39.702
  841    H    LYS 116           H        LYS 116  20.907   4.606 -39.660
  842    HA   LYS 116           HA       LYS 116  20.920   3.788 -36.963
  843   1HB   LYS 116          HB2       LYS 116  20.489   6.495 -38.290
  844   2HB   LYS 116          HB3       LYS 116  20.509   6.287 -36.525
  845   1HG   LYS 116          HG2       LYS 116  22.792   5.227 -36.754
  846   2HG   LYS 116          HG3       LYS 116  22.766   5.673 -38.475
  847   1HD   LYS 116          HD2       LYS 116  22.434   8.079 -37.776
  848   2HD   LYS 116          HD3       LYS 116  22.579   7.555 -36.082
  849   1HE   LYS 116          HE2       LYS 116  24.850   6.539 -36.754
  850   2HE   LYS 116          HE3       LYS 116  24.687   7.427 -38.279
  851   1HZ   LYS 116          HZ1       LYS 116  24.801   8.581 -35.550
  852   2HZ   LYS 116          HZ2       LYS 116  25.953   8.717 -36.701
  853   3HZ   LYS 116          HZ3       LYS 116  24.526   9.479 -36.904
  854    H    TRP 117           H        TRP 117  18.225   5.354 -38.797
  855    HA   TRP 117           HA       TRP 117  16.360   5.324 -36.707
  856   1HB   TRP 117          HB2       TRP 117  15.987   6.648 -38.652
  857   2HB   TRP 117          HB3       TRP 117  16.138   5.261 -39.721
  858    HD1  TRP 117           HD1      TRP 117  13.968   4.821 -40.837
  859    HE1  TRP 117           HE1      TRP 117  11.529   4.582 -40.172
  860    HE3  TRP 117           HE3      TRP 117  14.360   6.126 -35.900
  861    HZ2  TRP 117           HZ2      TRP 117   9.900   4.967 -37.784
  862    HZ3  TRP 117           HZ3      TRP 117  12.385   6.072 -34.441
  863    HH2  TRP 117           HH2      TRP 117  10.139   5.486 -35.362
  864    H    ALA 118           H        ALA 118  17.130   2.691 -39.057
  865    HA   ALA 118           HA       ALA 118  14.991   1.008 -38.187
  866   1HB   ALA 118          HB1       ALA 118  16.110   0.695 -40.335
  867   2HB   ALA 118          HB2       ALA 118  17.637   0.292 -39.509
  868   3HB   ALA 118          HB3       ALA 118  16.224  -0.775 -39.346
  869    H    PHE 119           H        PHE 119  18.411   1.322 -37.199
  870    HA   PHE 119           HA       PHE 119  18.314  -0.734 -35.228
  871   1HB   PHE 119          HB2       PHE 119  20.185   1.500 -35.889
  872   2HB   PHE 119          HB3       PHE 119  20.249   0.881 -34.253
  873    HD1  PHE 119           HD1      PHE 119  21.388  -1.118 -33.720
  874    HD2  PHE 119           HD2      PHE 119  20.400  -0.270 -37.835
  875    HE1  PHE 119           HE1      PHE 119  22.765  -3.045 -34.454
  876    HE2  PHE 119           HE2      PHE 119  21.779  -2.194 -38.561
  877    HZ   PHE 119           HZ       PHE 119  22.967  -3.588 -36.875
  878    H    PHE 120           H        PHE 120  17.484   2.739 -35.022
  879    HA   PHE 120           HA       PHE 120  17.055   2.785 -32.209
  880   1HB   PHE 120          HB2       PHE 120  16.007   4.405 -34.530
  881   2HB   PHE 120          HB3       PHE 120  15.119   4.486 -33.028
  882    HD1  PHE 120           HD1      PHE 120  16.191   5.255 -30.911
  883    HD2  PHE 120           HD2      PHE 120  18.134   5.609 -34.744
  884    HE1  PHE 120           HE1      PHE 120  17.774   6.925 -29.977
  885    HE2  PHE 120           HE2      PHE 120  19.719   7.247 -33.802
  886    HZ   PHE 120           HZ       PHE 120  19.507   7.944 -31.421
  887    H    GLN 121           H        GLN 121  14.750   1.863 -34.829
  888    HA   GLN 121           HA       GLN 121  12.639   1.229 -32.995
  889   1HB   GLN 121          HB2       GLN 121  13.263   0.299 -35.823
  890   2HB   GLN 121          HB3       GLN 121  11.789  -0.162 -34.962
  891   1HG   GLN 121          HG2       GLN 121  10.957   2.037 -34.896
  892   2HG   GLN 121          HG3       GLN 121  12.531   2.768 -35.218
  893   1HE2  GLN 121          HE22      GLN 121  13.453   2.670 -37.327
  894   2HE2  GLN 121          HE21      GLN 121  12.454   2.386 -38.737
  895    H    ARG 122           H        ARG 122  15.323  -0.815 -34.314
  896    HA   ARG 122           HA       ARG 122  14.343  -3.217 -33.073
  897   1HB   ARG 122          HB2       ARG 122  17.180  -2.388 -33.854
  898   2HB   ARG 122          HB3       ARG 122  16.752  -3.996 -33.287
  899   1HG   ARG 122          HG2       ARG 122  15.618  -2.703 -35.805
  900   2HG   ARG 122          HG3       ARG 122  16.960  -3.845 -35.752
  901   1HD   ARG 122          HD2       ARG 122  15.418  -5.554 -34.732
  902   2HD   ARG 122          HD3       ARG 122  14.090  -4.403 -34.890
  903    HE   ARG 122           HE       ARG 122  14.000  -4.711 -37.159
  904   1HH1  ARG 122          HH21      ARG 122  16.840  -6.448 -35.914
  905   2HH1  ARG 122          HH22      ARG 122  17.112  -7.329 -37.370
  906   1HH2  ARG 122          HH11      ARG 122  14.364  -5.887 -39.094
  907   2HH2  ARG 122          HH12      ARG 122  15.670  -7.002 -39.214
  908    H    VAL 123           H        VAL 123  16.725  -0.759 -31.871
  909    HA   VAL 123           HA       VAL 123  17.152  -2.185 -29.422
  910    HB   VAL 123           HB       VAL 123  17.655   0.699 -30.259
  911   1HG1  VAL 123          HG11      VAL 123  19.238   0.779 -28.322
  912   2HG1  VAL 123          HG12      VAL 123  17.545   0.697 -27.829
  913   3HG1  VAL 123          HG13      VAL 123  18.568  -0.755 -27.735
  914   1HG2  VAL 123          HG21      VAL 123  19.997  -0.036 -30.449
  915   2HG2  VAL 123          HG22      VAL 123  19.565  -1.665 -29.895
  916   3HG2  VAL 123          HG23      VAL 123  18.993  -1.071 -31.463
  917    H    ARG 124           H        ARG 124  14.821   0.394 -30.382
  918    HA   ARG 124           HA       ARG 124  13.600   0.864 -27.884
  919   1HB   ARG 124          HB2       ARG 124  13.097   2.171 -29.884
  920   2HB   ARG 124          HB3       ARG 124  12.536   0.754 -30.734
  921   1HG   ARG 124          HG2       ARG 124  10.825   0.865 -28.507
  922   2HG   ARG 124          HG3       ARG 124  11.096   2.546 -28.936
  923   1HD   ARG 124          HD2       ARG 124   9.172   1.831 -30.129
  924   2HD   ARG 124          HD3       ARG 124  10.479   1.976 -31.309
  925    HE   ARG 124           HE       ARG 124  10.084  -0.723 -30.207
  926   1HH1  ARG 124          HH21      ARG 124   9.198   1.528 -32.786
  927   2HH1  ARG 124          HH22      ARG 124   8.590   0.305 -33.846
  928   1HH2  ARG 124          HH11      ARG 124   9.059  -2.374 -31.561
  929   2HH2  ARG 124          HH12      ARG 124   8.541  -1.922 -33.136
  930    H    ASP 125           H        ASP 125  12.758  -1.579 -30.413
  931    HA   ASP 125           HA       ASP 125  10.643  -2.689 -28.923
  932   1HB   ASP 125          HB2       ASP 125  11.291  -2.980 -31.433
  933   2HB   ASP 125          HB3       ASP 125  12.285  -4.329 -30.883
  934    H    GLU 126           H        GLU 126  14.091  -3.746 -29.102
  935    HA   GLU 126           HA       GLU 126  13.740  -6.011 -27.421
  936   1HB   GLU 126          HB2       GLU 126  16.170  -4.313 -28.077
  937   2HB   GLU 126          HB3       GLU 126  16.233  -5.767 -27.064
  938   1HG   GLU 126          HG2       GLU 126  15.283  -7.119 -28.903
  939   2HG   GLU 126          HG3       GLU 126  15.249  -5.706 -29.949
  940    H    ILE 127           H        ILE 127  14.565  -2.588 -26.626
  941    HA   ILE 127           HA       ILE 127  14.920  -2.994 -23.822
  942    HB   ILE 127           HB       ILE 127  14.111  -0.613 -25.531
  943   1HG1  ILE 127          HG12      ILE 127  16.581  -1.140 -23.819
  944   2HG1  ILE 127          HG13      ILE 127  16.504  -1.512 -25.535
  945   1HG2  ILE 127          HG21      ILE 127  14.593  -0.531 -22.521
  946   2HG2  ILE 127          HG22      ILE 127  14.304   0.854 -23.607
  947   3HG2  ILE 127          HG23      ILE 127  13.020  -0.299 -23.306
  948   1HD1  ILE 127          HD11      ILE 127  17.617   0.583 -25.346
  949   2HD1  ILE 127          HD12      ILE 127  15.988   0.947 -25.951
  950   3HD1  ILE 127          HD13      ILE 127  16.404   1.238 -24.244
  951    H    GLY 128           H        GLY 128  11.979  -2.106 -25.736
  952   1HA   GLY 128          HA1       GLY 128  10.133  -2.041 -23.657
  953   2HA   GLY 128          HA2       GLY 128   9.772  -2.547 -25.323
  954    H    ASN 129           H        ASN 129  11.199  -4.917 -25.540
  955    HA   ASN 129           HA       ASN 129   9.517  -6.780 -24.198
  956   1HB   ASN 129          HB2       ASN 129  12.162  -7.119 -25.667
  957   2HB   ASN 129          HB3       ASN 129  11.394  -8.461 -24.841
  958   1HD2  ASN 129          HD22      ASN 129  10.999  -6.166 -27.533
  959   2HD2  ASN 129          HD21      ASN 129   9.838  -7.130 -28.399
  960    H    ARG 130           H        ARG 130  12.871  -5.706 -23.460
  961    HA   ARG 130           HA       ARG 130  13.040  -7.652 -21.360
  962   1HB   ARG 130          HB2       ARG 130  14.982  -6.750 -22.688
  963   2HB   ARG 130          HB3       ARG 130  14.813  -5.213 -21.837
  964   1HG   ARG 130          HG2       ARG 130  16.603  -6.586 -20.869
  965   2HG   ARG 130          HG3       ARG 130  15.310  -6.330 -19.702
  966   1HD   ARG 130          HD2       ARG 130  14.413  -8.624 -20.211
  967   2HD   ARG 130          HD3       ARG 130  15.776  -8.863 -21.313
  968    HE   ARG 130           HE       ARG 130  17.166  -9.186 -19.514
  969   1HH1  ARG 130          HH11      ARG 130  14.143  -7.702 -18.300
  970   2HH1  ARG 130          HH12      ARG 130  14.459  -8.159 -16.644
  971   1HH2  ARG 130          HH21      ARG 130  17.602  -9.625 -17.300
  972   2HH2  ARG 130          HH22      ARG 130  16.440  -9.238 -16.070
  973    H    LEU 131           H        LEU 131  12.019  -4.258 -21.461
  974    HA   LEU 131           HA       LEU 131  11.888  -3.891 -18.621
  975   1HB   LEU 131          HB2       LEU 131  11.364  -2.264 -20.885
  976   2HB   LEU 131          HB3       LEU 131   9.821  -2.446 -20.092
  977    HG   LEU 131           HG       LEU 131  10.810  -0.513 -19.232
  978   1HD1  LEU 131          HD11      LEU 131  10.962  -0.882 -16.831
  979   2HD1  LEU 131          HD12      LEU 131   9.682  -1.905 -17.515
  980   3HD1  LEU 131          HD13      LEU 131  11.253  -2.597 -17.075
  981   1HD2  LEU 131          HD21      LEU 131  12.996  -0.252 -18.374
  982   2HD2  LEU 131          HD22      LEU 131  13.301  -1.994 -18.369
  983   3HD2  LEU 131          HD23      LEU 131  13.168  -1.103 -19.904
  984    H    LYS 132           H        LYS 132   9.568  -5.101 -21.104
  985    HA   LYS 132           HA       LYS 132   7.378  -5.461 -19.391
  986   1HB   LYS 132          HB2       LYS 132   7.271  -5.704 -21.852
  987   2HB   LYS 132          HB3       LYS 132   8.217  -7.186 -21.763
  988   1HG   LYS 132          HG2       LYS 132   6.475  -8.305 -20.469
  989   2HG   LYS 132          HG3       LYS 132   5.513  -6.806 -20.427
  990   1HD   LYS 132          HD2       LYS 132   5.354  -6.837 -22.907
  991   2HD   LYS 132          HD3       LYS 132   6.313  -8.331 -22.953
  992   1HE   LYS 132          HE2       LYS 132   4.575  -9.480 -21.587
  993   2HE   LYS 132          HE3       LYS 132   3.621  -7.993 -21.547
  994   1HZ   LYS 132          HZ1       LYS 132   4.285  -9.524 -23.996
  995   2HZ   LYS 132          HZ2       LYS 132   2.835  -9.500 -23.256
  996   3HZ   LYS 132          HZ3       LYS 132   3.404  -8.146 -23.961
  997    H    GLU 133           H        GLU 133  10.029  -7.756 -20.133
  998    HA   GLU 133           HA       GLU 133   9.087  -9.750 -18.376
  999   1HB   GLU 133          HB2       GLU 133  11.963  -9.176 -19.170
 1000   2HB   GLU 133          HB3       GLU 133  11.395 -10.631 -18.328
 1001   1HG   GLU 133          HG2       GLU 133   9.879 -11.149 -20.211
 1002   2HG   GLU 133          HG3       GLU 133  10.470  -9.741 -21.087
 1003    H    PHE 134           H        PHE 134  11.307  -7.020 -17.725
 1004    HA   PHE 134           HA       PHE 134  11.881  -7.705 -15.046
 1005   1HB   PHE 134          HB2       PHE 134  13.169  -6.064 -16.196
 1006   2HB   PHE 134          HB3       PHE 134  11.745  -5.074 -16.521
 1007    HD1  PHE 134           HD1      PHE 134  11.077  -3.357 -15.042
 1008    HD2  PHE 134           HD2      PHE 134  13.895  -6.333 -13.707
 1009    HE1  PHE 134           HE1      PHE 134  11.501  -2.023 -13.004
 1010    HE2  PHE 134           HE2      PHE 134  14.266  -5.037 -11.628
 1011    HZ   PHE 134           HZ       PHE 134  13.098  -2.868 -11.284
 1012    H    ALA 135           H        ALA 135   9.041  -6.117 -16.405
 1013    HA   ALA 135           HA       ALA 135   8.031  -5.421 -13.765
 1014   1HB   ALA 135          HB1       ALA 135   6.118  -4.497 -15.039
 1015   2HB   ALA 135          HB2       ALA 135   7.653  -3.964 -15.761
 1016   3HB   ALA 135          HB3       ALA 135   6.720  -5.266 -16.525
 1017    H    GLU 136           H        GLU 136   7.481  -7.922 -16.200
 1018    HA   GLU 136           HA       GLU 136   5.047  -8.892 -14.941
 1019   1HB   GLU 136          HB2       GLU 136   5.201  -8.644 -17.379
 1020   2HB   GLU 136          HB3       GLU 136   6.608  -9.702 -17.423
 1021   1HG   GLU 136          HG2       GLU 136   4.751 -10.959 -18.193
 1022   2HG   GLU 136          HG3       GLU 136   5.210 -11.608 -16.632
 1023    H    THR 137           H        THR 137   8.271 -10.180 -15.781
 1024    HA   THR 137           HA       THR 137   7.717 -12.667 -14.313
 1025    HB   THR 137           HB       THR 137   9.379 -13.659 -15.701
 1026    HG1  THR 137           HG1      THR 137  10.514 -12.478 -17.204
 1027   1HG2  THR 137          HG21      THR 137   7.094 -13.278 -16.730
 1028   2HG2  THR 137          HG22      THR 137   7.771 -11.830 -17.528
 1029   3HG2  THR 137          HG23      THR 137   8.424 -13.434 -17.896
 1030    H    GLY 138           H        GLY 138   9.532  -9.728 -14.083
 1031   1HA   GLY 138          HA1       GLY 138  10.645  -8.911 -12.228
 1032   2HA   GLY 138          HA2       GLY 138  10.586 -10.505 -11.463
 1033    H    LYS 139           H        LYS 139  11.753 -10.440 -14.771
 1034    HA   LYS 139           HA       LYS 139  14.261 -11.543 -13.858
 1035   1HB   LYS 139          HB2       LYS 139  13.101 -10.960 -16.608
 1036   2HB   LYS 139          HB3       LYS 139  14.699 -11.676 -16.367
 1037   1HG   LYS 139          HG2       LYS 139  12.082 -12.861 -15.359
 1038   2HG   LYS 139          HG3       LYS 139  12.931 -13.361 -16.831
 1039   1HD   LYS 139          HD2       LYS 139  14.874 -14.040 -15.367
 1040   2HD   LYS 139          HD3       LYS 139  13.869 -13.635 -13.945
 1041   1HE   LYS 139          HE2       LYS 139  12.143 -15.225 -14.683
 1042   2HE   LYS 139          HE3       LYS 139  13.115 -15.652 -16.098
 1043   1HZ   LYS 139          HZ1       LYS 139  13.400 -17.257 -14.319
 1044   2HZ   LYS 139          HZ2       LYS 139  14.818 -16.504 -14.590
 1045   3HZ   LYS 139          HZ3       LYS 139  13.918 -16.115 -13.281
  Start of MODEL    5
    1   1H    MET   1           H1       MET   1   2.710   4.017   3.793
    2   2H    MET   1           H2       MET   1   1.381   3.110   3.461
    3   3H    MET   1           H3       MET   1   2.876   2.439   3.403
    4    HA   MET   1           HA       MET   1   2.084   2.810   1.196
    5   1HB   MET   1          HB2       MET   1   0.585   4.690   1.771
    6   2HB   MET   1          HB3       MET   1   1.971   5.756   2.005
    7   1HG   MET   1          HG2       MET   1   1.434   4.312  -0.618
    8   2HG   MET   1          HG3       MET   1   0.671   5.843  -0.216
    9   1HE   MET   1          HE1       MET   1   1.572   6.664  -2.601
   10   2HE   MET   1          HE2       MET   1   3.297   6.724  -3.028
   11   3HE   MET   1          HE3       MET   1   2.483   5.154  -2.845
   12    H    GLU   2           H        GLU   2   3.741   2.751  -0.282
   13    HA   GLU   2           HA       GLU   2   6.034   4.486  -0.044
   14   1HB   GLU   2          HB2       GLU   2   7.717   2.775  -0.098
   15   2HB   GLU   2          HB3       GLU   2   6.786   2.611   1.377
   16   1HG   GLU   2          HG2       GLU   2   6.420   0.893  -1.121
   17   2HG   GLU   2          HG3       GLU   2   7.417   0.459   0.255
   18    H    ASN   3           H        ASN   3   7.456   4.085  -2.088
   19    HA   ASN   3           HA       ASN   3   6.046   2.914  -4.379
   20   1HB   ASN   3          HB2       ASN   3   5.358   5.416  -3.998
   21   2HB   ASN   3          HB3       ASN   3   7.022   5.807  -4.447
   22   1HD2  ASN   3          HD22      ASN   3   7.725   5.162  -6.694
   23   2HD2  ASN   3          HD21      ASN   3   6.436   5.101  -7.912
   24    H    LYS   4           H        LYS   4   7.678   2.286  -5.950
   25    HA   LYS   4           HA       LYS   4  10.401   2.186  -4.849
   26   1HB   LYS   4          HB2       LYS   4   9.475   1.249  -7.586
   27   2HB   LYS   4          HB3       LYS   4  10.883   0.710  -6.705
   28   1HG   LYS   4          HG2       LYS   4   7.978   0.096  -6.017
   29   2HG   LYS   4          HG3       LYS   4   9.096  -0.982  -6.819
   30   1HD   LYS   4          HD2       LYS   4   9.362   0.071  -3.987
   31   2HD   LYS   4          HD3       LYS   4   8.836  -1.550  -4.445
   32   1HE   LYS   4          HE2       LYS   4  11.593  -0.340  -4.938
   33   2HE   LYS   4          HE3       LYS   4  11.195  -1.501  -3.677
   34   1HZ   LYS   4          HZ1       LYS   4  10.803  -3.162  -5.323
   35   2HZ   LYS   4          HZ2       LYS   4  10.936  -2.100  -6.570
   36   3HZ   LYS   4          HZ3       LYS   4  12.251  -2.452  -5.662
   37    H    ILE   5           H        ILE   5  12.186   2.577  -6.615
   38    HA   ILE   5           HA       ILE   5  11.704   4.929  -8.295
   39    HB   ILE   5           HB       ILE   5  13.990   4.757  -6.305
   40   1HG1  ILE   5          HG12      ILE   5  12.862   7.046  -5.485
   41   2HG1  ILE   5          HG13      ILE   5  11.395   6.208  -5.966
   42   1HG2  ILE   5          HG21      ILE   5  14.585   5.963  -8.385
   43   2HG2  ILE   5          HG22      ILE   5  13.169   7.005  -8.188
   44   3HG2  ILE   5          HG23      ILE   5  14.516   7.081  -7.031
   45   1HD1  ILE   5          HD11      ILE   5  13.531   5.218  -4.024
   46   2HD1  ILE   5          HD12      ILE   5  11.937   5.860  -3.580
   47   3HD1  ILE   5          HD13      ILE   5  12.074   4.308  -4.428
   48    H    ILE   6           H        ILE   6  13.121   4.774 -10.152
   49    HA   ILE   6           HA       ILE   6  15.180   2.679 -10.148
   50    HB   ILE   6           HB       ILE   6  13.184   1.452 -10.786
   51   1HG1  ILE   6          HG12      ILE   6  14.920   1.896 -13.255
   52   2HG1  ILE   6          HG13      ILE   6  15.413   0.959 -11.840
   53   1HG2  ILE   6          HG21      ILE   6  12.874   3.354 -13.144
   54   2HG2  ILE   6          HG22      ILE   6  11.854   1.955 -12.773
   55   3HG2  ILE   6          HG23      ILE   6  11.825   3.347 -11.703
   56   1HD1  ILE   6          HD11      ILE   6  13.085   0.319 -13.692
   57   2HD1  ILE   6          HD12      ILE   6  14.626  -0.538 -13.562
   58   3HD1  ILE   6          HD13      ILE   6  13.486  -0.565 -12.198
   59    H    TYR   7           H        TYR   7  16.764   2.995 -11.791
   60    HA   TYR   7           HA       TYR   7  16.611   5.586 -13.230
   61   1HB   TYR   7          HB2       TYR   7  17.771   5.511 -10.890
   62   2HB   TYR   7          HB3       TYR   7  19.027   4.591 -11.682
   63    HD1  TYR   7           HD1      TYR   7  20.537   6.271 -10.727
   64    HD2  TYR   7           HD2      TYR   7  17.513   7.435 -13.579
   65    HE1  TYR   7           HE1      TYR   7  21.511   8.551 -10.851
   66    HE2  TYR   7           HE2      TYR   7  18.480   9.689 -13.695
   67    HH   TYR   7           HH       TYR   7  20.037  11.166 -12.782
   68    H    PHE   8           H        PHE   8  17.376   5.439 -15.287
   69    HA   PHE   8           HA       PHE   8  18.919   2.994 -16.115
   70   1HB   PHE   8          HB2       PHE   8  17.081   4.760 -17.790
   71   2HB   PHE   8          HB3       PHE   8  17.971   3.356 -18.354
   72    HD1  PHE   8           HD1      PHE   8  14.868   4.509 -16.976
   73    HD2  PHE   8           HD2      PHE   8  17.437   1.061 -17.227
   74    HE1  PHE   8           HE1      PHE   8  12.979   3.024 -16.383
   75    HE2  PHE   8           HE2      PHE   8  15.548  -0.407 -16.577
   76    HZ   PHE   8           HZ       PHE   8  13.318   0.585 -16.117
   77    H    LEU   9           H        LEU   9  20.930   3.388 -16.912
   78    HA   LEU   9           HA       LEU   9  21.732   6.234 -17.354
   79   1HB   LEU   9          HB2       LEU   9  23.198   3.960 -15.968
   80   2HB   LEU   9          HB3       LEU   9  23.876   5.551 -16.298
   81    HG   LEU   9           HG       LEU   9  21.598   4.903 -14.381
   82   1HD1  LEU   9          HD11      LEU   9  23.186   5.673 -12.675
   83   2HD1  LEU   9          HD12      LEU   9  23.884   4.337 -13.606
   84   3HD1  LEU   9          HD13      LEU   9  24.407   6.003 -13.920
   85   1HD2  LEU   9          HD21      LEU   9  22.728   7.572 -15.288
   86   2HD2  LEU   9          HD22      LEU   9  21.034   7.043 -15.287
   87   3HD2  LEU   9          HD23      LEU   9  21.840   7.362 -13.759
   88    H    CYS  10           H        CYS  10  23.031   6.620 -19.165
   89    HA   CYS  10           HA       CYS  10  24.674   4.377 -20.097
   90   1HB   CYS  10          HB2       CYS  10  23.932   4.327 -22.388
   91   2HB   CYS  10          HB3       CYS  10  22.560   4.007 -21.331
   92    HG   CYS  10           HG       CYS  10  22.019   5.495 -23.523
   93    H    THR  11           H        THR  11  25.734   5.310 -22.415
   94    HA   THR  11           HA       THR  11  27.578   7.175 -21.345
   95    HB   THR  11           HB       THR  11  28.571   6.905 -23.709
   96    HG1  THR  11           HG1      THR  11  27.603   4.799 -24.550
   97   1HG2  THR  11          HG21      THR  11  29.185   5.528 -21.688
   98   2HG2  THR  11          HG22      THR  11  27.941   4.349 -22.151
   99   3HG2  THR  11          HG23      THR  11  29.318   4.650 -23.229
  100    H    GLY  12           H        GLY  12  24.550   7.826 -22.812
  101   1HA   GLY  12          HA1       GLY  12  24.945  10.600 -22.381
  102   2HA   GLY  12          HA2       GLY  12  24.893  10.279 -24.127
  103    H    ASN  13           H        ASN  13  22.939  11.281 -21.756
  104    HA   ASN  13           HA       ASN  13  20.812   9.388 -21.702
  105   1HB   ASN  13          HB2       ASN  13  21.421  11.072 -19.890
  106   2HB   ASN  13          HB3       ASN  13  20.690  12.322 -20.906
  107   1HD2  ASN  13          HD22      ASN  13  19.255   8.944 -20.473
  108   2HD2  ASN  13          HD21      ASN  13  17.855   9.577 -19.638
  109    H    SER  14           H        SER  14  20.976   9.624 -24.364
  110    HA   SER  14           HA       SER  14  18.815  11.523 -25.163
  111   1HB   SER  14          HB2       SER  14  21.330  10.741 -26.666
  112   2HB   SER  14          HB3       SER  14  20.068  11.842 -27.254
  113    HG   SER  14           HG       SER  14  20.522  13.259 -25.656
  114    H    CYS  15           H        CYS  15  19.814   8.194 -25.279
  115    HA   CYS  15           HA       CYS  15  17.696   7.643 -27.309
  116   1HB   CYS  15          HB2       CYS  15  20.475   6.396 -27.289
  117   2HB   CYS  15          HB3       CYS  15  19.204   6.147 -28.487
  118    HG   CYS  15           HG       CYS  15  21.363   7.527 -29.218
  119    H    ARG  16           H        ARG  16  19.975   5.322 -25.883
  120    HA   ARG  16           HA       ARG  16  18.003   3.392 -25.438
  121   1HB   ARG  16          HB2       ARG  16  20.708   3.826 -24.100
  122   2HB   ARG  16          HB3       ARG  16  19.749   2.388 -23.830
  123   1HG   ARG  16          HG2       ARG  16  19.995   1.560 -25.986
  124   2HG   ARG  16          HG3       ARG  16  20.452   3.124 -26.673
  125   1HD   ARG  16          HD2       ARG  16  22.152   1.606 -24.645
  126   2HD   ARG  16          HD3       ARG  16  22.387   1.525 -26.400
  127    HE   ARG  16           HE       ARG  16  22.414   4.197 -26.049
  128   1HH1  ARG  16          HH21      ARG  16  24.300   1.711 -24.328
  129   2HH1  ARG  16          HH22      ARG  16  25.757   2.700 -24.430
  130   1HH2  ARG  16          HH11      ARG  16  24.020   5.499 -25.745
  131   2HH2  ARG  16          HH12      ARG  16  25.481   5.057 -24.881
  132    H    SER  17           H        SER  17  19.454   5.556 -22.927
  133    HA   SER  17           HA       SER  17  17.888   4.399 -20.830
  134   1HB   SER  17          HB2       SER  17  18.831   6.336 -19.541
  135   2HB   SER  17          HB3       SER  17  20.016   5.362 -20.387
  136    HG   SER  17           HG       SER  17  20.634   7.109 -21.304
  137    H    GLN  18           H        GLN  18  17.376   7.191 -22.964
  138    HA   GLN  18           HA       GLN  18  15.079   8.263 -21.642
  139   1HB   GLN  18          HB2       GLN  18  16.138   8.394 -24.501
  140   2HB   GLN  18          HB3       GLN  18  14.656   9.197 -24.027
  141   1HG   GLN  18          HG2       GLN  18  17.312   9.680 -22.618
  142   2HG   GLN  18          HG3       GLN  18  16.760  10.628 -23.997
  143   1HE2  GLN  18          HE22      GLN  18  17.086  11.186 -20.864
  144   2HE2  GLN  18          HE21      GLN  18  15.601  12.062 -20.571
  145    H    MET  19           H        MET  19  15.359   6.061 -24.449
  146    HA   MET  19           HA       MET  19  12.583   5.534 -24.721
  147   1HB   MET  19          HB2       MET  19  14.963   3.766 -25.450
  148   2HB   MET  19          HB3       MET  19  13.289   3.477 -25.932
  149   1HG   MET  19          HG2       MET  19  13.352   5.865 -26.936
  150   2HG   MET  19          HG3       MET  19  15.104   5.740 -26.806
  151   1HE   MET  19          HE1       MET  19  16.589   3.960 -28.136
  152   2HE   MET  19          HE2       MET  19  15.605   2.597 -27.547
  153   3HE   MET  19          HE3       MET  19  15.907   2.784 -29.286
  154    H    ALA  20           H        ALA  20  15.074   3.799 -22.753
  155    HA   ALA  20           HA       ALA  20  13.346   1.755 -21.812
  156   1HB   ALA  20          HB1       ALA  20  15.808   1.687 -21.575
  157   2HB   ALA  20          HB2       ALA  20  15.742   3.038 -20.417
  158   3HB   ALA  20          HB3       ALA  20  15.004   1.479 -20.006
  159    H    GLU  21           H        GLU  21  14.079   4.972 -20.376
  160    HA   GLU  21           HA       GLU  21  12.323   4.729 -18.181
  161   1HB   GLU  21          HB2       GLU  21  13.974   6.517 -18.454
  162   2HB   GLU  21          HB3       GLU  21  13.017   7.225 -19.771
  163   1HG   GLU  21          HG2       GLU  21  11.114   7.477 -18.089
  164   2HG   GLU  21          HG3       GLU  21  12.238   6.950 -16.844
  165    H    GLY  22           H        GLY  22  11.585   5.714 -21.586
  166   1HA   GLY  22          HA1       GLY  22   8.884   6.435 -21.242
  167   2HA   GLY  22          HA2       GLY  22   9.626   5.763 -22.719
  168    H    TRP  23           H        TRP  23  10.283   3.223 -22.132
  169    HA   TRP  23           HA       TRP  23   7.760   1.853 -22.168
  170   1HB   TRP  23          HB2       TRP  23  10.627   0.904 -21.769
  171   2HB   TRP  23          HB3       TRP  23   9.253  -0.191 -21.802
  172    HD1  TRP  23           HD1      TRP  23  11.631   1.494 -24.079
  173    HE1  TRP  23           HE1      TRP  23  11.061   1.002 -26.499
  174    HE3  TRP  23           HE3      TRP  23   6.939  -0.425 -23.403
  175    HZ2  TRP  23           HZ2      TRP  23   8.776  -0.035 -28.013
  176    HZ3  TRP  23           HZ3      TRP  23   5.638  -1.264 -25.331
  177    HH2  TRP  23           HH2      TRP  23   6.555  -1.108 -27.628
  178    H    ALA  24           H        ALA  24  10.239   2.252 -19.610
  179    HA   ALA  24           HA       ALA  24   9.019   0.537 -17.737
  180   1HB   ALA  24          HB1       ALA  24  11.360   1.256 -17.606
  181   2HB   ALA  24          HB2       ALA  24  10.858   2.926 -17.383
  182   3HB   ALA  24          HB3       ALA  24  10.525   1.713 -16.119
  183    H    LYS  25           H        LYS  25   8.642   4.097 -18.193
  184    HA   LYS  25           HA       LYS  25   6.863   4.572 -16.066
  185   1HB   LYS  25          HB2       LYS  25   7.223   5.807 -18.807
  186   2HB   LYS  25          HB3       LYS  25   5.869   6.305 -17.790
  187   1HG   LYS  25          HG2       LYS  25   7.348   6.955 -15.978
  188   2HG   LYS  25          HG3       LYS  25   8.773   6.402 -16.877
  189   1HD   LYS  25          HD2       LYS  25   8.715   8.198 -18.374
  190   2HD   LYS  25          HD3       LYS  25   6.979   8.428 -18.189
  191   1HE   LYS  25          HE2       LYS  25   8.045  10.316 -17.208
  192   2HE   LYS  25          HE3       LYS  25   7.280   9.368 -15.936
  193   1HZ   LYS  25          HZ1       LYS  25   9.522   8.503 -15.381
  194   2HZ   LYS  25          HZ2       LYS  25  10.200   9.460 -16.536
  195   3HZ   LYS  25          HZ3       LYS  25   9.447  10.117 -15.262
  196    H    GLN  26           H        GLN  26   6.158   3.054 -19.208
  197    HA   GLN  26           HA       GLN  26   3.319   3.010 -18.692
  198   1HB   GLN  26          HB2       GLN  26   4.671   1.074 -20.585
  199   2HB   GLN  26          HB3       GLN  26   3.023   1.676 -20.593
  200   1HG   GLN  26          HG2       GLN  26   5.558   3.019 -21.472
  201   2HG   GLN  26          HG3       GLN  26   4.096   2.718 -22.388
  202   1HE2  GLN  26          HE22      GLN  26   5.865   5.147 -20.998
  203   2HE2  GLN  26          HE21      GLN  26   4.591   6.330 -20.734
  204    H    TYR  27           H        TYR  27   5.734   0.352 -18.761
  205    HA   TYR  27           HA       TYR  27   3.890  -1.580 -17.818
  206   1HB   TYR  27          HB2       TYR  27   6.932  -1.600 -17.708
  207   2HB   TYR  27          HB3       TYR  27   5.912  -2.987 -17.369
  208    HD1  TYR  27           HD1      TYR  27   7.796  -1.449 -19.883
  209    HD2  TYR  27           HD2      TYR  27   4.105  -3.583 -19.266
  210    HE1  TYR  27           HE1      TYR  27   7.870  -2.248 -22.234
  211    HE2  TYR  27           HE2      TYR  27   4.100  -4.279 -21.638
  212    HH   TYR  27           HH       TYR  27   5.221  -4.200 -23.682
  213    H    LEU  28           H        LEU  28   6.309   0.338 -16.019
  214    HA   LEU  28           HA       LEU  28   5.749  -0.998 -13.497
  215   1HB   LEU  28          HB2       LEU  28   7.263   1.587 -14.032
  216   2HB   LEU  28          HB3       LEU  28   7.298   0.650 -12.568
  217    HG   LEU  28           HG       LEU  28   8.362  -0.290 -15.258
  218   1HD1  LEU  28          HD11      LEU  28   9.666   1.494 -14.078
  219   2HD1  LEU  28          HD12      LEU  28   9.870   0.379 -12.708
  220   3HD1  LEU  28          HD13      LEU  28  10.547  -0.031 -14.299
  221   1HD2  LEU  28          HD21      LEU  28   9.287  -2.218 -14.039
  222   2HD2  LEU  28          HD22      LEU  28   8.459  -1.698 -12.557
  223   3HD2  LEU  28          HD23      LEU  28   7.532  -2.227 -13.976
  224    H    GLY  29           H        GLY  29   3.949   1.286 -15.200
  225   1HA   GLY  29          HA1       GLY  29   2.152   2.552 -14.674
  226   2HA   GLY  29          HA2       GLY  29   1.927   1.377 -13.369
  227    H    ASP  30           H        ASP  30   4.649   3.611 -13.495
  228    HA   ASP  30           HA       ASP  30   5.497   5.117 -12.114
  229   1HB   ASP  30          HB2       ASP  30   3.705   6.446 -13.080
  230   2HB   ASP  30          HB3       ASP  30   2.647   6.040 -11.727
  231    H    GLU  31           H        GLU  31   4.056   2.507 -10.897
  232    HA   GLU  31           HA       GLU  31   4.055   3.065  -8.063
  233   1HB   GLU  31          HB2       GLU  31   4.622   0.355  -9.322
  234   2HB   GLU  31          HB3       GLU  31   3.999   0.714  -7.716
  235   1HG   GLU  31          HG2       GLU  31   1.939   1.696  -8.918
  236   2HG   GLU  31          HG3       GLU  31   2.591   0.938 -10.384
  237    H    TRP  32           H        TRP  32   6.417   3.134 -10.364
  238    HA   TRP  32           HA       TRP  32   8.625   2.979  -8.451
  239   1HB   TRP  32          HB2       TRP  32   8.781   2.092 -11.361
  240   2HB   TRP  32          HB3       TRP  32  10.060   2.012 -10.169
  241    HD1  TRP  32           HD1      TRP  32   6.483   0.498 -10.432
  242    HE1  TRP  32           HE1      TRP  32   6.520  -1.939  -9.796
  243    HE3  TRP  32           HE3      TRP  32  11.506   0.004  -9.515
  244    HZ2  TRP  32           HZ2      TRP  32   8.499  -3.963  -9.325
  245    HZ3  TRP  32           HZ3      TRP  32  12.447  -2.242  -9.055
  246    HH2  TRP  32           HH2      TRP  32  10.961  -4.252  -9.037
  247    H    LYS  33           H        LYS  33   9.410   5.061  -8.410
  248    HA   LYS  33           HA       LYS  33   8.649   7.066 -10.326
  249   1HB   LYS  33          HB2       LYS  33  10.711   6.999  -8.068
  250   2HB   LYS  33          HB3       LYS  33  10.328   8.440  -9.022
  251   1HG   LYS  33          HG2       LYS  33   8.631   6.992  -6.991
  252   2HG   LYS  33          HG3       LYS  33   9.165   8.658  -6.977
  253   1HD   LYS  33          HD2       LYS  33   7.035   7.459  -8.801
  254   2HD   LYS  33          HD3       LYS  33   6.768   8.511  -7.413
  255   1HE   LYS  33          HE2       LYS  33   7.891  10.380  -8.517
  256   2HE   LYS  33          HE3       LYS  33   8.353   9.354  -9.882
  257   1HZ   LYS  33          HZ1       LYS  33   5.566  10.025  -9.149
  258   2HZ   LYS  33          HZ2       LYS  33   6.399  10.660 -10.399
  259   3HZ   LYS  33          HZ3       LYS  33   6.009   9.066 -10.406
  260    H    VAL  34           H        VAL  34   9.313   6.562 -12.358
  261    HA   VAL  34           HA       VAL  34  11.886   5.374 -12.834
  262    HB   VAL  34           HB       VAL  34   9.994   6.423 -14.950
  263   1HG1  VAL  34          HG11      VAL  34  12.309   5.279 -15.400
  264   2HG1  VAL  34          HG12      VAL  34  11.462   3.790 -14.954
  265   3HG1  VAL  34          HG13      VAL  34  10.878   4.785 -16.315
  266   1HG2  VAL  34          HG21      VAL  34   8.404   5.226 -13.638
  267   2HG2  VAL  34          HG22      VAL  34   8.868   4.146 -14.945
  268   3HG2  VAL  34          HG23      VAL  34   9.547   3.894 -13.326
  269    H    TYR  35           H        TYR  35  13.716   6.405 -13.521
  270    HA   TYR  35           HA       TYR  35  13.568   9.110 -14.747
  271   1HB   TYR  35          HB2       TYR  35  15.451   8.249 -12.507
  272   2HB   TYR  35          HB3       TYR  35  15.538   9.771 -13.372
  273    HD1  TYR  35           HD1      TYR  35  14.066   8.016 -10.578
  274    HD2  TYR  35           HD2      TYR  35  13.603  11.440 -13.165
  275    HE1  TYR  35           HE1      TYR  35  12.651   9.108  -8.871
  276    HE2  TYR  35           HE2      TYR  35  12.152  12.527 -11.475
  277    HH   TYR  35           HH       TYR  35  11.398  10.999  -8.307
  278    H    SER  36           H        SER  36  15.736   9.625 -15.828
  279    HA   SER  36           HA       SER  36  17.555   7.381 -16.134
  280   1HB   SER  36          HB2       SER  36  17.652   7.555 -18.552
  281   2HB   SER  36          HB3       SER  36  16.047   7.041 -18.040
  282    HG   SER  36           HG       SER  36  15.273   9.079 -18.464
  283    H    ALA  37           H        ALA  37  19.625   8.074 -17.113
  284    HA   ALA  37           HA       ALA  37  20.178  10.859 -17.526
  285   1HB   ALA  37          HB1       ALA  37  21.299   9.604 -14.984
  286   2HB   ALA  37          HB2       ALA  37  21.746  11.183 -15.664
  287   3HB   ALA  37          HB3       ALA  37  20.119  10.930 -15.073
  288    H    GLY  38           H        GLY  38  22.947  10.839 -17.203
  289   1HA   GLY  38          HA1       GLY  38  24.216   8.411 -17.940
  290   2HA   GLY  38          HA2       GLY  38  23.939   9.401 -19.387
  291    H    ILE  39           H        ILE  39  26.422   8.978 -19.008
  292    HA   ILE  39           HA       ILE  39  27.974  10.702 -17.377
  293    HB   ILE  39           HB       ILE  39  28.287   9.044 -19.844
  294   1HG1  ILE  39          HG12      ILE  39  30.101   9.363 -17.415
  295   2HG1  ILE  39          HG13      ILE  39  28.655   8.371 -17.391
  296   1HG2  ILE  39          HG21      ILE  39  30.387  11.128 -19.187
  297   2HG2  ILE  39          HG22      ILE  39  30.571   9.781 -20.336
  298   3HG2  ILE  39          HG23      ILE  39  29.396  11.041 -20.668
  299   1HD1  ILE  39          HD11      ILE  39  29.564   6.985 -19.258
  300   2HD1  ILE  39          HD12      ILE  39  31.068   7.937 -19.198
  301   3HD1  ILE  39          HD13      ILE  39  30.589   6.961 -17.810
  302    H    GLU  40           H        GLU  40  26.002  11.443 -20.190
  303    HA   GLU  40           HA       GLU  40  26.449  14.231 -19.712
  304   1HB   GLU  40          HB2       GLU  40  26.793  14.872 -22.021
  305   2HB   GLU  40          HB3       GLU  40  28.155  13.936 -21.417
  306   1HG   GLU  40          HG2       GLU  40  27.500  11.978 -22.656
  307   2HG   GLU  40          HG3       GLU  40  25.911  12.647 -23.032
  308    H    ALA  41           H        ALA  41  24.787  15.483 -21.065
  309    HA   ALA  41           HA       ALA  41  22.615  13.954 -22.237
  310   1HB   ALA  41          HB1       ALA  41  21.885  14.068 -19.889
  311   2HB   ALA  41          HB2       ALA  41  22.197  15.819 -19.844
  312   3HB   ALA  41          HB3       ALA  41  20.904  15.178 -20.874
  313    H    HIS  42           H        HIS  42  21.911  15.115 -23.960
  314    HA   HIS  42           HA       HIS  42  22.268  18.056 -24.056
  315   1HB   HIS  42          HB2       HIS  42  23.276  16.028 -26.097
  316   2HB   HIS  42          HB3       HIS  42  23.004  17.725 -26.489
  317    HD1  HIS  42           HD1      HIS  42  25.760  15.585 -25.075
  318    HD2  HIS  42           HD2      HIS  42  24.387  19.582 -24.896
  319    HE1  HIS  42           HE1      HIS  42  27.675  16.967 -24.185
  320    H    GLY  43           H        GLY  43  20.028  16.159 -23.507
  321   1HA   GLY  43          HA1       GLY  43  17.726  16.449 -23.931
  322   2HA   GLY  43          HA2       GLY  43  18.077  17.176 -25.503
  323    H    LEU  44           H        LEU  44  16.196  15.240 -25.441
  324    HA   LEU  44           HA       LEU  44  17.430  12.655 -26.012
  325   1HB   LEU  44          HB2       LEU  44  15.326  11.694 -25.973
  326   2HB   LEU  44          HB3       LEU  44  15.404  12.811 -24.615
  327    HG   LEU  44           HG       LEU  44  13.896  13.143 -27.232
  328   1HD1  LEU  44          HD11      LEU  44  12.867  12.984 -24.357
  329   2HD1  LEU  44          HD12      LEU  44  11.951  12.835 -25.873
  330   3HD1  LEU  44          HD13      LEU  44  13.077  11.570 -25.393
  331   1HD2  LEU  44          HD21      LEU  44  12.835  15.167 -26.203
  332   2HD2  LEU  44          HD22      LEU  44  14.035  15.112 -24.897
  333   3HD2  LEU  44          HD23      LEU  44  14.532  15.419 -26.584
  334    H    ASN  45           H        ASN  45  17.202  11.500 -27.934
  335    HA   ASN  45           HA       ASN  45  17.790  13.157 -30.217
  336   1HB   ASN  45          HB2       ASN  45  18.872  10.976 -29.587
  337   2HB   ASN  45          HB3       ASN  45  17.388  10.138 -30.017
  338   1HD2  ASN  45          HD22      ASN  45  20.350  10.567 -31.152
  339   2HD2  ASN  45          HD21      ASN  45  20.049  10.681 -32.872
  340    HA   PRO  46           HA       PRO  46  13.533  13.416 -31.769
  341   1HB   PRO  46          HB2       PRO  46  14.968  13.416 -34.432
  342   2HB   PRO  46          HB3       PRO  46  13.593  14.432 -33.897
  343   1HG   PRO  46          HG2       PRO  46  16.108  15.438 -33.883
  344   2HG   PRO  46          HG3       PRO  46  15.015  15.744 -32.492
  345   1HD   PRO  46          HD2       PRO  46  17.251  13.725 -32.718
  346   2HD   PRO  46          HD3       PRO  46  16.805  14.779 -31.342
  347    H    ASN  47           H        ASN  47  15.872  11.020 -33.080
  348    HA   ASN  47           HA       ASN  47  13.775   9.400 -34.312
  349   1HB   ASN  47          HB2       ASN  47  16.705   8.904 -33.717
  350   2HB   ASN  47          HB3       ASN  47  15.641   7.648 -34.339
  351   1HD2  ASN  47          HD22      ASN  47  18.042   8.956 -35.609
  352   2HD2  ASN  47          HD21      ASN  47  17.448   9.503 -37.155
  353    H    ALA  48           H        ALA  48  15.236   9.658 -31.103
  354    HA   ALA  48           HA       ALA  48  14.248   7.148 -30.104
  355   1HB   ALA  48          HB1       ALA  48  14.693   9.687 -28.466
  356   2HB   ALA  48          HB2       ALA  48  14.748   8.007 -27.926
  357   3HB   ALA  48          HB3       ALA  48  16.028   8.650 -28.971
  358    H    VAL  49           H        VAL  49  13.055  10.546 -30.157
  359    HA   VAL  49           HA       VAL  49  10.574  10.065 -28.925
  360    HB   VAL  49           HB       VAL  49  11.263  12.164 -31.032
  361   1HG1  VAL  49          HG11      VAL  49   8.853  12.058 -30.791
  362   2HG1  VAL  49          HG12      VAL  49   8.981  12.059 -29.012
  363   3HG1  VAL  49          HG13      VAL  49   9.444  13.492 -29.959
  364   1HG2  VAL  49          HG21      VAL  49  11.366  12.270 -27.994
  365   2HG2  VAL  49          HG22      VAL  49  12.769  12.287 -29.085
  366   3HG2  VAL  49          HG23      VAL  49  11.647  13.645 -29.086
  367    H    LYS  50           H        LYS  50  11.383  10.022 -32.479
  368    HA   LYS  50           HA       LYS  50   8.805   9.206 -33.340
  369   1HB   LYS  50          HB2       LYS  50  11.578   8.730 -34.520
  370   2HB   LYS  50          HB3       LYS  50  10.119   8.213 -35.335
  371   1HG   LYS  50          HG2       LYS  50  10.792  11.097 -34.604
  372   2HG   LYS  50          HG3       LYS  50  10.975  10.364 -36.191
  373   1HD   LYS  50          HD2       LYS  50   8.353  10.884 -34.726
  374   2HD   LYS  50          HD3       LYS  50   8.990  11.744 -36.127
  375   1HE   LYS  50          HE2       LYS  50   8.889   9.613 -37.454
  376   2HE   LYS  50          HE3       LYS  50   8.138   8.810 -36.068
  377   1HZ   LYS  50          HZ1       LYS  50   6.990  11.116 -37.535
  378   2HZ   LYS  50          HZ2       LYS  50   6.486   9.574 -37.648
  379   3HZ   LYS  50          HZ3       LYS  50   6.291  10.386 -36.249
  380    H    ALA  51           H        ALA  51  11.585   7.171 -32.289
  381    HA   ALA  51           HA       ALA  51  10.396   4.696 -32.951
  382   1HB   ALA  51          HB1       ALA  51  12.789   5.004 -32.326
  383   2HB   ALA  51          HB2       ALA  51  12.311   5.348 -30.655
  384   3HB   ALA  51          HB3       ALA  51  12.014   3.745 -31.353
  385    H    MET  52           H        MET  52  10.192   6.627 -29.891
  386    HA   MET  52           HA       MET  52   8.479   4.697 -28.623
  387   1HB   MET  52          HB2       MET  52   8.867   7.659 -28.028
  388   2HB   MET  52          HB3       MET  52   8.014   6.512 -26.999
  389   1HG   MET  52          HG2       MET  52  10.960   6.612 -27.641
  390   2HG   MET  52          HG3       MET  52  10.171   6.724 -26.081
  391   1HE   MET  52          HE1       MET  52   9.121   3.021 -25.386
  392   2HE   MET  52          HE2       MET  52   8.917   4.723 -24.965
  393   3HE   MET  52          HE3       MET  52   8.141   4.052 -26.435
  394    H    LYS  53           H        LYS  53   7.758   7.601 -30.629
  395    HA   LYS  53           HA       LYS  53   4.949   7.431 -30.266
  396   1HB   LYS  53          HB2       LYS  53   6.758   8.699 -32.290
  397   2HB   LYS  53          HB3       LYS  53   5.107   8.362 -32.805
  398   1HG   LYS  53          HG2       LYS  53   5.046  10.559 -31.933
  399   2HG   LYS  53          HG3       LYS  53   4.237   9.515 -30.758
  400   1HD   LYS  53          HD2       LYS  53   6.490   9.456 -29.493
  401   2HD   LYS  53          HD3       LYS  53   7.015  10.748 -30.566
  402   1HE   LYS  53          HE2       LYS  53   4.571  10.783 -28.744
  403   2HE   LYS  53          HE3       LYS  53   6.135  11.503 -28.346
  404   1HZ   LYS  53          HZ1       LYS  53   4.377  12.397 -30.557
  405   2HZ   LYS  53          HZ2       LYS  53   4.636  13.180 -29.155
  406   3HZ   LYS  53          HZ3       LYS  53   5.853  13.025 -30.221
  407    H    GLU  54           H        GLU  54   7.123   5.424 -32.224
  408    HA   GLU  54           HA       GLU  54   5.089   4.424 -33.937
  409   1HB   GLU  54          HB2       GLU  54   7.555   4.365 -34.382
  410   2HB   GLU  54          HB3       GLU  54   7.689   3.042 -33.219
  411   1HG   GLU  54          HG2       GLU  54   6.207   1.637 -34.570
  412   2HG   GLU  54          HG3       GLU  54   5.830   2.989 -35.640
  413    H    VAL  55           H        VAL  55   5.762   3.838 -30.590
  414    HA   VAL  55           HA       VAL  55   3.970   1.444 -30.625
  415    HB   VAL  55           HB       VAL  55   5.078   0.818 -28.507
  416   1HG1  VAL  55          HG11      VAL  55   6.958   1.183 -30.891
  417   2HG1  VAL  55          HG12      VAL  55   7.136  -0.001 -29.589
  418   3HG1  VAL  55          HG13      VAL  55   5.766  -0.117 -30.695
  419   1HG2  VAL  55          HG21      VAL  55   5.878   3.149 -27.891
  420   2HG2  VAL  55          HG22      VAL  55   7.111   1.904 -27.761
  421   3HG2  VAL  55          HG23      VAL  55   7.124   2.985 -29.153
  422    H    GLY  56           H        GLY  56   3.868   4.724 -29.987
  423   1HA   GLY  56          HA1       GLY  56   1.917   5.817 -29.364
  424   2HA   GLY  56          HA2       GLY  56   1.286   4.338 -28.619
  425    H    ILE  57           H        ILE  57   4.529   5.745 -28.053
  426    HA   ILE  57           HA       ILE  57   3.769   6.501 -25.274
  427    HB   ILE  57           HB       ILE  57   6.239   5.066 -26.322
  428   1HG1  ILE  57          HG12      ILE  57   4.247   4.257 -24.166
  429   2HG1  ILE  57          HG13      ILE  57   4.226   3.656 -25.817
  430   1HG2  ILE  57          HG21      ILE  57   7.086   5.181 -23.909
  431   2HG2  ILE  57          HG22      ILE  57   7.089   6.710 -24.758
  432   3HG2  ILE  57          HG23      ILE  57   5.800   6.345 -23.589
  433   1HD1  ILE  57          HD11      ILE  57   6.416   3.107 -23.788
  434   2HD1  ILE  57          HD12      ILE  57   5.228   1.980 -24.451
  435   3HD1  ILE  57          HD13      ILE  57   6.479   2.649 -25.505
  436    H    ASP  58           H        ASP  58   5.243   8.241 -24.504
  437    HA   ASP  58           HA       ASP  58   6.606   9.785 -26.595
  438   1HB   ASP  58          HB2       ASP  58   4.521  11.024 -26.387
  439   2HB   ASP  58          HB3       ASP  58   4.603  10.949 -24.617
  440    H    ILE  59           H        ILE  59   8.376  10.768 -25.813
  441    HA   ILE  59           HA       ILE  59   9.103  10.527 -22.948
  442    HB   ILE  59           HB       ILE  59  11.482  10.032 -23.756
  443   1HG1  ILE  59          HG12      ILE  59  10.128   9.086 -26.317
  444   2HG1  ILE  59          HG13      ILE  59  11.023  10.591 -26.194
  445   1HG2  ILE  59          HG21      ILE  59   9.984   8.395 -22.648
  446   2HG2  ILE  59          HG22      ILE  59   9.364   7.884 -24.227
  447   3HG2  ILE  59          HG23      ILE  59  11.066   7.614 -23.798
  448   1HD1  ILE  59          HD11      ILE  59  12.427   8.847 -27.139
  449   2HD1  ILE  59          HD12      ILE  59  13.074   9.340 -25.574
  450   3HD1  ILE  59          HD13      ILE  59  12.195   7.810 -25.728
  451    H    SER  60           H        SER  60   8.581  12.537 -25.646
  452    HA   SER  60           HA       SER  60  10.709  14.428 -25.220
  453   1HB   SER  60          HB2       SER  60   9.395  15.956 -26.568
  454   2HB   SER  60          HB3       SER  60   9.509  14.363 -27.321
  455    HG   SER  60           HG       SER  60   7.397  13.910 -26.542
  456    H    ASN  61           H        ASN  61   7.686  13.801 -23.617
  457    HA   ASN  61           HA       ASN  61   7.431  16.127 -22.033
  458   1HB   ASN  61          HB2       ASN  61   5.640  14.542 -22.172
  459   2HB   ASN  61          HB3       ASN  61   6.677  13.204 -21.688
  460   1HD2  ASN  61          HD22      ASN  61   6.777  12.647 -19.529
  461   2HD2  ASN  61          HD21      ASN  61   6.071  13.592 -18.243
  462    H    GLN  62           H        GLN  62   9.856  13.530 -21.746
  463    HA   GLN  62           HA       GLN  62  10.118  14.162 -18.851
  464   1HB   GLN  62          HB2       GLN  62  10.964  12.085 -18.485
  465   2HB   GLN  62          HB3       GLN  62   9.783  11.810 -19.758
  466   1HG   GLN  62          HG2       GLN  62  11.910  12.060 -21.341
  467   2HG   GLN  62          HG3       GLN  62  12.804  11.747 -19.871
  468   1HE2  GLN  62          HE22      GLN  62  13.263  10.070 -21.784
  469   2HE2  GLN  62          HE21      GLN  62  12.491   8.496 -21.551
  470    H    THR  63           H        THR  63  11.891  14.484 -21.863
  471    HA   THR  63           HA       THR  63  13.890  15.288 -22.440
  472    HB   THR  63           HB       THR  63  14.656  17.375 -21.366
  473    HG1  THR  63           HG1      THR  63  13.045  16.493 -19.362
  474   1HG2  THR  63          HG21      THR  63  11.646  17.322 -21.828
  475   2HG2  THR  63          HG22      THR  63  12.728  18.725 -21.944
  476   3HG2  THR  63          HG23      THR  63  12.883  17.395 -23.103
  477    H    SER  64           H        SER  64  16.260  16.109 -21.263
  478    HA   SER  64           HA       SER  64  17.113  13.605 -19.949
  479   1HB   SER  64          HB2       SER  64  18.567  15.350 -21.971
  480   2HB   SER  64          HB3       SER  64  19.078  13.773 -21.370
  481    HG   SER  64           HG       SER  64  18.019  12.960 -22.904
  482    H    ASP  65           H        ASP  65  19.056  13.730 -18.653
  483    HA   ASP  65           HA       ASP  65  20.240  16.308 -18.040
  484   1HB   ASP  65          HB2       ASP  65  18.184  16.243 -16.550
  485   2HB   ASP  65          HB3       ASP  65  18.835  14.783 -15.803
  486    H    ILE  66           H        ILE  66  22.117  16.010 -16.604
  487    HA   ILE  66           HA       ILE  66  23.487  13.443 -17.000
  488    HB   ILE  66           HB       ILE  66  25.170  14.754 -15.401
  489   1HG1  ILE  66          HG12      ILE  66  23.572  16.787 -15.224
  490   2HG1  ILE  66          HG13      ILE  66  25.291  17.023 -15.462
  491   1HG2  ILE  66          HG21      ILE  66  26.333  15.512 -17.429
  492   2HG2  ILE  66          HG22      ILE  66  25.695  13.867 -17.544
  493   3HG2  ILE  66          HG23      ILE  66  24.847  15.197 -18.366
  494   1HD1  ILE  66          HD11      ILE  66  23.952  18.577 -16.836
  495   2HD1  ILE  66          HD12      ILE  66  25.002  17.555 -17.828
  496   3HD1  ILE  66          HD13      ILE  66  23.267  17.215 -17.738
  497    H    ILE  67           H        ILE  67  24.490  12.438 -15.086
  498    HA   ILE  67           HA       ILE  67  22.537  11.457 -13.353
  499    HB   ILE  67           HB       ILE  67  25.567  11.341 -13.419
  500   1HG1  ILE  67          HG12      ILE  67  23.428   9.206 -13.820
  501   2HG1  ILE  67          HG13      ILE  67  24.030  10.192 -15.143
  502   1HG2  ILE  67          HG21      ILE  67  24.984  11.049 -11.037
  503   2HG2  ILE  67          HG22      ILE  67  23.752   9.845 -11.480
  504   3HG2  ILE  67          HG23      ILE  67  25.483   9.520 -11.743
  505   1HD1  ILE  67          HD11      ILE  67  25.661   8.206 -13.530
  506   2HD1  ILE  67          HD12      ILE  67  25.145   8.102 -15.220
  507   3HD1  ILE  67          HD13      ILE  67  26.333   9.333 -14.738
  508    H    ASP  68           H        ASP  68  22.094  11.720 -11.207
  509    HA   ASP  68           HA       ASP  68  23.429  13.888  -9.691
  510   1HB   ASP  68          HB2       ASP  68  21.326  14.780 -10.803
  511   2HB   ASP  68          HB3       ASP  68  20.403  13.640  -9.817
  512    H    SER  69           H        SER  69  23.757  13.369  -7.598
  513    HA   SER  69           HA       SER  69  23.655  10.792  -6.642
  514   1HB   SER  69          HB2       SER  69  23.637  13.320  -4.974
  515   2HB   SER  69          HB3       SER  69  24.354  11.751  -4.558
  516    HG   SER  69           HG       SER  69  25.913  13.261  -5.326
  517    H    ASP  70           H        ASP  70  21.080  13.183  -6.587
  518    HA   ASP  70           HA       ASP  70  19.670  12.185  -4.294
  519   1HB   ASP  70          HB2       ASP  70  19.486  14.502  -5.160
  520   2HB   ASP  70          HB3       ASP  70  18.693  13.884  -6.615
  521    H    ILE  71           H        ILE  71  20.020  10.950  -7.449
  522    HA   ILE  71           HA       ILE  71  17.590   9.251  -7.156
  523    HB   ILE  71           HB       ILE  71  19.083   9.975  -9.689
  524   1HG1  ILE  71          HG12      ILE  71  16.231  10.873  -9.189
  525   2HG1  ILE  71          HG13      ILE  71  17.526  11.843  -8.505
  526   1HG2  ILE  71          HG21      ILE  71  17.121   8.867 -10.780
  527   2HG2  ILE  71          HG22      ILE  71  18.022   7.767  -9.728
  528   3HG2  ILE  71          HG23      ILE  71  16.480   8.448  -9.176
  529   1HD1  ILE  71          HD11      ILE  71  17.327  11.140 -11.447
  530   2HD1  ILE  71          HD12      ILE  71  16.908  12.694 -10.694
  531   3HD1  ILE  71          HD13      ILE  71  18.589  12.129 -10.661
  532    H    LEU  72           H        LEU  72  21.084   9.371  -8.090
  533    HA   LEU  72           HA       LEU  72  21.639   6.673  -8.394
  534   1HB   LEU  72          HB2       LEU  72  23.251   8.751  -6.859
  535   2HB   LEU  72          HB3       LEU  72  23.841   7.138  -7.153
  536    HG   LEU  72           HG       LEU  72  23.206   9.141  -9.325
  537   1HD1  LEU  72          HD11      LEU  72  25.747   9.177  -9.492
  538   2HD1  LEU  72          HD12      LEU  72  25.107   9.848  -7.990
  539   3HD1  LEU  72          HD13      LEU  72  25.807   8.219  -8.009
  540   1HD2  LEU  72          HD21      LEU  72  22.972   6.804 -10.141
  541   2HD2  LEU  72          HD22      LEU  72  24.454   7.510 -10.782
  542   3HD2  LEU  72          HD23      LEU  72  24.533   6.380  -9.422
  543    H    ASN  73           H        ASN  73  21.859   8.357  -5.243
  544    HA   ASN  73           HA       ASN  73  22.179   5.854  -3.867
  545   1HB   ASN  73          HB2       ASN  73  22.862   7.050  -2.076
  546   2HB   ASN  73          HB3       ASN  73  23.099   8.304  -3.278
  547   1HD2  ASN  73          HD22      ASN  73  21.042   9.843  -3.548
  548   2HD2  ASN  73          HD21      ASN  73  20.196  10.221  -2.065
  549    H    ASN  74           H        ASN  74  19.420   7.047  -5.098
  550    HA   ASN  74           HA       ASN  74  17.656   6.458  -2.755
  551   1HB   ASN  74          HB2       ASN  74  17.836   8.802  -3.542
  552   2HB   ASN  74          HB3       ASN  74  17.422   8.280  -5.170
  553   1HD2  ASN  74          HD22      ASN  74  15.879  10.046  -4.880
  554   2HD2  ASN  74          HD21      ASN  74  14.300   9.670  -4.203
  555    H    ALA  75           H        ALA  75  18.264   5.876  -6.195
  556    HA   ALA  75           HA       ALA  75  15.859   4.567  -6.886
  557   1HB   ALA  75          HB1       ALA  75  17.078   3.819  -8.827
  558   2HB   ALA  75          HB2       ALA  75  17.395   5.528  -8.502
  559   3HB   ALA  75          HB3       ALA  75  18.621   4.312  -8.075
  560    H    ASP  76           H        ASP  76  15.090   2.623  -6.413
  561    HA   ASP  76           HA       ASP  76  16.447   0.832  -4.623
  562   1HB   ASP  76          HB2       ASP  76  13.995   1.007  -4.696
  563   2HB   ASP  76          HB3       ASP  76  13.988   0.420  -6.363
  564    H    LEU  77           H        LEU  77  16.343   1.238  -8.080
  565    HA   LEU  77           HA       LEU  77  18.386  -0.854  -8.395
  566   1HB   LEU  77          HB2       LEU  77  16.330  -2.077  -8.959
  567   2HB   LEU  77          HB3       LEU  77  15.801  -0.761 -10.009
  568    HG   LEU  77           HG       LEU  77  17.721  -1.197 -11.539
  569   1HD1  LEU  77          HD11      LEU  77  19.315  -2.255  -9.925
  570   2HD1  LEU  77          HD12      LEU  77  18.223  -3.655  -9.804
  571   3HD1  LEU  77          HD13      LEU  77  19.027  -3.260 -11.339
  572   1HD2  LEU  77          HD21      LEU  77  15.990  -3.621 -10.957
  573   2HD2  LEU  77          HD22      LEU  77  15.547  -2.226 -11.965
  574   3HD2  LEU  77          HD23      LEU  77  16.856  -3.296 -12.475
  575    H    VAL  78           H        VAL  78  19.908  -0.222  -9.841
  576    HA   VAL  78           HA       VAL  78  19.313   2.058 -11.660
  577    HB   VAL  78           HB       VAL  78  21.976   1.337 -10.355
  578   1HG1  VAL  78          HG11      VAL  78  22.720   3.521 -11.336
  579   2HG1  VAL  78          HG12      VAL  78  22.329   2.318 -12.567
  580   3HG1  VAL  78          HG13      VAL  78  21.182   3.630 -12.212
  581   1HG2  VAL  78          HG21      VAL  78  20.130   3.711  -9.824
  582   2HG2  VAL  78          HG22      VAL  78  20.474   2.388  -8.697
  583   3HG2  VAL  78          HG23      VAL  78  21.762   3.500  -9.154
  584    H    VAL  79           H        VAL  79  19.941   1.623 -13.860
  585    HA   VAL  79           HA       VAL  79  21.197  -1.031 -14.356
  586    HB   VAL  79           HB       VAL  79  18.949   0.095 -16.037
  587   1HG1  VAL  79          HG11      VAL  79  20.482  -1.536 -17.127
  588   2HG1  VAL  79          HG12      VAL  79  20.127  -2.709 -15.846
  589   3HG1  VAL  79          HG13      VAL  79  18.846  -2.177 -16.953
  590   1HG2  VAL  79          HG21      VAL  79  17.864  -0.368 -13.926
  591   2HG2  VAL  79          HG22      VAL  79  17.459  -1.661 -15.053
  592   3HG2  VAL  79          HG23      VAL  79  18.684  -1.941 -13.797
  593    H    THR  80           H        THR  80  22.938  -0.817 -15.671
  594    HA   THR  80           HA       THR  80  23.254   1.739 -17.164
  595    HB   THR  80           HB       THR  80  25.629   0.701 -17.529
  596    HG1  THR  80           HG1      THR  80  25.054  -1.297 -16.419
  597   1HG2  THR  80          HG21      THR  80  25.135   2.769 -16.321
  598   2HG2  THR  80          HG22      THR  80  24.738   1.841 -14.851
  599   3HG2  THR  80          HG23      THR  80  26.397   1.855 -15.500
  600    H    LEU  81           H        LEU  81  23.093   1.778 -19.300
  601    HA   LEU  81           HA       LEU  81  22.440  -0.773 -20.699
  602   1HB   LEU  81          HB2       LEU  81  21.621   2.103 -21.238
  603   2HB   LEU  81          HB3       LEU  81  21.329   0.781 -22.352
  604    HG   LEU  81           HG       LEU  81  19.889  -0.357 -20.724
  605   1HD1  LEU  81          HD11      LEU  81  19.010   0.967 -18.763
  606   2HD1  LEU  81          HD12      LEU  81  20.636   0.375 -18.553
  607   3HD1  LEU  81          HD13      LEU  81  20.373   2.089 -18.966
  608   1HD2  LEU  81          HD21      LEU  81  19.160   2.538 -21.313
  609   2HD2  LEU  81          HD22      LEU  81  18.801   1.105 -22.309
  610   3HD2  LEU  81          HD23      LEU  81  18.007   1.314 -20.760
  611    H    CYS  82           H        CYS  82  25.207   0.381 -20.174
  612    HA   CYS  82           HA       CYS  82  26.269   1.368 -22.651
  613   1HB   CYS  82          HB2       CYS  82  28.450   0.890 -21.547
  614   2HB   CYS  82          HB3       CYS  82  27.400   2.004 -20.681
  615    H    GLY  83           H        GLY  83  26.338   0.088 -24.459
  616   1HA   GLY  83          HA1       GLY  83  27.990  -2.278 -24.376
  617   2HA   GLY  83          HA2       GLY  83  26.319  -2.634 -24.823
  618    H    ASP  84           H        ASP  84  27.765   0.472 -25.468
  619    HA   ASP  84           HA       ASP  84  27.484   0.202 -28.386
  620   1HB   ASP  84          HB2       ASP  84  27.039   2.601 -28.271
  621   2HB   ASP  84          HB3       ASP  84  26.068   1.815 -27.023
  622    H    ALA  85           H        ALA  85  28.890   2.152 -29.443
  623    HA   ALA  85           HA       ALA  85  31.485   1.071 -29.466
  624   1HB   ALA  85          HB1       ALA  85  30.626   3.804 -30.493
  625   2HB   ALA  85          HB2       ALA  85  32.047   2.878 -30.999
  626   3HB   ALA  85          HB3       ALA  85  30.425   2.265 -31.371
  627    H    ALA  86           H        ALA  86  30.234   3.606 -27.350
  628    HA   ALA  86           HA       ALA  86  32.948   4.547 -26.643
  629   1HB   ALA  86          HB1       ALA  86  30.235   5.354 -25.507
  630   2HB   ALA  86          HB2       ALA  86  31.795   6.151 -25.231
  631   3HB   ALA  86          HB3       ALA  86  31.070   6.174 -26.846
  632    H    ASP  87           H        ASP  87  30.165   2.877 -25.178
  633    HA   ASP  87           HA       ASP  87  29.895   1.596 -23.328
  634   1HB   ASP  87          HB2       ASP  87  30.973   0.084 -24.910
  635   2HB   ASP  87          HB3       ASP  87  32.559   0.462 -24.238
  636    H    LYS  88           H        LYS  88  31.101   4.147 -22.637
  637    HA   LYS  88           HA       LYS  88  33.219   3.785 -20.787
  638   1HB   LYS  88          HB2       LYS  88  31.251   6.094 -21.018
  639   2HB   LYS  88          HB3       LYS  88  32.736   6.102 -20.063
  640   1HG   LYS  88          HG2       LYS  88  34.089   5.740 -22.101
  641   2HG   LYS  88          HG3       LYS  88  32.623   5.668 -23.078
  642   1HD   LYS  88          HD2       LYS  88  33.592   7.822 -23.366
  643   2HD   LYS  88          HD3       LYS  88  32.082   8.013 -22.464
  644   1HE   LYS  88          HE2       LYS  88  33.351   8.233 -20.349
  645   2HE   LYS  88          HE3       LYS  88  34.865   7.907 -21.200
  646   1HZ   LYS  88          HZ1       LYS  88  33.144  10.275 -21.673
  647   2HZ   LYS  88          HZ2       LYS  88  34.542  10.270 -20.836
  648   3HZ   LYS  88          HZ3       LYS  88  34.557   9.964 -22.433
  649    H    CYS  89           H        CYS  89  29.924   3.033 -20.362
  650    HA   CYS  89           HA       CYS  89  28.564   2.558 -18.634
  651   1HB   CYS  89          HB2       CYS  89  31.117   1.280 -17.688
  652   2HB   CYS  89          HB3       CYS  89  29.530   0.980 -16.997
  653    HA   PRO  90           HA       PRO  90  29.249   6.285 -16.098
  654   1HB   PRO  90          HB2       PRO  90  26.376   5.660 -15.502
  655   2HB   PRO  90          HB3       PRO  90  27.156   7.232 -15.884
  656   1HG   PRO  90          HG2       PRO  90  25.704   5.880 -17.762
  657   2HG   PRO  90          HG3       PRO  90  27.187   6.781 -18.194
  658   1HD   PRO  90          HD2       PRO  90  26.816   3.835 -17.840
  659   2HD   PRO  90          HD3       PRO  90  27.846   4.733 -18.997
  660    H    MET  91           H        MET  91  29.816   6.455 -13.992
  661    HA   MET  91           HA       MET  91  30.019   4.125 -12.392
  662   1HB   MET  91          HB2       MET  91  30.509   7.057 -11.672
  663   2HB   MET  91          HB3       MET  91  31.030   5.651 -10.745
  664   1HG   MET  91          HG2       MET  91  32.943   6.297 -11.900
  665   2HG   MET  91          HG3       MET  91  32.345   4.907 -12.799
  666   1HE   MET  91          HE1       MET  91  34.597   6.725 -13.953
  667   2HE   MET  91          HE2       MET  91  33.858   5.389 -14.868
  668   3HE   MET  91          HE3       MET  91  34.043   6.988 -15.621
  669    H    THR  92           H        THR  92  28.930   3.529 -10.585
  670    HA   THR  92           HA       THR  92  26.610   5.085  -9.607
  671    HB   THR  92           HB       THR  92  25.691   2.740  -9.230
  672    HG1  THR  92           HG1      THR  92  27.549   1.520  -9.319
  673   1HG2  THR  92          HG21      THR  92  25.141   4.156 -11.273
  674   2HG2  THR  92          HG22      THR  92  26.403   3.257 -12.143
  675   3HG2  THR  92          HG23      THR  92  24.975   2.408 -11.513
  676    HA   PRO  93           HA       PRO  93  28.391   4.379  -5.520
  677   1HB   PRO  93          HB2       PRO  93  26.182   4.080  -3.914
  678   2HB   PRO  93          HB3       PRO  93  26.710   5.655  -4.584
  679   1HG   PRO  93          HG2       PRO  93  24.600   3.777  -5.671
  680   2HG   PRO  93          HG3       PRO  93  24.470   5.542  -5.414
  681   1HD   PRO  93          HD2       PRO  93  25.043   4.457  -7.849
  682   2HD   PRO  93          HD3       PRO  93  25.818   5.981  -7.320
  683    HA   PRO  94           HA       PRO  94  28.497  -0.023  -5.854
  684   1HB   PRO  94          HB2       PRO  94  30.092  -0.756  -3.749
  685   2HB   PRO  94          HB3       PRO  94  30.693   0.143  -5.175
  686   1HG   PRO  94          HG2       PRO  94  29.847   1.264  -2.487
  687   2HG   PRO  94          HG3       PRO  94  31.341   1.619  -3.415
  688   1HD   PRO  94          HD2       PRO  94  29.144   3.246  -3.514
  689   2HD   PRO  94          HD3       PRO  94  30.170   2.968  -4.959
  690    H    HIS  95           H        HIS  95  27.233   1.405  -2.875
  691    HA   HIS  95           HA       HIS  95  26.303  -1.110  -1.776
  692   1HB   HIS  95          HB2       HIS  95  25.357   0.224  -0.016
  693   2HB   HIS  95          HB3       HIS  95  26.991   0.768  -0.351
  694    HD1  HIS  95           HD1      HIS  95  23.340   1.949  -0.718
  695    HD2  HIS  95           HD2      HIS  95  27.302   3.320  -1.099
  696    HE1  HIS  95           HE1      HIS  95  23.202   4.478  -0.972
  697    H    VAL  96           H        VAL  96  25.095   0.778  -4.363
  698    HA   VAL  96           HA       VAL  96  22.265   0.132  -3.753
  699    HB   VAL  96           HB       VAL  96  23.489   1.871  -5.908
  700   1HG1  VAL  96          HG11      VAL  96  21.142   2.631  -6.290
  701   2HG1  VAL  96          HG12      VAL  96  21.393   0.950  -6.749
  702   3HG1  VAL  96          HG13      VAL  96  20.566   1.336  -5.224
  703   1HG2  VAL  96          HG21      VAL  96  22.389   3.698  -4.586
  704   2HG2  VAL  96          HG22      VAL  96  21.925   2.518  -3.350
  705   3HG2  VAL  96          HG23      VAL  96  23.640   2.882  -3.651
  706    H    LYS  97           H        LYS  97  21.145  -1.374  -4.945
  707    HA   LYS  97           HA       LYS  97  22.560  -3.427  -6.336
  708   1HB   LYS  97          HB2       LYS  97  20.504  -3.946  -5.171
  709   2HB   LYS  97          HB3       LYS  97  19.609  -2.720  -6.070
  710   1HG   LYS  97          HG2       LYS  97  19.034  -4.954  -6.848
  711   2HG   LYS  97          HG3       LYS  97  19.780  -3.996  -8.120
  712   1HD   LYS  97          HD2       LYS  97  21.970  -5.210  -7.642
  713   2HD   LYS  97          HD3       LYS  97  21.068  -6.272  -6.551
  714   1HE   LYS  97          HE2       LYS  97  19.797  -7.204  -8.314
  715   2HE   LYS  97          HE3       LYS  97  20.045  -5.803  -9.361
  716   1HZ   LYS  97          HZ1       LYS  97  21.320  -7.631 -10.152
  717   2HZ   LYS  97          HZ2       LYS  97  22.319  -6.445  -9.679
  718   3HZ   LYS  97          HZ3       LYS  97  22.138  -7.791  -8.725
  719    H    ARG  98           H        ARG  98  23.044  -3.620  -8.441
  720    HA   ARG  98           HA       ARG  98  21.954  -1.675 -10.382
  721   1HB   ARG  98          HB2       ARG  98  24.154  -0.925  -9.640
  722   2HB   ARG  98          HB3       ARG  98  24.852  -2.505 -10.012
  723   1HG   ARG  98          HG2       ARG  98  24.479  -2.161 -12.406
  724   2HG   ARG  98          HG3       ARG  98  23.638  -0.616 -12.089
  725   1HD   ARG  98          HD2       ARG  98  25.638   0.371 -11.243
  726   2HD   ARG  98          HD3       ARG  98  26.490  -1.179 -11.212
  727    HE   ARG  98           HE       ARG  98  25.635  -0.631 -13.886
  728   1HH1  ARG  98          HH11      ARG  98  27.918   0.809 -11.601
  729   2HH1  ARG  98          HH12      ARG  98  29.260   0.785 -12.699
  730   1HH2  ARG  98          HH21      ARG  98  27.281  -0.514 -15.364
  731   2HH2  ARG  98          HH22      ARG  98  28.891   0.011 -14.936
  732    H    GLU  99           H        GLU  99  21.971  -2.433 -12.581
  733    HA   GLU  99           HA       GLU  99  22.648  -5.259 -13.110
  734   1HB   GLU  99          HB2       GLU  99  19.998  -3.852 -13.610
  735   2HB   GLU  99          HB3       GLU  99  20.526  -5.112 -14.706
  736   1HG   GLU  99          HG2       GLU  99  20.129  -5.447 -11.710
  737   2HG   GLU  99          HG3       GLU  99  19.004  -5.962 -12.964
  738    H    HIS 100           H        HIS 100  22.750  -5.552 -15.565
  739    HA   HIS 100           HA       HIS 100  23.730  -3.113 -16.947
  740   1HB   HIS 100          HB2       HIS 100  25.710  -4.079 -16.020
  741   2HB   HIS 100          HB3       HIS 100  25.203  -5.716 -16.441
  742    HD1  HIS 100           HD1      HIS 100  26.790  -2.622 -18.081
  743    HD2  HIS 100           HD2      HIS 100  25.618  -6.578 -18.927
  744    HE1  HIS 100           HE1      HIS 100  27.836  -3.216 -20.319
  745    H    TRP 101           H        TRP 101  22.655  -2.957 -18.767
  746    HA   TRP 101           HA       TRP 101  21.626  -5.361 -20.221
  747   1HB   TRP 101          HB2       TRP 101  20.262  -2.688 -19.691
  748   2HB   TRP 101          HB3       TRP 101  19.723  -3.852 -20.881
  749    HD1  TRP 101           HD1      TRP 101  20.542  -5.433 -17.525
  750    HE1  TRP 101           HE1      TRP 101  18.405  -6.021 -16.312
  751    HE3  TRP 101           HE3      TRP 101  17.207  -3.118 -20.647
  752    HZ2  TRP 101           HZ2      TRP 101  15.565  -5.518 -16.604
  753    HZ3  TRP 101           HZ3      TRP 101  14.773  -3.239 -20.177
  754    HH2  TRP 101           HH2      TRP 101  13.954  -4.402 -18.133
  755    H    GLY 102           H        GLY 102  24.087  -4.694 -21.016
  756   1HA   GLY 102          HA1       GLY 102  24.333  -2.303 -22.527
  757   2HA   GLY 102          HA2       GLY 102  25.411  -3.705 -22.565
  758    H    PHE 103           H        PHE 103  23.907  -1.827 -24.601
  759    HA   PHE 103           HA       PHE 103  24.072  -3.716 -26.720
  760   1HB   PHE 103          HB2       PHE 103  21.701  -2.825 -27.594
  761   2HB   PHE 103          HB3       PHE 103  21.898  -4.325 -26.721
  762    HD1  PHE 103           HD1      PHE 103  21.340  -0.683 -25.877
  763    HD2  PHE 103           HD2      PHE 103  20.321  -4.798 -25.084
  764    HE1  PHE 103           HE1      PHE 103  19.766   0.036 -24.100
  765    HE2  PHE 103           HE2      PHE 103  18.729  -4.067 -23.330
  766    HZ   PHE 103           HZ       PHE 103  18.497  -1.650 -22.791
  767    H    ASP 104           H        ASP 104  23.958  -2.455 -28.796
  768    HA   ASP 104           HA       ASP 104  25.546  -0.150 -28.446
  769   1HB   ASP 104          HB2       ASP 104  25.798  -1.716 -30.344
  770   2HB   ASP 104          HB3       ASP 104  24.230  -1.190 -30.973
  771    H    ASP 105           H        ASP 105  25.195   1.966 -28.982
  772    HA   ASP 105           HA       ASP 105  22.523   2.946 -28.335
  773   1HB   ASP 105          HB2       ASP 105  24.690   4.136 -27.696
  774   2HB   ASP 105          HB3       ASP 105  24.814   4.645 -29.363
  775    HA   PRO 106           HA       PRO 106  21.407   2.551 -32.600
  776   1HB   PRO 106          HB2       PRO 106  19.020   3.895 -32.678
  777   2HB   PRO 106          HB3       PRO 106  19.245   2.268 -31.970
  778   1HG   PRO 106          HG2       PRO 106  19.181   4.912 -30.502
  779   2HG   PRO 106          HG3       PRO 106  18.317   3.396 -30.087
  780   1HD   PRO 106          HD2       PRO 106  20.671   4.092 -28.918
  781   2HD   PRO 106          HD3       PRO 106  20.327   2.384 -29.330
  782    H    ALA 107           H        ALA 107  21.788   5.749 -31.116
  783    HA   ALA 107           HA       ALA 107  21.838   7.131 -33.674
  784   1HB   ALA 107          HB1       ALA 107  21.122   8.270 -31.590
  785   2HB   ALA 107          HB2       ALA 107  22.765   8.081 -30.934
  786   3HB   ALA 107          HB3       ALA 107  22.490   9.085 -32.369
  787    H    ARG 108           H        ARG 108  23.960   4.938 -32.285
  788    HA   ARG 108           HA       ARG 108  26.410   6.272 -33.317
  789   1HB   ARG 108          HB2       ARG 108  26.003   6.017 -30.790
  790   2HB   ARG 108          HB3       ARG 108  26.205   4.276 -31.034
  791   1HG   ARG 108          HG2       ARG 108  28.491   4.522 -31.636
  792   2HG   ARG 108          HG3       ARG 108  28.348   6.276 -31.832
  793   1HD   ARG 108          HD2       ARG 108  27.947   4.810 -29.178
  794   2HD   ARG 108          HD3       ARG 108  29.468   5.570 -29.672
  795    HE   ARG 108           HE       ARG 108  27.883   7.661 -29.964
  796   1HH1  ARG 108          HH11      ARG 108  28.081   5.425 -27.155
  797   2HH1  ARG 108          HH12      ARG 108  27.387   6.558 -26.070
  798   1HH2  ARG 108          HH21      ARG 108  27.022   9.152 -28.475
  799   2HH2  ARG 108          HH22      ARG 108  26.832   8.736 -26.818
  800    H    ALA 109           H        ALA 109  24.152   3.922 -33.933
  801    HA   ALA 109           HA       ALA 109  25.615   1.692 -34.850
  802   1HB   ALA 109          HB1       ALA 109  23.175   1.646 -34.611
  803   2HB   ALA 109          HB2       ALA 109  22.991   2.899 -35.857
  804   3HB   ALA 109          HB3       ALA 109  23.644   1.318 -36.292
  805    H    GLN 110           H        GLN 110  27.470   2.324 -35.853
  806    HA   GLN 110           HA       GLN 110  27.806   4.209 -37.907
  807   1HB   GLN 110          HB2       GLN 110  29.281   1.551 -37.603
  808   2HB   GLN 110          HB3       GLN 110  29.835   2.955 -38.513
  809   1HG   GLN 110          HG2       GLN 110  29.480   2.775 -35.487
  810   2HG   GLN 110          HG3       GLN 110  30.996   2.779 -36.367
  811   1HE2  GLN 110          HE22      GLN 110  28.678   4.759 -34.805
  812   2HE2  GLN 110          HE21      GLN 110  29.314   6.313 -35.325
  813    H    GLY 111           H        GLY 111  26.989   4.313 -39.912
  814   1HA   GLY 111          HA1       GLY 111  26.956   2.372 -41.890
  815   2HA   GLY 111          HA2       GLY 111  25.386   2.217 -41.081
  816    H    THR 112           H        THR 112  23.891   3.977 -41.143
  817    HA   THR 112           HA       THR 112  24.508   6.494 -42.327
  818    HB   THR 112           HB       THR 112  24.377   5.179 -44.405
  819    HG1  THR 112           HG1      THR 112  23.014   6.514 -45.422
  820   1HG2  THR 112          HG21      THR 112  22.276   4.141 -45.158
  821   2HG2  THR 112          HG22      THR 112  22.907   3.326 -43.724
  822   3HG2  THR 112          HG23      THR 112  21.536   4.448 -43.575
  823    H    GLU 113           H        GLU 113  22.348   7.796 -42.451
  824    HA   GLU 113           HA       GLU 113  21.281   7.676 -39.820
  825   1HB   GLU 113          HB2       GLU 113  19.829   9.502 -40.492
  826   2HB   GLU 113          HB3       GLU 113  21.491   9.766 -41.020
  827   1HG   GLU 113          HG2       GLU 113  20.853   9.021 -43.328
  828   2HG   GLU 113          HG3       GLU 113  19.186   8.825 -42.787
  829    H    GLU 114           H        GLU 114  20.101   6.325 -42.869
  830    HA   GLU 114           HA       GLU 114  17.503   5.628 -41.905
  831   1HB   GLU 114          HB2       GLU 114  18.163   5.732 -44.310
  832   2HB   GLU 114          HB3       GLU 114  19.163   4.286 -44.078
  833   1HG   GLU 114          HG2       GLU 114  17.174   2.969 -43.484
  834   2HG   GLU 114          HG3       GLU 114  16.159   4.412 -43.576
  835    H    GLU 115           H        GLU 115  20.687   4.042 -41.768
  836    HA   GLU 115           HA       GLU 115  19.643   1.551 -40.744
  837   1HB   GLU 115          HB2       GLU 115  21.785   1.808 -42.068
  838   2HB   GLU 115          HB3       GLU 115  22.497   2.607 -40.665
  839   1HG   GLU 115          HG2       GLU 115  23.180   0.305 -40.692
  840   2HG   GLU 115          HG3       GLU 115  22.123   0.560 -39.317
  841    H    LYS 116           H        LYS 116  21.099   4.538 -39.360
  842    HA   LYS 116           HA       LYS 116  21.026   3.754 -36.629
  843   1HB   LYS 116          HB2       LYS 116  20.739   6.478 -37.963
  844   2HB   LYS 116          HB3       LYS 116  20.773   6.248 -36.209
  845   1HG   LYS 116          HG2       LYS 116  22.987   5.142 -36.402
  846   2HG   LYS 116          HG3       LYS 116  22.989   5.450 -38.148
  847   1HD   LYS 116          HD2       LYS 116  22.877   7.901 -37.691
  848   2HD   LYS 116          HD3       LYS 116  22.861   7.555 -35.948
  849   1HE   LYS 116          HE2       LYS 116  25.059   6.258 -36.353
  850   2HE   LYS 116          HE3       LYS 116  25.090   7.005 -37.954
  851   1HZ   LYS 116          HZ1       LYS 116  26.368   8.313 -36.389
  852   2HZ   LYS 116          HZ2       LYS 116  25.056   9.189 -36.801
  853   3HZ   LYS 116          HZ3       LYS 116  25.112   8.420 -35.344
  854    H    TRP 117           H        TRP 117  18.474   5.398 -38.620
  855    HA   TRP 117           HA       TRP 117  16.508   5.369 -36.582
  856   1HB   TRP 117          HB2       TRP 117  16.137   6.723 -38.486
  857   2HB   TRP 117          HB3       TRP 117  16.391   5.385 -39.598
  858    HD1  TRP 117           HD1      TRP 117  14.283   4.790 -40.767
  859    HE1  TRP 117           HE1      TRP 117  11.821   4.485 -40.207
  860    HE3  TRP 117           HE3      TRP 117  14.400   6.179 -35.825
  861    HZ2  TRP 117           HZ2      TRP 117  10.100   4.751 -37.881
  862    HZ3  TRP 117           HZ3      TRP 117  12.349   6.085 -34.462
  863    HH2  TRP 117           HH2      TRP 117  10.186   5.375 -35.474
  864    H    ALA 118           H        ALA 118  17.478   2.779 -38.889
  865    HA   ALA 118           HA       ALA 118  15.289   1.083 -38.197
  866   1HB   ALA 118          HB1       ALA 118  16.612   0.854 -40.280
  867   2HB   ALA 118          HB2       ALA 118  18.004   0.303 -39.319
  868   3HB   ALA 118          HB3       ALA 118  16.504  -0.654 -39.353
  869    H    PHE 119           H        PHE 119  18.630   1.395 -36.959
  870    HA   PHE 119           HA       PHE 119  18.330  -0.615 -34.962
  871   1HB   PHE 119          HB2       PHE 119  20.301   1.616 -35.388
  872   2HB   PHE 119          HB3       PHE 119  20.216   0.840 -33.814
  873    HD1  PHE 119           HD1      PHE 119  21.585   0.520 -37.111
  874    HD2  PHE 119           HD2      PHE 119  20.300  -1.738 -33.672
  875    HE1  PHE 119           HE1      PHE 119  22.938  -1.417 -37.878
  876    HE2  PHE 119           HE2      PHE 119  21.624  -3.683 -34.458
  877    HZ   PHE 119           HZ       PHE 119  22.950  -3.526 -36.559
  878    H    PHE 120           H        PHE 120  17.373   2.815 -34.965
  879    HA   PHE 120           HA       PHE 120  16.844   2.943 -32.171
  880   1HB   PHE 120          HB2       PHE 120  15.940   4.486 -34.577
  881   2HB   PHE 120          HB3       PHE 120  14.861   4.529 -33.208
  882    HD1  PHE 120           HD1      PHE 120  17.950   5.849 -34.575
  883    HD2  PHE 120           HD2      PHE 120  15.714   5.237 -30.939
  884    HE1  PHE 120           HE1      PHE 120  19.296   7.601 -33.455
  885    HE2  PHE 120           HE2      PHE 120  17.086   6.967 -29.818
  886    HZ   PHE 120           HZ       PHE 120  18.825   8.198 -31.092
  887    H    GLN 121           H        GLN 121  14.579   1.967 -34.827
  888    HA   GLN 121           HA       GLN 121  12.579   1.249 -32.898
  889   1HB   GLN 121          HB2       GLN 121  11.452   0.057 -34.741
  890   2HB   GLN 121          HB3       GLN 121  11.842   1.748 -35.055
  891   1HG   GLN 121          HG2       GLN 121  13.817   1.004 -36.396
  892   2HG   GLN 121          HG3       GLN 121  13.308  -0.678 -36.165
  893   1HE2  GLN 121          HE22      GLN 121  12.195   2.538 -37.388
  894   2HE2  GLN 121          HE21      GLN 121  11.149   1.896 -38.628
  895    H    ARG 122           H        ARG 122  15.294  -0.674 -34.293
  896    HA   ARG 122           HA       ARG 122  14.442  -3.158 -33.136
  897   1HB   ARG 122          HB2       ARG 122  17.251  -2.124 -33.702
  898   2HB   ARG 122          HB3       ARG 122  16.892  -3.774 -33.217
  899   1HG   ARG 122          HG2       ARG 122  15.700  -4.239 -35.265
  900   2HG   ARG 122          HG3       ARG 122  15.740  -2.547 -35.750
  901   1HD   ARG 122          HD2       ARG 122  18.333  -2.767 -35.586
  902   2HD   ARG 122          HD3       ARG 122  18.055  -4.506 -35.587
  903    HE   ARG 122           HE       ARG 122  16.792  -4.089 -37.772
  904   1HH1  ARG 122          HH21      ARG 122  19.665  -2.118 -36.839
  905   2HH1  ARG 122          HH22      ARG 122  19.912  -1.599 -38.489
  906   1HH2  ARG 122          HH11      ARG 122  17.403  -3.411 -39.969
  907   2HH2  ARG 122          HH12      ARG 122  18.773  -2.330 -40.132
  908    H    VAL 123           H        VAL 123  16.663  -0.613 -31.783
  909    HA   VAL 123           HA       VAL 123  17.086  -2.111 -29.366
  910    HB   VAL 123           HB       VAL 123  17.595   0.795 -30.139
  911   1HG1  VAL 123          HG11      VAL 123  19.162   0.849 -28.179
  912   2HG1  VAL 123          HG12      VAL 123  17.462   0.762 -27.716
  913   3HG1  VAL 123          HG13      VAL 123  18.482  -0.693 -27.626
  914   1HG2  VAL 123          HG21      VAL 123  19.935   0.091 -30.327
  915   2HG2  VAL 123          HG22      VAL 123  19.529  -1.550 -29.786
  916   3HG2  VAL 123          HG23      VAL 123  18.955  -0.958 -31.353
  917    H    ARG 124           H        ARG 124  14.739   0.433 -30.349
  918    HA   ARG 124           HA       ARG 124  13.521   0.916 -27.846
  919   1HB   ARG 124          HB2       ARG 124  13.002   2.180 -29.899
  920   2HB   ARG 124          HB3       ARG 124  12.417   0.728 -30.679
  921   1HG   ARG 124          HG2       ARG 124  10.753   0.846 -28.465
  922   2HG   ARG 124          HG3       ARG 124  11.062   2.546 -28.786
  923   1HD   ARG 124          HD2       ARG 124   9.092   1.922 -30.002
  924   2HD   ARG 124          HD3       ARG 124  10.403   2.153 -31.162
  925    HE   ARG 124           HE       ARG 124   9.872  -0.619 -30.231
  926   1HH1  ARG 124          HH21      ARG 124   9.422   1.816 -32.724
  927   2HH1  ARG 124          HH22      ARG 124   8.989   0.721 -33.991
  928   1HH2  ARG 124          HH12      ARG 124   9.066  -2.150 -31.827
  929   2HH2  ARG 124          HH11      ARG 124   8.779  -1.584 -33.436
  930    H    ASP 125           H        ASP 125  12.737  -1.563 -30.362
  931    HA   ASP 125           HA       ASP 125  10.577  -2.613 -28.885
  932   1HB   ASP 125          HB2       ASP 125  11.284  -2.894 -31.411
  933   2HB   ASP 125          HB3       ASP 125  12.132  -4.331 -30.840
  934    H    GLU 126           H        GLU 126  14.005  -3.698 -29.079
  935    HA   GLU 126           HA       GLU 126  13.672  -5.979 -27.415
  936   1HB   GLU 126          HB2       GLU 126  16.065  -4.236 -28.073
  937   2HB   GLU 126          HB3       GLU 126  16.185  -5.699 -27.088
  938   1HG   GLU 126          HG2       GLU 126  15.051  -5.688 -29.917
  939   2HG   GLU 126          HG3       GLU 126  16.746  -5.973 -29.546
  940    H    ILE 127           H        ILE 127  14.506  -2.564 -26.608
  941    HA   ILE 127           HA       ILE 127  14.871  -2.983 -23.808
  942    HB   ILE 127           HB       ILE 127  14.079  -0.594 -25.510
  943   1HG1  ILE 127          HG12      ILE 127  16.527  -1.180 -23.785
  944   2HG1  ILE 127          HG13      ILE 127  16.463  -1.487 -25.513
  945   1HG2  ILE 127          HG21      ILE 127  14.248   0.869 -23.597
  946   2HG2  ILE 127          HG22      ILE 127  12.967  -0.286 -23.291
  947   3HG2  ILE 127          HG23      ILE 127  14.540  -0.507 -22.499
  948   1HD1  ILE 127          HD11      ILE 127  17.603   0.586 -25.241
  949   2HD1  ILE 127          HD12      ILE 127  15.982   1.001 -25.838
  950   3HD1  ILE 127          HD13      ILE 127  16.394   1.214 -24.120
  951    H    GLY 128           H        GLY 128  11.914  -2.071 -25.694
  952   1HA   GLY 128          HA1       GLY 128  10.060  -2.054 -23.620
  953   2HA   GLY 128          HA2       GLY 128   9.710  -2.562 -25.287
  954    H    ASN 129           H        ASN 129  11.163  -4.908 -25.532
  955    HA   ASN 129           HA       ASN 129   9.497  -6.783 -24.201
  956   1HB   ASN 129          HB2       ASN 129  12.134  -7.097 -25.690
  957   2HB   ASN 129          HB3       ASN 129  11.392  -8.453 -24.860
  958   1HD2  ASN 129          HD22      ASN 129  10.937  -6.151 -27.537
  959   2HD2  ASN 129          HD21      ASN 129   9.752  -7.109 -28.379
  960    H    ARG 130           H        ARG 130  12.876  -5.780 -23.446
  961    HA   ARG 130           HA       ARG 130  12.898  -7.636 -21.229
  962   1HB   ARG 130          HB2       ARG 130  14.788  -5.467 -22.179
  963   2HB   ARG 130          HB3       ARG 130  14.995  -6.139 -20.561
  964   1HG   ARG 130          HG2       ARG 130  14.843  -7.865 -23.051
  965   2HG   ARG 130          HG3       ARG 130  16.354  -7.290 -22.350
  966   1HD   ARG 130          HD2       ARG 130  14.330  -8.978 -20.772
  967   2HD   ARG 130          HD3       ARG 130  15.652  -9.642 -21.707
  968    HE   ARG 130           HE       ARG 130  17.243  -8.739 -20.265
  969   1HH1  ARG 130          HH22      ARG 130  14.011  -7.798 -18.994
  970   2HH1  ARG 130          HH21      ARG 130  14.519  -7.978 -17.343
  971   1HH2  ARG 130          HH11      ARG 130  17.852  -8.805 -18.068
  972   2HH2  ARG 130          HH12      ARG 130  16.679  -8.548 -16.813
  973    H    LEU 131           H        LEU 131  11.896  -4.241 -21.492
  974    HA   LEU 131           HA       LEU 131  11.790  -3.861 -18.656
  975   1HB   LEU 131          HB2       LEU 131  11.335  -2.212 -20.889
  976   2HB   LEU 131          HB3       LEU 131   9.755  -2.380 -20.165
  977    HG   LEU 131           HG       LEU 131  10.783  -0.469 -19.236
  978   1HD1  LEU 131          HD11      LEU 131  10.999  -2.620 -17.112
  979   2HD1  LEU 131          HD12      LEU 131  10.823  -0.895 -16.828
  980   3HD1  LEU 131          HD13      LEU 131   9.508  -1.805 -17.599
  981   1HD2  LEU 131          HD21      LEU 131  13.173  -2.109 -18.334
  982   2HD2  LEU 131          HD22      LEU 131  13.135  -1.117 -19.808
  983   3HD2  LEU 131          HD23      LEU 131  12.947  -0.357 -18.234
  984    H    LYS 132           H        LYS 132   9.438  -5.082 -21.094
  985    HA   LYS 132           HA       LYS 132   7.276  -5.494 -19.339
  986   1HB   LYS 132          HB2       LYS 132   7.145  -5.724 -21.793
  987   2HB   LYS 132          HB3       LYS 132   8.157  -7.163 -21.733
  988   1HG   LYS 132          HG2       LYS 132   6.472  -8.370 -20.430
  989   2HG   LYS 132          HG3       LYS 132   5.444  -6.915 -20.381
  990   1HD   LYS 132          HD2       LYS 132   5.301  -6.934 -22.864
  991   2HD   LYS 132          HD3       LYS 132   6.324  -8.383 -22.914
  992   1HE   LYS 132          HE2       LYS 132   4.632  -9.620 -21.567
  993   2HE   LYS 132          HE3       LYS 132   3.609  -8.179 -21.527
  994   1HZ   LYS 132          HZ1       LYS 132   2.910  -9.712 -23.251
  995   2HZ   LYS 132          HZ2       LYS 132   3.418  -8.330 -23.944
  996   3HZ   LYS 132          HZ3       LYS 132   4.364  -9.663 -23.979
  997    H    GLU 133           H        GLU 133   9.990  -7.696 -20.152
  998    HA   GLU 133           HA       GLU 133   9.138  -9.672 -18.316
  999   1HB   GLU 133          HB2       GLU 133  11.959  -9.207 -19.322
 1000   2HB   GLU 133          HB3       GLU 133  11.381 -10.627 -18.415
 1001   1HG   GLU 133          HG2       GLU 133   9.717 -11.092 -20.172
 1002   2HG   GLU 133          HG3       GLU 133  10.312  -9.730 -21.118
 1003    H    PHE 134           H        PHE 134  11.295  -6.876 -17.791
 1004    HA   PHE 134           HA       PHE 134  12.026  -7.568 -15.149
 1005   1HB   PHE 134          HB2       PHE 134  13.181  -5.811 -16.326
 1006   2HB   PHE 134          HB3       PHE 134  11.699  -4.892 -16.539
 1007    HD1  PHE 134           HD1      PHE 134  11.167  -3.171 -15.035
 1008    HD2  PHE 134           HD2      PHE 134  13.874  -6.287 -13.791
 1009    HE1  PHE 134           HE1      PHE 134  11.576  -1.952 -12.932
 1010    HE2  PHE 134           HE2      PHE 134  14.240  -5.097 -11.646
 1011    HZ   PHE 134           HZ       PHE 134  13.113  -2.922 -11.217
 1012    H    ALA 135           H        ALA 135   9.088  -6.031 -16.399
 1013    HA   ALA 135           HA       ALA 135   8.170  -5.349 -13.738
 1014   1HB   ALA 135          HB1       ALA 135   6.143  -4.560 -14.937
 1015   2HB   ALA 135          HB2       ALA 135   7.614  -3.968 -15.738
 1016   3HB   ALA 135          HB3       ALA 135   6.717  -5.333 -16.434
 1017    H    GLU 136           H        GLU 136   7.579  -7.904 -16.109
 1018    HA   GLU 136           HA       GLU 136   5.336  -9.020 -14.649
 1019   1HB   GLU 136          HB2       GLU 136   5.261  -8.883 -17.057
 1020   2HB   GLU 136          HB3       GLU 136   6.781  -9.776 -17.218
 1021   1HG   GLU 136          HG2       GLU 136   5.783 -11.810 -16.391
 1022   2HG   GLU 136          HG3       GLU 136   4.283 -10.972 -15.974
 1023    H    THR 137           H        THR 137   8.673  -9.960 -15.389
 1024    HA   THR 137           HA       THR 137   8.338 -12.459 -13.832
 1025    HB   THR 137           HB       THR 137   9.943 -13.489 -15.225
 1026    HG1  THR 137           HG1      THR 137  10.369 -10.884 -16.230
 1027   1HG2  THR 137          HG21      THR 137   7.633 -13.319 -16.169
 1028   2HG2  THR 137          HG22      THR 137   8.152 -11.877 -17.086
 1029   3HG2  THR 137          HG23      THR 137   8.905 -13.451 -17.398
 1030    H    GLY 138           H        GLY 138  10.149  -9.462 -13.977
 1031   1HA   GLY 138          HA1       GLY 138  11.399  -8.548 -12.231
 1032   2HA   GLY 138          HA2       GLY 138  11.547 -10.134 -11.473
 1033    H    LYS 139           H        LYS 139  12.282 -10.243 -14.878
 1034    HA   LYS 139           HA       LYS 139  14.995 -10.968 -14.229
 1035   1HB   LYS 139          HB2       LYS 139  13.497 -10.739 -16.864
 1036   2HB   LYS 139          HB3       LYS 139  15.173 -11.283 -16.732
 1037   1HG   LYS 139          HG2       LYS 139  12.794 -12.619 -15.386
 1038   2HG   LYS 139          HG3       LYS 139  13.571 -13.166 -16.881
 1039   1HD   LYS 139          HD2       LYS 139  15.693 -13.479 -15.518
 1040   2HD   LYS 139          HD3       LYS 139  14.726 -13.088 -14.066
 1041   1HE   LYS 139          HE2       LYS 139  13.181 -14.938 -14.574
 1042   2HE   LYS 139          HE3       LYS 139  14.120 -15.348 -16.015
 1043   1HZ   LYS 139          HZ1       LYS 139  15.132 -15.484 -13.233
 1044   2HZ   LYS 139          HZ2       LYS 139  14.709 -16.760 -14.152
 1045   3HZ   LYS 139          HZ3       LYS 139  16.001 -15.860 -14.567
  Start of MODEL    6
    1   1H    MET   1           H1       MET   1   6.371   0.313   3.498
    2   2H    MET   1           H2       MET   1   4.852   0.806   3.842
    3   3H    MET   1           H3       MET   1   5.153  -0.783   3.556
    4    HA   MET   1           HA       MET   1   5.763  -0.318   1.293
    5   1HB   MET   1          HB2       MET   1   3.427  -0.923   1.825
    6   2HB   MET   1          HB3       MET   1   3.002   0.778   2.016
    7   1HG   MET   1          HG2       MET   1   4.170  -0.341  -0.560
    8   2HG   MET   1          HG3       MET   1   2.452  -0.424  -0.198
    9   1HE   MET   1          HE1       MET   1   2.172   0.696  -2.645
   10   2HE   MET   1          HE2       MET   1   2.833   2.293  -3.061
   11   3HE   MET   1          HE3       MET   1   3.930   0.921  -2.799
   12    H    GLU   2           H        GLU   2   6.484   1.141  -0.228
   13    HA   GLU   2           HA       GLU   2   5.803   3.944  -0.047
   14   1HB   GLU   2          HB2       GLU   2   8.086   4.773  -0.159
   15   2HB   GLU   2          HB3       GLU   2   7.833   3.898   1.345
   16   1HG   GLU   2          HG2       GLU   2   8.972   1.891   0.312
   17   2HG   GLU   2          HG3       GLU   2   9.314   2.867  -1.115
   18    H    ASN   3           H        ASN   3   6.553   5.020  -2.156
   19    HA   ASN   3           HA       ASN   3   5.916   3.320  -4.396
   20   1HB   ASN   3          HB2       ASN   3   5.444   5.872  -4.009
   21   2HB   ASN   3          HB3       ASN   3   7.118   6.112  -4.536
   22   1HD2  ASN   3          HD22      ASN   3   7.659   5.404  -6.793
   23   2HD2  ASN   3          HD21      ASN   3   6.314   5.350  -7.948
   24    H    LYS   4           H        LYS   4   7.381   2.555  -5.952
   25    HA   LYS   4           HA       LYS   4  10.125   2.108  -5.061
   26   1HB   LYS   4          HB2       LYS   4   8.737   1.494  -7.703
   27   2HB   LYS   4          HB3       LYS   4  10.272   0.829  -7.200
   28   1HG   LYS   4          HG2       LYS   4   7.590   0.305  -5.820
   29   2HG   LYS   4          HG3       LYS   4   8.288  -0.716  -7.059
   30   1HD   LYS   4          HD2       LYS   4   9.560  -0.163  -4.351
   31   2HD   LYS   4          HD3       LYS   4   8.661  -1.621  -4.819
   32   1HE   LYS   4          HE2       LYS   4  10.332  -1.903  -6.739
   33   2HE   LYS   4          HE3       LYS   4  11.286  -0.613  -5.988
   34   1HZ   LYS   4          HZ1       LYS   4  10.715  -3.285  -4.868
   35   2HZ   LYS   4          HZ2       LYS   4  12.175  -2.594  -5.209
   36   3HZ   LYS   4          HZ3       LYS   4  11.294  -2.063  -3.942
   37    H    ILE   5           H        ILE   5  11.914   2.502  -6.724
   38    HA   ILE   5           HA       ILE   5  11.635   4.915  -8.367
   39    HB   ILE   5           HB       ILE   5  13.842   4.581  -6.318
   40   1HG1  ILE   5          HG12      ILE   5  12.769   6.858  -5.389
   41   2HG1  ILE   5          HG13      ILE   5  11.285   6.099  -5.936
   42   1HG2  ILE   5          HG21      ILE   5  14.498   5.882  -8.326
   43   2HG2  ILE   5          HG22      ILE   5  13.111   6.951  -8.085
   44   3HG2  ILE   5          HG23      ILE   5  14.444   6.924  -6.912
   45   1HD1  ILE   5          HD11      ILE   5  11.758   5.574  -3.577
   46   2HD1  ILE   5          HD12      ILE   5  11.920   4.071  -4.510
   47   3HD1  ILE   5          HD13      ILE   5  13.365   4.959  -4.012
   48    H    ILE   6           H        ILE   6  13.138   4.769 -10.150
   49    HA   ILE   6           HA       ILE   6  15.173   2.666 -10.107
   50    HB   ILE   6           HB       ILE   6  13.227   1.404 -10.797
   51   1HG1  ILE   6          HG12      ILE   6  14.972   1.855 -13.251
   52   2HG1  ILE   6          HG13      ILE   6  15.499   0.975 -11.811
   53   1HG2  ILE   6          HG21      ILE   6  11.842   3.259 -11.744
   54   2HG2  ILE   6          HG22      ILE   6  12.926   3.309 -13.157
   55   3HG2  ILE   6          HG23      ILE   6  11.937   1.879 -12.824
   56   1HD1  ILE   6          HD11      ILE   6  14.765  -0.588 -13.499
   57   2HD1  ILE   6          HD12      ILE   6  13.650  -0.636 -12.117
   58   3HD1  ILE   6          HD13      ILE   6  13.185   0.198 -13.622
   59    H    TYR   7           H        TYR   7  16.762   2.950 -11.802
   60    HA   TYR   7           HA       TYR   7  16.633   5.560 -13.200
   61   1HB   TYR   7          HB2       TYR   7  17.755   5.462 -10.840
   62   2HB   TYR   7          HB3       TYR   7  19.034   4.571 -11.627
   63    HD1  TYR   7           HD1      TYR   7  20.483   6.271 -10.595
   64    HD2  TYR   7           HD2      TYR   7  17.535   7.405 -13.534
   65    HE1  TYR   7           HE1      TYR   7  21.429   8.566 -10.681
   66    HE2  TYR   7           HE2      TYR   7  18.464   9.674 -13.605
   67    HH   TYR   7           HH       TYR   7  19.975  11.170 -12.644
   68    H    PHE   8           H        PHE   8  17.433   5.432 -15.254
   69    HA   PHE   8           HA       PHE   8  19.008   3.006 -16.084
   70   1HB   PHE   8          HB2       PHE   8  17.198   4.806 -17.757
   71   2HB   PHE   8          HB3       PHE   8  18.075   3.402 -18.332
   72    HD1  PHE   8           HD1      PHE   8  17.504   1.095 -17.232
   73    HD2  PHE   8           HD2      PHE   8  14.985   4.579 -16.947
   74    HE1  PHE   8           HE1      PHE   8  15.616  -0.338 -16.520
   75    HE2  PHE   8           HE2      PHE   8  13.088   3.127 -16.302
   76    HZ   PHE   8           HZ       PHE   8  13.407   0.692 -16.005
   77    H    LEU   9           H        LEU   9  21.050   3.416 -16.787
   78    HA   LEU   9           HA       LEU   9  21.839   6.268 -17.141
   79   1HB   LEU   9          HB2       LEU   9  23.374   3.990 -15.847
   80   2HB   LEU   9          HB3       LEU   9  23.932   5.650 -16.079
   81    HG   LEU   9           HG       LEU   9  21.690   4.780 -14.229
   82   1HD1  LEU   9          HD11      LEU   9  24.435   6.017 -13.714
   83   2HD1  LEU   9          HD12      LEU   9  23.230   5.586 -12.487
   84   3HD1  LEU   9          HD13      LEU   9  23.999   4.315 -13.456
   85   1HD2  LEU   9          HD21      LEU   9  21.828   7.243 -13.518
   86   2HD2  LEU   9          HD22      LEU   9  22.677   7.534 -15.052
   87   3HD2  LEU   9          HD23      LEU   9  21.011   6.925 -15.041
   88    H    CYS  10           H        CYS  10  23.242   6.788 -18.720
   89    HA   CYS  10           HA       CYS  10  24.192   4.670 -20.598
   90   1HB   CYS  10          HB2       CYS  10  21.916   5.428 -21.171
   91   2HB   CYS  10          HB3       CYS  10  22.452   7.121 -21.135
   92    HG   CYS  10           HG       CYS  10  22.399   7.051 -23.504
   93    H    THR  11           H        THR  11  25.474   5.786 -22.413
   94    HA   THR  11           HA       THR  11  27.663   7.348 -21.471
   95    HB   THR  11           HB       THR  11  28.022   7.482 -24.038
   96    HG1  THR  11           HG1      THR  11  26.115   7.093 -24.963
   97   1HG2  THR  11          HG21      THR  11  28.624   5.113 -24.220
   98   2HG2  THR  11          HG22      THR  11  29.056   5.730 -22.613
   99   3HG2  THR  11          HG23      THR  11  27.622   4.710 -22.806
  100    H    GLY  12           H        GLY  12  24.461   8.126 -22.849
  101   1HA   GLY  12          HA1       GLY  12  24.750  10.820 -21.855
  102   2HA   GLY  12          HA2       GLY  12  24.542  10.738 -23.615
  103    H    ASN  13           H        ASN  13  22.695  11.741 -21.490
  104    HA   ASN  13           HA       ASN  13  20.603   9.746 -21.256
  105   1HB   ASN  13          HB2       ASN  13  21.183  11.449 -19.479
  106   2HB   ASN  13          HB3       ASN  13  20.491  12.690 -20.532
  107   1HD2  ASN  13          HD22      ASN  13  18.991   9.392 -20.353
  108   2HD2  ASN  13          HD21      ASN  13  17.598   9.916 -19.440
  109    H    SER  14           H        SER  14  20.959  10.088 -23.964
  110    HA   SER  14           HA       SER  14  18.697  11.856 -24.795
  111   1HB   SER  14          HB2       SER  14  21.307  11.395 -26.256
  112   2HB   SER  14          HB3       SER  14  20.042  12.561 -26.668
  113    HG   SER  14           HG       SER  14  21.839  13.469 -25.528
  114    H    CYS  15           H        CYS  15  19.537   8.574 -24.805
  115    HA   CYS  15           HA       CYS  15  17.884   8.102 -27.226
  116   1HB   CYS  15          HB2       CYS  15  19.696   6.561 -28.112
  117   2HB   CYS  15          HB3       CYS  15  20.032   8.288 -28.213
  118    HG   CYS  15           HG       CYS  15  22.153   6.762 -27.649
  119    H    ARG  16           H        ARG  16  19.865   5.510 -26.143
  120    HA   ARG  16           HA       ARG  16  17.656   3.831 -25.640
  121   1HB   ARG  16          HB2       ARG  16  19.317   2.254 -24.699
  122   2HB   ARG  16          HB3       ARG  16  19.764   2.913 -26.270
  123   1HG   ARG  16          HG2       ARG  16  21.262   4.560 -25.057
  124   2HG   ARG  16          HG3       ARG  16  20.944   3.671 -23.565
  125   1HD   ARG  16          HD2       ARG  16  22.084   1.707 -24.429
  126   2HD   ARG  16          HD3       ARG  16  22.130   2.390 -26.065
  127    HE   ARG  16           HE       ARG  16  23.353   4.231 -24.317
  128   1HH1  ARG  16          HH11      ARG  16  24.217   0.952 -25.574
  129   2HH1  ARG  16          HH12      ARG  16  25.896   1.445 -25.684
  130   1HH2  ARG  16          HH21      ARG  16  25.642   4.652 -24.534
  131   2HH2  ARG  16          HH22      ARG  16  26.669   3.305 -24.904
  132    H    SER  17           H        SER  17  19.447   5.866 -23.340
  133    HA   SER  17           HA       SER  17  18.318   4.914 -20.901
  134   1HB   SER  17          HB2       SER  17  18.802   7.404 -20.282
  135   2HB   SER  17          HB3       SER  17  20.146   6.364 -20.715
  136    HG   SER  17           HG       SER  17  20.555   7.791 -22.264
  137    H    GLN  18           H        GLN  18  17.340   7.554 -23.071
  138    HA   GLN  18           HA       GLN  18  15.027   8.379 -21.675
  139   1HB   GLN  18          HB2       GLN  18  15.897   8.599 -24.593
  140   2HB   GLN  18          HB3       GLN  18  14.419   9.309 -24.004
  141   1HG   GLN  18          HG2       GLN  18  17.106   9.917 -22.707
  142   2HG   GLN  18          HG3       GLN  18  16.530  10.801 -24.114
  143   1HE2  GLN  18          HE22      GLN  18  16.999  11.967 -21.449
  144   2HE2  GLN  18          HE21      GLN  18  15.407  12.540 -20.909
  145    H    MET  19           H        MET  19  15.337   6.205 -24.491
  146    HA   MET  19           HA       MET  19  12.605   5.527 -24.712
  147   1HB   MET  19          HB2       MET  19  15.025   3.802 -25.409
  148   2HB   MET  19          HB3       MET  19  13.357   3.497 -25.904
  149   1HG   MET  19          HG2       MET  19  13.436   5.907 -26.899
  150   2HG   MET  19          HG3       MET  19  15.187   5.737 -26.789
  151   1HE   MET  19          HE1       MET  19  16.604   3.917 -28.160
  152   2HE   MET  19          HE2       MET  19  15.602   2.586 -27.528
  153   3HE   MET  19          HE3       MET  19  15.866   2.742 -29.275
  154    H    ALA  20           H        ALA  20  15.166   3.899 -22.720
  155    HA   ALA  20           HA       ALA  20  13.498   1.805 -21.789
  156   1HB   ALA  20          HB1       ALA  20  15.951   1.781 -21.556
  157   2HB   ALA  20          HB2       ALA  20  15.870   3.138 -20.407
  158   3HB   ALA  20          HB3       ALA  20  15.161   1.568 -19.980
  159    H    GLU  21           H        GLU  21  14.105   5.044 -20.347
  160    HA   GLU  21           HA       GLU  21  12.395   4.683 -18.121
  161   1HB   GLU  21          HB2       GLU  21  14.037   6.518 -18.458
  162   2HB   GLU  21          HB3       GLU  21  12.956   7.241 -19.654
  163   1HG   GLU  21          HG2       GLU  21  11.192   7.308 -17.771
  164   2HG   GLU  21          HG3       GLU  21  12.494   6.853 -16.679
  165    H    GLY  22           H        GLY  22  11.630   5.785 -21.483
  166   1HA   GLY  22          HA1       GLY  22   8.914   6.432 -21.136
  167   2HA   GLY  22          HA2       GLY  22   9.675   5.818 -22.634
  168    H    TRP  23           H        TRP  23  10.345   3.279 -22.160
  169    HA   TRP  23           HA       TRP  23   7.847   1.867 -22.203
  170   1HB   TRP  23          HB2       TRP  23  10.734   0.962 -21.855
  171   2HB   TRP  23          HB3       TRP  23   9.383  -0.159 -21.887
  172    HD1  TRP  23           HD1      TRP  23  11.681   1.632 -24.173
  173    HE1  TRP  23           HE1      TRP  23  11.058   1.231 -26.594
  174    HE3  TRP  23           HE3      TRP  23   7.051  -0.416 -23.456
  175    HZ2  TRP  23           HZ2      TRP  23   8.800   0.112 -28.087
  176    HZ3  TRP  23           HZ3      TRP  23   5.729  -1.233 -25.383
  177    HH2  TRP  23           HH2      TRP  23   6.604  -1.006 -27.691
  178    H    ALA  24           H        ALA  24  10.312   2.314 -19.633
  179    HA   ALA  24           HA       ALA  24   9.161   0.471 -17.849
  180   1HB   ALA  24          HB1       ALA  24  10.953   2.868 -17.384
  181   2HB   ALA  24          HB2       ALA  24  10.598   1.630 -16.150
  182   3HB   ALA  24          HB3       ALA  24  11.458   1.200 -17.632
  183    H    LYS  25           H        LYS  25   8.537   4.059 -18.113
  184    HA   LYS  25           HA       LYS  25   6.770   4.138 -15.898
  185   1HB   LYS  25          HB2       LYS  25   6.504   5.679 -18.503
  186   2HB   LYS  25          HB3       LYS  25   5.597   6.005 -17.015
  187   1HG   LYS  25          HG2       LYS  25   7.663   6.597 -15.829
  188   2HG   LYS  25          HG3       LYS  25   8.617   6.235 -17.273
  189   1HD   LYS  25          HD2       LYS  25   7.041   7.959 -18.466
  190   2HD   LYS  25          HD3       LYS  25   6.648   8.511 -16.838
  191   1HE   LYS  25          HE2       LYS  25   9.441   8.317 -18.056
  192   2HE   LYS  25          HE3       LYS  25   8.481   9.786 -18.042
  193   1HZ   LYS  25          HZ1       LYS  25   8.692   9.932 -15.702
  194   2HZ   LYS  25          HZ2       LYS  25   9.332   8.425 -15.552
  195   3HZ   LYS  25          HZ3       LYS  25  10.195   9.588 -16.294
  196    H    GLN  26           H        GLN  26   6.159   2.966 -19.205
  197    HA   GLN  26           HA       GLN  26   3.328   2.765 -18.809
  198   1HB   GLN  26          HB2       GLN  26   4.835   0.975 -20.736
  199   2HB   GLN  26          HB3       GLN  26   3.161   1.495 -20.786
  200   1HG   GLN  26          HG2       GLN  26   5.648   2.978 -21.537
  201   2HG   GLN  26          HG3       GLN  26   4.193   2.698 -22.470
  202   1HE2  GLN  26          HE22      GLN  26   5.904   5.085 -20.955
  203   2HE2  GLN  26          HE21      GLN  26   4.601   6.222 -20.632
  204    H    TYR  27           H        TYR  27   5.867   0.234 -18.761
  205    HA   TYR  27           HA       TYR  27   3.993  -1.820 -18.030
  206   1HB   TYR  27          HB2       TYR  27   7.031  -1.766 -17.879
  207   2HB   TYR  27          HB3       TYR  27   6.043  -3.190 -17.607
  208    HD1  TYR  27           HD1      TYR  27   7.973  -1.588 -20.021
  209    HD2  TYR  27           HD2      TYR  27   4.248  -3.709 -19.558
  210    HE1  TYR  27           HE1      TYR  27   8.100  -2.308 -22.379
  211    HE2  TYR  27           HE2      TYR  27   4.310  -4.347 -21.950
  212    HH   TYR  27           HH       TYR  27   7.007  -3.416 -24.128
  213    H    LEU  28           H        LEU  28   6.440   0.002 -16.124
  214    HA   LEU  28           HA       LEU  28   5.947  -1.472 -13.686
  215   1HB   LEU  28          HB2       LEU  28   7.213   1.274 -14.113
  216   2HB   LEU  28          HB3       LEU  28   7.292   0.323 -12.672
  217    HG   LEU  28           HG       LEU  28   8.549  -0.499 -15.301
  218   1HD1  LEU  28          HD11      LEU  28   9.806   0.413 -12.682
  219   2HD1  LEU  28          HD12      LEU  28  10.658  -0.007 -14.186
  220   3HD1  LEU  28          HD13      LEU  28   9.615   1.431 -14.119
  221   1HD2  LEU  28          HD21      LEU  28   8.668  -1.819 -12.557
  222   2HD2  LEU  28          HD22      LEU  28   7.867  -2.482 -13.993
  223   3HD2  LEU  28          HD23      LEU  28   9.615  -2.294 -13.984
  224    H    GLY  29           H        GLY  29   4.720   1.551 -15.042
  225   1HA   GLY  29          HA1       GLY  29   2.737   2.654 -14.563
  226   2HA   GLY  29          HA2       GLY  29   2.548   1.719 -13.070
  227    H    ASP  30           H        ASP  30   2.214   4.245 -12.746
  228    HA   ASP  30           HA       ASP  30   4.443   5.888 -12.081
  229   1HB   ASP  30          HB2       ASP  30   2.178   6.752 -12.473
  230   2HB   ASP  30          HB3       ASP  30   1.561   5.838 -11.094
  231    H    GLU  31           H        GLU  31   3.455   2.973 -10.734
  232    HA   GLU  31           HA       GLU  31   3.800   3.433  -7.909
  233   1HB   GLU  31          HB2       GLU  31   3.967   0.886  -9.583
  234   2HB   GLU  31          HB3       GLU  31   3.969   0.944  -7.816
  235   1HG   GLU  31          HG2       GLU  31   1.728   2.061  -7.880
  236   2HG   GLU  31          HG3       GLU  31   1.710   1.868  -9.636
  237    H    TRP  32           H        TRP  32   5.959   3.600 -10.465
  238    HA   TRP  32           HA       TRP  32   8.276   3.313  -8.666
  239   1HB   TRP  32          HB2       TRP  32   8.149   2.541 -11.608
  240   2HB   TRP  32          HB3       TRP  32   9.585   2.522 -10.599
  241    HD1  TRP  32           HD1      TRP  32   6.094   0.816 -10.528
  242    HE1  TRP  32           HE1      TRP  32   6.378  -1.663  -9.975
  243    HE3  TRP  32           HE3      TRP  32  11.184   0.686  -9.933
  244    HZ2  TRP  32           HZ2      TRP  32   8.518  -3.502  -9.542
  245    HZ3  TRP  32           HZ3      TRP  32  12.328  -1.475  -9.539
  246    HH2  TRP  32           HH2      TRP  32  11.009  -3.592  -9.398
  247    H    LYS  33           H        LYS  33   9.342   5.207  -8.561
  248    HA   LYS  33           HA       LYS  33   8.797   7.426 -10.363
  249   1HB   LYS  33          HB2       LYS  33  10.745   6.985  -8.049
  250   2HB   LYS  33          HB3       LYS  33  10.633   8.491  -8.962
  251   1HG   LYS  33          HG2       LYS  33   8.489   7.297  -7.167
  252   2HG   LYS  33          HG3       LYS  33   9.528   8.662  -6.830
  253   1HD   LYS  33          HD2       LYS  33   7.637   9.778  -7.430
  254   2HD   LYS  33          HD3       LYS  33   8.463   9.726  -8.989
  255   1HE   LYS  33          HE2       LYS  33   7.041   7.707  -9.588
  256   2HE   LYS  33          HE3       LYS  33   6.225   7.865  -8.033
  257   1HZ   LYS  33          HZ1       LYS  33   5.402  10.010  -8.720
  258   2HZ   LYS  33          HZ2       LYS  33   6.242   9.965 -10.124
  259   3HZ   LYS  33          HZ3       LYS  33   5.017   8.917  -9.880
  260    H    VAL  34           H        VAL  34   9.328   6.615 -12.338
  261    HA   VAL  34           HA       VAL  34  11.855   5.326 -12.816
  262    HB   VAL  34           HB       VAL  34   9.977   6.396 -14.943
  263   1HG1  VAL  34          HG11      VAL  34  12.242   5.146 -15.374
  264   2HG1  VAL  34          HG12      VAL  34  11.334   3.702 -14.905
  265   3HG1  VAL  34          HG13      VAL  34  10.783   4.702 -16.277
  266   1HG2  VAL  34          HG21      VAL  34   8.372   5.310 -13.552
  267   2HG2  VAL  34          HG22      VAL  34   8.758   4.170 -14.839
  268   3HG2  VAL  34          HG23      VAL  34   9.463   3.941 -13.227
  269    H    TYR  35           H        TYR  35  13.720   6.321 -13.497
  270    HA   TYR  35           HA       TYR  35  13.630   9.047 -14.688
  271   1HB   TYR  35          HB2       TYR  35  15.481   8.090 -12.462
  272   2HB   TYR  35          HB3       TYR  35  15.626   9.621 -13.305
  273    HD1  TYR  35           HD1      TYR  35  14.208   7.944 -10.480
  274    HD2  TYR  35           HD2      TYR  35  13.665  11.315 -13.120
  275    HE1  TYR  35           HE1      TYR  35  12.911   9.098  -8.728
  276    HE2  TYR  35           HE2      TYR  35  12.315  12.461 -11.387
  277    HH   TYR  35           HH       TYR  35  11.711  11.023  -8.145
  278    H    SER  36           H        SER  36  15.775   9.540 -15.766
  279    HA   SER  36           HA       SER  36  17.615   7.325 -16.063
  280   1HB   SER  36          HB2       SER  36  17.685   7.441 -18.497
  281   2HB   SER  36          HB3       SER  36  16.101   6.918 -17.943
  282    HG   SER  36           HG       SER  36  15.278   8.964 -18.347
  283    H    ALA  37           H        ALA  37  19.678   8.077 -17.026
  284    HA   ALA  37           HA       ALA  37  20.182  10.894 -17.364
  285   1HB   ALA  37          HB1       ALA  37  20.080  10.881 -14.920
  286   2HB   ALA  37          HB2       ALA  37  21.267   9.557 -14.853
  287   3HB   ALA  37          HB3       ALA  37  21.716  11.162 -15.475
  288    H    GLY  38           H        GLY  38  22.941  10.908 -17.053
  289   1HA   GLY  38          HA1       GLY  38  24.285   8.515 -17.716
  290   2HA   GLY  38          HA2       GLY  38  23.974   9.426 -19.210
  291    H    ILE  39           H        ILE  39  26.444   9.181 -18.942
  292    HA   ILE  39           HA       ILE  39  27.974  10.827 -17.259
  293    HB   ILE  39           HB       ILE  39  28.238   9.464 -19.945
  294   1HG1  ILE  39          HG12      ILE  39  29.836   9.193 -17.371
  295   2HG1  ILE  39          HG13      ILE  39  28.408   8.248 -17.788
  296   1HG2  ILE  39          HG21      ILE  39  30.439  11.250 -18.885
  297   2HG2  ILE  39          HG22      ILE  39  30.565  10.108 -20.249
  298   3HG2  ILE  39          HG23      ILE  39  29.490  11.480 -20.381
  299   1HD1  ILE  39          HD11      ILE  39  30.362   6.923 -18.252
  300   2HD1  ILE  39          HD12      ILE  39  29.573   7.340 -19.786
  301   3HD1  ILE  39          HD13      ILE  39  31.060   8.182 -19.272
  302    H    GLU  40           H        GLU  40  25.967  11.677 -20.028
  303    HA   GLU  40           HA       GLU  40  26.419  14.456 -19.463
  304   1HB   GLU  40          HB2       GLU  40  26.739  15.118 -21.802
  305   2HB   GLU  40          HB3       GLU  40  28.107  14.208 -21.173
  306   1HG   GLU  40          HG2       GLU  40  27.517  12.237 -22.383
  307   2HG   GLU  40          HG3       GLU  40  25.897  12.835 -22.761
  308    H    ALA  41           H        ALA  41  24.814  15.773 -20.888
  309    HA   ALA  41           HA       ALA  41  22.543  14.298 -21.968
  310   1HB   ALA  41          HB1       ALA  41  20.986  15.830 -20.626
  311   2HB   ALA  41          HB2       ALA  41  21.779  14.532 -19.698
  312   3HB   ALA  41          HB3       ALA  41  22.363  16.211 -19.588
  313    H    HIS  42           H        HIS  42  21.927  15.382 -23.773
  314    HA   HIS  42           HA       HIS  42  22.400  18.301 -23.992
  315   1HB   HIS  42          HB2       HIS  42  23.432  16.156 -25.889
  316   2HB   HIS  42          HB3       HIS  42  23.202  17.827 -26.391
  317    HD1  HIS  42           HD1      HIS  42  25.888  15.746 -24.865
  318    HD2  HIS  42           HD2      HIS  42  24.535  19.749 -24.767
  319    HE1  HIS  42           HE1      HIS  42  27.804  17.135 -23.965
  320    H    GLY  43           H        GLY  43  20.064  16.053 -23.839
  321   1HA   GLY  43          HA1       GLY  43  17.827  16.688 -24.284
  322   2HA   GLY  43          HA2       GLY  43  18.320  17.600 -25.709
  323    H    LEU  44           H        LEU  44  16.501  15.194 -25.111
  324    HA   LEU  44           HA       LEU  44  17.613  12.897 -26.175
  325   1HB   LEU  44          HB2       LEU  44  15.485  11.921 -26.112
  326   2HB   LEU  44          HB3       LEU  44  15.615  13.002 -24.730
  327    HG   LEU  44           HG       LEU  44  14.038  13.487 -27.296
  328   1HD1  LEU  44          HD11      LEU  44  13.171  12.981 -24.407
  329   2HD1  LEU  44          HD12      LEU  44  12.096  13.222 -25.797
  330   3HD1  LEU  44          HD13      LEU  44  13.142  11.794 -25.719
  331   1HD2  LEU  44          HD21      LEU  44  14.234  15.258 -24.810
  332   2HD2  LEU  44          HD22      LEU  44  14.712  15.696 -26.475
  333   3HD2  LEU  44          HD23      LEU  44  13.017  15.431 -26.089
  334    H    ASN  45           H        ASN  45  17.392  11.724 -28.037
  335    HA   ASN  45           HA       ASN  45  17.941  13.289 -30.373
  336   1HB   ASN  45          HB2       ASN  45  19.040  11.152 -29.678
  337   2HB   ASN  45          HB3       ASN  45  17.550  10.281 -30.014
  338   1HD2  ASN  45          HD22      ASN  45  20.478  10.560 -31.254
  339   2HD2  ASN  45          HD21      ASN  45  20.123  10.563 -32.965
  340    HA   PRO  46           HA       PRO  46  13.681  13.524 -31.901
  341   1HB   PRO  46          HB2       PRO  46  15.086  13.400 -34.578
  342   2HB   PRO  46          HB3       PRO  46  13.730  14.454 -34.069
  343   1HG   PRO  46          HG2       PRO  46  16.258  15.427 -34.122
  344   2HG   PRO  46          HG3       PRO  46  15.184  15.803 -32.734
  345   1HD   PRO  46          HD2       PRO  46  17.392  13.747 -32.901
  346   2HD   PRO  46          HD3       PRO  46  16.972  14.862 -31.564
  347    H    ASN  47           H        ASN  47  15.980  11.042 -33.129
  348    HA   ASN  47           HA       ASN  47  13.867   9.413 -34.317
  349   1HB   ASN  47          HB2       ASN  47  16.777   8.871 -33.644
  350   2HB   ASN  47          HB3       ASN  47  15.702   7.647 -34.306
  351   1HD2  ASN  47          HD22      ASN  47  18.190   8.933 -35.465
  352   2HD2  ASN  47          HD21      ASN  47  17.673   9.486 -37.037
  353    H    ALA  48           H        ALA  48  15.354   9.757 -31.121
  354    HA   ALA  48           HA       ALA  48  14.373   7.276 -30.053
  355   1HB   ALA  48          HB1       ALA  48  16.181   8.719 -28.966
  356   2HB   ALA  48          HB2       ALA  48  14.917   9.866 -28.512
  357   3HB   ALA  48          HB3       ALA  48  14.869   8.214 -27.884
  358    H    VAL  49           H        VAL  49  13.171  10.683 -30.110
  359    HA   VAL  49           HA       VAL  49  10.707  10.166 -28.821
  360    HB   VAL  49           HB       VAL  49  11.248  12.275 -30.963
  361   1HG1  VAL  49          HG11      VAL  49   9.200  12.183 -28.697
  362   2HG1  VAL  49          HG12      VAL  49   9.481  13.557 -29.784
  363   3HG1  VAL  49          HG13      VAL  49   8.842  12.045 -30.432
  364   1HG2  VAL  49          HG21      VAL  49  12.930  12.482 -29.183
  365   2HG2  VAL  49          HG22      VAL  49  11.752  13.787 -29.050
  366   3HG2  VAL  49          HG23      VAL  49  11.653  12.397 -27.950
  367    H    LYS  50           H        LYS  50  11.469  10.200 -32.368
  368    HA   LYS  50           HA       LYS  50   8.873   9.476 -33.177
  369   1HB   LYS  50          HB2       LYS  50  10.756  10.381 -34.620
  370   2HB   LYS  50          HB3       LYS  50  11.492   8.781 -34.576
  371   1HG   LYS  50          HG2       LYS  50  10.317   9.015 -36.648
  372   2HG   LYS  50          HG3       LYS  50   9.420   7.851 -35.671
  373   1HD   LYS  50          HD2       LYS  50   7.754   9.579 -35.087
  374   2HD   LYS  50          HD3       LYS  50   8.690  10.794 -35.992
  375   1HE   LYS  50          HE2       LYS  50   8.392   9.445 -38.067
  376   2HE   LYS  50          HE3       LYS  50   7.453   8.255 -37.157
  377   1HZ   LYS  50          HZ1       LYS  50   6.027   9.809 -38.328
  378   2HZ   LYS  50          HZ2       LYS  50   5.805   9.987 -36.725
  379   3HZ   LYS  50          HZ3       LYS  50   6.679  11.088 -37.562
  380    H    ALA  51           H        ALA  51  11.642   7.351 -32.259
  381    HA   ALA  51           HA       ALA  51  10.429   4.899 -32.952
  382   1HB   ALA  51          HB1       ALA  51  12.037   3.904 -31.373
  383   2HB   ALA  51          HB2       ALA  51  12.818   5.126 -32.387
  384   3HB   ALA  51          HB3       ALA  51  12.403   5.506 -30.704
  385    H    MET  52           H        MET  52  10.287   6.780 -29.854
  386    HA   MET  52           HA       MET  52   8.578   4.839 -28.592
  387   1HB   MET  52          HB2       MET  52   9.015   7.786 -27.957
  388   2HB   MET  52          HB3       MET  52   8.152   6.640 -26.934
  389   1HG   MET  52          HG2       MET  52  11.092   6.677 -27.626
  390   2HG   MET  52          HG3       MET  52  10.333   6.800 -26.050
  391   1HE   MET  52          HE1       MET  52   8.218   4.193 -26.414
  392   2HE   MET  52          HE2       MET  52   9.168   3.144 -25.356
  393   3HE   MET  52          HE3       MET  52   9.016   4.857 -24.954
  394    H    LYS  53           H        LYS  53   7.856   7.785 -30.525
  395    HA   LYS  53           HA       LYS  53   5.044   7.609 -30.137
  396   1HB   LYS  53          HB2       LYS  53   6.714   8.706 -32.410
  397   2HB   LYS  53          HB3       LYS  53   4.970   8.905 -32.335
  398   1HG   LYS  53          HG2       LYS  53   6.533   9.761 -29.896
  399   2HG   LYS  53          HG3       LYS  53   6.728  10.725 -31.359
  400   1HD   LYS  53          HD2       LYS  53   5.030  11.718 -29.994
  401   2HD   LYS  53          HD3       LYS  53   4.286  11.092 -31.470
  402   1HE   LYS  53          HE2       LYS  53   3.495   9.093 -30.215
  403   2HE   LYS  53          HE3       LYS  53   4.275   9.706 -28.749
  404   1HZ   LYS  53          HZ1       LYS  53   2.052  11.041 -30.190
  405   2HZ   LYS  53          HZ2       LYS  53   1.915  10.231 -28.785
  406   3HZ   LYS  53          HZ3       LYS  53   2.769  11.617 -28.840
  407    H    GLU  54           H        GLU  54   7.211   5.677 -32.149
  408    HA   GLU  54           HA       GLU  54   5.229   4.695 -33.930
  409   1HB   GLU  54          HB2       GLU  54   7.811   4.618 -34.116
  410   2HB   GLU  54          HB3       GLU  54   7.712   3.193 -33.081
  411   1HG   GLU  54          HG2       GLU  54   7.855   2.499 -35.378
  412   2HG   GLU  54          HG3       GLU  54   6.265   2.082 -34.764
  413    H    VAL  55           H        VAL  55   5.814   4.085 -30.557
  414    HA   VAL  55           HA       VAL  55   4.005   1.703 -30.658
  415    HB   VAL  55           HB       VAL  55   5.092   1.011 -28.550
  416   1HG1  VAL  55          HG11      VAL  55   7.143   0.189 -29.632
  417   2HG1  VAL  55          HG12      VAL  55   5.787   0.127 -30.759
  418   3HG1  VAL  55          HG13      VAL  55   6.999   1.416 -30.900
  419   1HG2  VAL  55          HG21      VAL  55   7.186   3.152 -29.125
  420   2HG2  VAL  55          HG22      VAL  55   5.928   3.316 -27.871
  421   3HG2  VAL  55          HG23      VAL  55   7.132   2.040 -27.759
  422    H    GLY  56           H        GLY  56   3.949   4.965 -29.946
  423   1HA   GLY  56          HA1       GLY  56   2.010   6.074 -29.304
  424   2HA   GLY  56          HA2       GLY  56   1.359   4.588 -28.590
  425    H    ILE  57           H        ILE  57   4.633   5.933 -27.990
  426    HA   ILE  57           HA       ILE  57   3.867   6.650 -25.206
  427    HB   ILE  57           HB       ILE  57   6.345   5.250 -26.280
  428   1HG1  ILE  57          HG12      ILE  57   4.375   4.388 -24.124
  429   2HG1  ILE  57          HG13      ILE  57   4.332   3.821 -25.788
  430   1HG2  ILE  57          HG21      ILE  57   5.891   6.482 -23.528
  431   2HG2  ILE  57          HG22      ILE  57   7.193   5.340 -23.871
  432   3HG2  ILE  57          HG23      ILE  57   7.170   6.887 -24.693
  433   1HD1  ILE  57          HD11      ILE  57   6.560   3.245 -23.806
  434   2HD1  ILE  57          HD12      ILE  57   5.365   2.122 -24.466
  435   3HD1  ILE  57          HD13      ILE  57   6.589   2.813 -25.529
  436    H    ASP  58           H        ASP  58   5.293   8.386 -24.430
  437    HA   ASP  58           HA       ASP  58   6.596  10.021 -26.520
  438   1HB   ASP  58          HB2       ASP  58   4.526  11.231 -26.175
  439   2HB   ASP  58          HB3       ASP  58   4.657  11.056 -24.411
  440    H    ILE  59           H        ILE  59   8.424  10.982 -25.776
  441    HA   ILE  59           HA       ILE  59   9.200  10.665 -22.944
  442    HB   ILE  59           HB       ILE  59  11.563  10.176 -23.749
  443   1HG1  ILE  59          HG12      ILE  59  10.177   9.270 -26.315
  444   2HG1  ILE  59          HG13      ILE  59  11.074  10.776 -26.190
  445   1HG2  ILE  59          HG21      ILE  59   9.446   8.037 -24.293
  446   2HG2  ILE  59          HG22      ILE  59  11.131   7.767 -23.801
  447   3HG2  ILE  59          HG23      ILE  59  10.000   8.528 -22.687
  448   1HD1  ILE  59          HD11      ILE  59  12.287   8.015 -25.689
  449   2HD1  ILE  59          HD12      ILE  59  12.408   8.950 -27.180
  450   3HD1  ILE  59          HD13      ILE  59  13.142   9.569 -25.709
  451    H    SER  60           H        SER  60   8.429  12.818 -25.333
  452    HA   SER  60           HA       SER  60  10.462  14.806 -25.068
  453   1HB   SER  60          HB2       SER  60   7.507  15.382 -25.401
  454   2HB   SER  60          HB3       SER  60   8.891  16.294 -26.025
  455    HG   SER  60           HG       SER  60   7.779  13.835 -26.828
  456    H    ASN  61           H        ASN  61   7.795  13.788 -23.027
  457    HA   ASN  61           HA       ASN  61   7.747  15.936 -21.180
  458   1HB   ASN  61          HB2       ASN  61   6.460  14.428 -19.771
  459   2HB   ASN  61          HB3       ASN  61   5.943  14.263 -21.440
  460   1HD2  ASN  61          HD22      ASN  61   6.434  12.314 -22.594
  461   2HD2  ASN  61          HD21      ASN  61   6.970  10.858 -21.785
  462    H    GLN  62           H        GLN  62  10.454  13.887 -21.595
  463    HA   GLN  62           HA       GLN  62  11.248  14.215 -18.748
  464   1HB   GLN  62          HB2       GLN  62  12.133  11.836 -18.830
  465   2HB   GLN  62          HB3       GLN  62  10.378  11.994 -18.751
  466   1HG   GLN  62          HG2       GLN  62  10.098  11.472 -21.054
  467   2HG   GLN  62          HG3       GLN  62  11.817  11.715 -21.383
  468   1HE2  GLN  62          HE22      GLN  62  13.034  10.028 -21.601
  469   2HE2  GLN  62          HE21      GLN  62  12.586   8.370 -21.184
  470    H    THR  63           H        THR  63  12.084  16.018 -20.432
  471    HA   THR  63           HA       THR  63  14.176  15.576 -22.162
  472    HB   THR  63           HB       THR  63  14.788  18.021 -21.444
  473    HG1  THR  63           HG1      THR  63  13.788  18.001 -19.401
  474   1HG2  THR  63          HG21      THR  63  11.954  17.365 -22.352
  475   2HG2  THR  63          HG22      THR  63  12.807  18.904 -22.600
  476   3HG2  THR  63          HG23      THR  63  13.380  17.435 -23.409
  477    H    SER  64           H        SER  64  16.405  15.602 -22.103
  478    HA   SER  64           HA       SER  64  17.523  13.959 -20.332
  479   1HB   SER  64          HB2       SER  64  18.953  16.030 -22.020
  480   2HB   SER  64          HB3       SER  64  19.556  14.424 -21.566
  481    HG   SER  64           HG       SER  64  18.260  13.492 -22.957
  482    H    ASP  65           H        ASP  65  19.058  14.039 -18.739
  483    HA   ASP  65           HA       ASP  65  20.263  16.532 -17.841
  484   1HB   ASP  65          HB2       ASP  65  18.091  16.462 -16.558
  485   2HB   ASP  65          HB3       ASP  65  18.583  14.908 -15.880
  486    H    ILE  66           H        ILE  66  22.022  16.113 -16.339
  487    HA   ILE  66           HA       ILE  66  23.383  13.560 -16.839
  488    HB   ILE  66           HB       ILE  66  25.053  14.814 -15.162
  489   1HG1  ILE  66          HG12      ILE  66  23.456  16.844 -14.950
  490   2HG1  ILE  66          HG13      ILE  66  25.178  17.082 -15.162
  491   1HG2  ILE  66          HG21      ILE  66  25.603  13.985 -17.321
  492   2HG2  ILE  66          HG22      ILE  66  24.772  15.342 -18.115
  493   3HG2  ILE  66          HG23      ILE  66  26.245  15.623 -17.147
  494   1HD1  ILE  66          HD11      ILE  66  23.870  18.678 -16.507
  495   2HD1  ILE  66          HD12      ILE  66  24.911  17.671 -17.523
  496   3HD1  ILE  66          HD13      ILE  66  23.171  17.349 -17.445
  497    H    ILE  67           H        ILE  67  24.425  12.500 -14.945
  498    HA   ILE  67           HA       ILE  67  22.485  11.438 -13.225
  499    HB   ILE  67           HB       ILE  67  25.518  11.379 -13.277
  500   1HG1  ILE  67          HG12      ILE  67  23.437   9.200 -13.732
  501   2HG1  ILE  67          HG13      ILE  67  24.009  10.232 -15.034
  502   1HG2  ILE  67          HG21      ILE  67  24.921  11.029 -10.907
  503   2HG2  ILE  67          HG22      ILE  67  23.705   9.821 -11.380
  504   3HG2  ILE  67          HG23      ILE  67  25.442   9.518 -11.633
  505   1HD1  ILE  67          HD11      ILE  67  25.704   8.267 -13.463
  506   2HD1  ILE  67          HD12      ILE  67  25.189   8.175 -15.154
  507   3HD1  ILE  67          HD13      ILE  67  26.336   9.434 -14.654
  508    H    ASP  68           H        ASP  68  22.018  11.682 -11.089
  509    HA   ASP  68           HA       ASP  68  23.312  13.851  -9.538
  510   1HB   ASP  68          HB2       ASP  68  21.198  14.708 -10.668
  511   2HB   ASP  68          HB3       ASP  68  20.292  13.552  -9.686
  512    H    SER  69           H        SER  69  23.661  13.289  -7.462
  513    HA   SER  69           HA       SER  69  23.549  10.693  -6.546
  514   1HB   SER  69          HB2       SER  69  23.566  13.198  -4.840
  515   2HB   SER  69          HB3       SER  69  24.268  11.616  -4.449
  516    HG   SER  69           HG       SER  69  25.839  13.119  -5.205
  517    H    ASP  70           H        ASP  70  20.986  13.092  -6.459
  518    HA   ASP  70           HA       ASP  70  19.576  12.086  -4.171
  519   1HB   ASP  70          HB2       ASP  70  19.385  14.404  -5.032
  520   2HB   ASP  70          HB3       ASP  70  18.599  13.787  -6.491
  521    H    ILE  71           H        ILE  71  19.931  10.866  -7.333
  522    HA   ILE  71           HA       ILE  71  17.515   9.148  -7.036
  523    HB   ILE  71           HB       ILE  71  18.984   9.897  -9.572
  524   1HG1  ILE  71          HG12      ILE  71  16.118  10.736  -9.063
  525   2HG1  ILE  71          HG13      ILE  71  17.391  11.724  -8.362
  526   1HG2  ILE  71          HG21      ILE  71  17.965   7.669  -9.614
  527   2HG2  ILE  71          HG22      ILE  71  16.416   8.316  -9.046
  528   3HG2  ILE  71          HG23      ILE  71  17.036   8.755 -10.656
  529   1HD1  ILE  71          HD11      ILE  71  18.452  12.062 -10.511
  530   2HD1  ILE  71          HD12      ILE  71  17.220  11.048 -11.314
  531   3HD1  ILE  71          HD13      ILE  71  16.757  12.585 -10.547
  532    H    LEU  72           H        LEU  72  21.011   9.288  -7.961
  533    HA   LEU  72           HA       LEU  72  21.569   6.589  -8.284
  534   1HB   LEU  72          HB2       LEU  72  23.194   8.633  -6.714
  535   2HB   LEU  72          HB3       LEU  72  23.772   7.024  -7.056
  536    HG   LEU  72           HG       LEU  72  23.139   9.088  -9.172
  537   1HD1  LEU  72          HD11      LEU  72  25.751   8.107  -7.924
  538   2HD1  LEU  72          HD12      LEU  72  25.663   9.142  -9.355
  539   3HD1  LEU  72          HD13      LEU  72  25.056   9.733  -7.806
  540   1HD2  LEU  72          HD21      LEU  72  24.365   7.492 -10.677
  541   2HD2  LEU  72          HD22      LEU  72  24.462   6.327  -9.345
  542   3HD2  LEU  72          HD23      LEU  72  22.891   6.767 -10.038
  543    H    ASN  73           H        ASN  73  21.748   8.258  -5.126
  544    HA   ASN  73           HA       ASN  73  22.050   5.748  -3.754
  545   1HB   ASN  73          HB2       ASN  73  22.725   6.931  -1.953
  546   2HB   ASN  73          HB3       ASN  73  22.989   8.183  -3.153
  547   1HD2  ASN  73          HD22      ASN  73  20.932   9.734  -3.444
  548   2HD2  ASN  73          HD21      ASN  73  20.086  10.125  -1.964
  549    H    ASN  74           H        ASN  74  19.312   6.883  -5.027
  550    HA   ASN  74           HA       ASN  74  17.520   6.301  -2.699
  551   1HB   ASN  74          HB2       ASN  74  17.715   8.659  -3.423
  552   2HB   ASN  74          HB3       ASN  74  17.336   8.181  -5.071
  553   1HD2  ASN  74          HD22      ASN  74  15.788   9.932  -4.802
  554   2HD2  ASN  74          HD21      ASN  74  14.194   9.552  -4.161
  555    H    ALA  75           H        ALA  75  18.155   5.771  -6.143
  556    HA   ALA  75           HA       ALA  75  15.738   4.485  -6.870
  557   1HB   ALA  75          HB1       ALA  75  18.504   4.244  -8.052
  558   2HB   ALA  75          HB2       ALA  75  16.960   3.773  -8.817
  559   3HB   ALA  75          HB3       ALA  75  17.286   5.475  -8.464
  560    H    ASP  76           H        ASP  76  14.979   2.516  -6.483
  561    HA   ASP  76           HA       ASP  76  16.312   0.757  -4.644
  562   1HB   ASP  76          HB2       ASP  76  13.851   0.929  -4.799
  563   2HB   ASP  76          HB3       ASP  76  13.906   0.271  -6.439
  564    H    LEU  77           H        LEU  77  16.322   1.155  -8.088
  565    HA   LEU  77           HA       LEU  77  18.389  -0.903  -8.349
  566   1HB   LEU  77          HB2       LEU  77  16.353  -2.170  -8.954
  567   2HB   LEU  77          HB3       LEU  77  15.853  -0.879 -10.048
  568    HG   LEU  77           HG       LEU  77  17.837  -1.323 -11.490
  569   1HD1  LEU  77          HD11      LEU  77  18.316  -3.707  -9.641
  570   2HD1  LEU  77          HD12      LEU  77  19.154  -3.383 -11.175
  571   3HD1  LEU  77          HD13      LEU  77  19.394  -2.304  -9.809
  572   1HD2  LEU  77          HD21      LEU  77  15.695  -2.383 -11.982
  573   2HD2  LEU  77          HD22      LEU  77  17.042  -3.436 -12.427
  574   3HD2  LEU  77          HD23      LEU  77  16.118  -3.763 -10.945
  575    H    VAL  78           H        VAL  78  19.895  -0.270  -9.840
  576    HA   VAL  78           HA       VAL  78  19.277   2.039 -11.610
  577    HB   VAL  78           HB       VAL  78  21.934   1.321 -10.295
  578   1HG1  VAL  78          HG11      VAL  78  22.315   2.362 -12.480
  579   2HG1  VAL  78          HG12      VAL  78  21.146   3.649 -12.111
  580   3HG1  VAL  78          HG13      VAL  78  22.668   3.536 -11.212
  581   1HG2  VAL  78          HG21      VAL  78  20.063   3.662  -9.731
  582   2HG2  VAL  78          HG22      VAL  78  20.424   2.320  -8.627
  583   3HG2  VAL  78          HG23      VAL  78  21.694   3.460  -9.059
  584    H    VAL  79           H        VAL  79  20.135   1.704 -13.819
  585    HA   VAL  79           HA       VAL  79  21.275  -0.992 -14.346
  586    HB   VAL  79           HB       VAL  79  19.056   0.256 -15.991
  587   1HG1  VAL  79          HG11      VAL  79  20.227  -2.554 -15.996
  588   2HG1  VAL  79          HG12      VAL  79  18.912  -1.963 -17.036
  589   3HG1  VAL  79          HG13      VAL  79  20.536  -1.304 -17.218
  590   1HG2  VAL  79          HG21      VAL  79  18.762  -1.911 -13.886
  591   2HG2  VAL  79          HG22      VAL  79  17.970  -0.322 -13.918
  592   3HG2  VAL  79          HG23      VAL  79  17.547  -1.534 -15.124
  593    H    THR  80           H        THR  80  23.048  -0.806 -15.651
  594    HA   THR  80           HA       THR  80  23.475   1.746 -17.136
  595    HB   THR  80           HB       THR  80  25.735   0.450 -17.635
  596    HG1  THR  80           HG1      THR  80  25.018  -1.429 -16.404
  597   1HG2  THR  80          HG21      THR  80  25.098   1.842 -15.006
  598   2HG2  THR  80          HG22      THR  80  26.733   1.550 -15.654
  599   3HG2  THR  80          HG23      THR  80  25.608   2.590 -16.531
  600    H    LEU  81           H        LEU  81  23.243   1.816 -19.289
  601    HA   LEU  81           HA       LEU  81  22.316  -0.654 -20.658
  602   1HB   LEU  81          HB2       LEU  81  21.939   2.323 -21.148
  603   2HB   LEU  81          HB3       LEU  81  21.507   1.101 -22.331
  604    HG   LEU  81           HG       LEU  81  19.926   0.044 -20.770
  605   1HD1  LEU  81          HD11      LEU  81  20.554   2.380 -18.925
  606   2HD1  LEU  81          HD12      LEU  81  19.123   1.333 -18.795
  607   3HD1  LEU  81          HD13      LEU  81  20.713   0.644 -18.565
  608   1HD2  LEU  81          HD21      LEU  81  19.541   3.030 -21.258
  609   2HD2  LEU  81          HD22      LEU  81  19.129   1.714 -22.378
  610   3HD2  LEU  81          HD23      LEU  81  18.236   1.893 -20.871
  611    H    CYS  82           H        CYS  82  25.259   0.693 -20.317
  612    HA   CYS  82           HA       CYS  82  26.151   1.249 -22.951
  613   1HB   CYS  82          HB2       CYS  82  28.403   1.056 -21.908
  614   2HB   CYS  82          HB3       CYS  82  27.321   2.193 -21.114
  615    H    GLY  83           H        GLY  83  26.011  -0.322 -24.546
  616   1HA   GLY  83          HA1       GLY  83  27.924  -2.546 -24.274
  617   2HA   GLY  83          HA2       GLY  83  26.269  -2.990 -24.687
  618    H    ASP  84           H        ASP  84  27.586   0.050 -25.702
  619    HA   ASP  84           HA       ASP  84  27.607  -0.545 -28.593
  620   1HB   ASP  84          HB2       ASP  84  27.921   1.898 -28.758
  621   2HB   ASP  84          HB3       ASP  84  26.548   1.545 -27.710
  622    H    ALA  85           H        ALA  85  29.606   0.848 -29.587
  623    HA   ALA  85           HA       ALA  85  31.888  -0.754 -28.960
  624   1HB   ALA  85          HB1       ALA  85  31.282  -0.044 -31.256
  625   2HB   ALA  85          HB2       ALA  85  31.614   1.652 -30.818
  626   3HB   ALA  85          HB3       ALA  85  32.929   0.459 -30.835
  627    H    ALA  86           H        ALA  86  30.945   2.368 -27.660
  628    HA   ALA  86           HA       ALA  86  33.771   3.014 -26.959
  629   1HB   ALA  86          HB1       ALA  86  32.469   4.806 -28.053
  630   2HB   ALA  86          HB2       ALA  86  31.251   4.713 -26.757
  631   3HB   ALA  86          HB3       ALA  86  32.907   5.226 -26.385
  632    H    ASP  87           H        ASP  87  30.585   2.303 -25.639
  633    HA   ASP  87           HA       ASP  87  29.816   2.056 -23.532
  634   1HB   ASP  87          HB2       ASP  87  30.251  -0.065 -22.695
  635   2HB   ASP  87          HB3       ASP  87  30.371  -0.155 -24.428
  636    H    LYS  88           H        LYS  88  30.947   4.273 -23.056
  637    HA   LYS  88           HA       LYS  88  33.100   4.332 -21.232
  638   1HB   LYS  88          HB2       LYS  88  30.830   6.345 -21.475
  639   2HB   LYS  88          HB3       LYS  88  32.368   6.632 -20.697
  640   1HG   LYS  88          HG2       LYS  88  31.934   6.094 -23.667
  641   2HG   LYS  88          HG3       LYS  88  32.264   7.652 -22.924
  642   1HD   LYS  88          HD2       LYS  88  34.184   5.282 -23.009
  643   2HD   LYS  88          HD3       LYS  88  34.257   6.733 -24.011
  644   1HE   LYS  88          HE2       LYS  88  34.541   8.134 -21.965
  645   2HE   LYS  88          HE3       LYS  88  34.517   6.677 -20.968
  646   1HZ   LYS  88          HZ1       LYS  88  36.527   5.937 -22.121
  647   2HZ   LYS  88          HZ2       LYS  88  36.548   7.290 -23.039
  648   3HZ   LYS  88          HZ3       LYS  88  36.772   7.390 -21.431
  649    H    CYS  89           H        CYS  89  29.797   3.506 -20.628
  650    HA   CYS  89           HA       CYS  89  28.585   2.970 -18.818
  651   1HB   CYS  89          HB2       CYS  89  31.224   1.756 -18.060
  652   2HB   CYS  89          HB3       CYS  89  29.683   1.373 -17.310
  653    HA   PRO  90           HA       PRO  90  29.383   6.441 -15.856
  654   1HB   PRO  90          HB2       PRO  90  26.755   6.220 -14.853
  655   2HB   PRO  90          HB3       PRO  90  27.388   7.414 -16.018
  656   1HG   PRO  90          HG2       PRO  90  25.938   4.837 -16.529
  657   2HG   PRO  90          HG3       PRO  90  25.797   6.385 -17.420
  658   1HD   PRO  90          HD2       PRO  90  27.146   4.283 -18.401
  659   2HD   PRO  90          HD3       PRO  90  27.790   5.934 -18.627
  660    H    MET  91           H        MET  91  29.942   6.188 -13.676
  661    HA   MET  91           HA       MET  91  29.830   3.546 -12.488
  662   1HB   MET  91          HB2       MET  91  30.953   6.203 -11.506
  663   2HB   MET  91          HB3       MET  91  31.088   4.670 -10.635
  664   1HG   MET  91          HG2       MET  91  32.273   3.673 -12.577
  665   2HG   MET  91          HG3       MET  91  32.237   5.231 -13.399
  666   1HE   MET  91          HE1       MET  91  33.665   7.313 -12.765
  667   2HE   MET  91          HE2       MET  91  32.946   7.385 -11.139
  668   3HE   MET  91          HE3       MET  91  34.708   7.425 -11.332
  669    H    THR  92           H        THR  92  28.835   3.114 -10.471
  670    HA   THR  92           HA       THR  92  26.666   4.909  -9.550
  671    HB   THR  92           HB       THR  92  25.506   2.682  -9.158
  672    HG1  THR  92           HG1      THR  92  27.178   1.245  -9.177
  673   1HG2  THR  92          HG21      THR  92  26.336   3.090 -12.061
  674   2HG2  THR  92          HG22      THR  92  24.835   2.369 -11.455
  675   3HG2  THR  92          HG23      THR  92  25.136   4.097 -11.221
  676    HA   PRO  93           HA       PRO  93  28.326   4.205  -5.449
  677   1HB   PRO  93          HB2       PRO  93  26.106   3.937  -3.844
  678   2HB   PRO  93          HB3       PRO  93  26.655   5.500  -4.528
  679   1HG   PRO  93          HG2       PRO  93  24.534   3.626  -5.599
  680   2HG   PRO  93          HG3       PRO  93  24.416   5.395  -5.366
  681   1HD   PRO  93          HD2       PRO  93  24.987   4.304  -7.788
  682   2HD   PRO  93          HD3       PRO  93  25.803   5.805  -7.257
  683    HA   PRO  94           HA       PRO  94  28.344  -0.257  -5.414
  684   1HB   PRO  94          HB2       PRO  94  29.884  -0.812  -3.230
  685   2HB   PRO  94          HB3       PRO  94  30.540  -0.049  -4.711
  686   1HG   PRO  94          HG2       PRO  94  29.649   1.312  -2.152
  687   2HG   PRO  94          HG3       PRO  94  31.171   1.562  -3.068
  688   1HD   PRO  94          HD2       PRO  94  28.979   3.194  -3.354
  689   2HD   PRO  94          HD3       PRO  94  30.071   2.822  -4.727
  690    H    HIS  95           H        HIS  95  27.056   1.573  -2.694
  691    HA   HIS  95           HA       HIS  95  25.932  -0.744  -1.342
  692   1HB   HIS  95          HB2       HIS  95  25.032   0.906   0.221
  693   2HB   HIS  95          HB3       HIS  95  26.753   1.107  -0.036
  694    HD1  HIS  95           HD1      HIS  95  27.526   3.527  -0.788
  695    HD2  HIS  95           HD2      HIS  95  23.378   2.822  -0.935
  696    HE1  HIS  95           HE1      HIS  95  26.433   5.773  -1.269
  697    H    VAL  96           H        VAL  96  25.049   0.486  -4.249
  698    HA   VAL  96           HA       VAL  96  22.157  -0.027  -3.720
  699    HB   VAL  96           HB       VAL  96  23.290   1.846  -5.806
  700   1HG1  VAL  96          HG11      VAL  96  20.414   1.220  -5.012
  701   2HG1  VAL  96          HG12      VAL  96  20.916   2.524  -6.106
  702   3HG1  VAL  96          HG13      VAL  96  21.191   0.848  -6.567
  703   1HG2  VAL  96          HG21      VAL  96  23.499   2.869  -3.575
  704   2HG2  VAL  96          HG22      VAL  96  22.157   3.617  -4.430
  705   3HG2  VAL  96          HG23      VAL  96  21.827   2.410  -3.174
  706    H    LYS  97           H        LYS  97  21.158  -1.484  -5.110
  707    HA   LYS  97           HA       LYS  97  22.783  -3.398  -6.494
  708   1HB   LYS  97          HB2       LYS  97  20.585  -3.915  -5.428
  709   2HB   LYS  97          HB3       LYS  97  19.771  -2.875  -6.610
  710   1HG   LYS  97          HG2       LYS  97  20.540  -4.360  -8.448
  711   2HG   LYS  97          HG3       LYS  97  21.399  -5.375  -7.274
  712   1HD   LYS  97          HD2       LYS  97  19.257  -5.938  -6.178
  713   2HD   LYS  97          HD3       LYS  97  18.385  -4.878  -7.308
  714   1HE   LYS  97          HE2       LYS  97  19.169  -6.262  -9.216
  715   2HE   LYS  97          HE3       LYS  97  20.057  -7.308  -8.102
  716   1HZ   LYS  97          HZ1       LYS  97  17.939  -7.940  -7.103
  717   2HZ   LYS  97          HZ2       LYS  97  17.112  -6.969  -8.127
  718   3HZ   LYS  97          HZ3       LYS  97  17.924  -8.259  -8.699
  719    H    ARG  98           H        ARG  98  23.292  -3.499  -8.634
  720    HA   ARG  98           HA       ARG  98  21.967  -1.622 -10.472
  721   1HB   ARG  98          HB2       ARG  98  24.446  -0.950  -9.826
  722   2HB   ARG  98          HB3       ARG  98  24.882  -2.283 -10.901
  723   1HG   ARG  98          HG2       ARG  98  23.033  -0.901 -12.449
  724   2HG   ARG  98          HG3       ARG  98  23.706   0.402 -11.501
  725   1HD   ARG  98          HD2       ARG  98  25.218  -1.555 -13.280
  726   2HD   ARG  98          HD3       ARG  98  24.777   0.112 -13.676
  727    HE   ARG  98           HE       ARG  98  26.252   0.374 -11.366
  728   1HH1  ARG  98          HH21      ARG  98  26.830  -0.782 -14.671
  729   2HH1  ARG  98          HH22      ARG  98  28.556  -0.633 -14.562
  730   1HH2  ARG  98          HH11      ARG  98  28.407   0.732 -11.263
  731   2HH2  ARG  98          HH12      ARG  98  29.501   0.321 -12.558
  732    H    GLU  99           H        GLU  99  21.849  -2.405 -12.646
  733    HA   GLU  99           HA       GLU  99  22.616  -5.236 -13.142
  734   1HB   GLU  99          HB2       GLU  99  19.983  -3.816 -13.666
  735   2HB   GLU  99          HB3       GLU  99  20.559  -5.036 -14.803
  736   1HG   GLU  99          HG2       GLU  99  20.738  -6.704 -13.040
  737   2HG   GLU  99          HG3       GLU  99  20.221  -5.525 -11.823
  738    H    HIS 100           H        HIS 100  22.899  -5.583 -15.524
  739    HA   HIS 100           HA       HIS 100  23.901  -3.161 -16.929
  740   1HB   HIS 100          HB2       HIS 100  25.812  -4.242 -15.872
  741   2HB   HIS 100          HB3       HIS 100  25.321  -5.817 -16.500
  742    HD1  HIS 100           HD1      HIS 100  26.818  -2.479 -17.771
  743    HD2  HIS 100           HD2      HIS 100  26.006  -6.434 -18.979
  744    HE1  HIS 100           HE1      HIS 100  27.968  -2.795 -20.016
  745    H    TRP 101           H        TRP 101  22.643  -2.982 -18.619
  746    HA   TRP 101           HA       TRP 101  21.626  -5.394 -20.071
  747   1HB   TRP 101          HB2       TRP 101  20.308  -2.686 -19.600
  748   2HB   TRP 101          HB3       TRP 101  19.735  -3.894 -20.731
  749    HD1  TRP 101           HD1      TRP 101  20.668  -5.264 -17.299
  750    HE1  TRP 101           HE1      TRP 101  18.570  -5.787 -15.956
  751    HE3  TRP 101           HE3      TRP 101  17.193  -3.249 -20.480
  752    HZ2  TRP 101           HZ2      TRP 101  15.724  -5.439 -16.254
  753    HZ3  TRP 101           HZ3      TRP 101  14.775  -3.422 -19.951
  754    HH2  TRP 101           HH2      TRP 101  14.033  -4.502 -17.831
  755    H    GLY 102           H        GLY 102  24.100  -4.777 -20.779
  756   1HA   GLY 102          HA1       GLY 102  24.478  -2.466 -22.391
  757   2HA   GLY 102          HA2       GLY 102  25.493  -3.910 -22.374
  758    H    PHE 103           H        PHE 103  23.795  -2.038 -24.378
  759    HA   PHE 103           HA       PHE 103  23.877  -3.996 -26.496
  760   1HB   PHE 103          HB2       PHE 103  21.529  -3.119 -27.308
  761   2HB   PHE 103          HB3       PHE 103  21.664  -4.494 -26.238
  762    HD1  PHE 103           HD1      PHE 103  19.971  -4.621 -24.666
  763    HD2  PHE 103           HD2      PHE 103  21.508  -0.730 -25.744
  764    HE1  PHE 103           HE1      PHE 103  18.496  -3.567 -22.978
  765    HE2  PHE 103           HE2      PHE 103  20.068   0.298 -24.019
  766    HZ   PHE 103           HZ       PHE 103  18.583  -1.107 -22.612
  767    H    ASP 104           H        ASP 104  23.537  -2.714 -28.627
  768    HA   ASP 104           HA       ASP 104  25.381  -0.561 -28.529
  769   1HB   ASP 104          HB2       ASP 104  25.079  -2.126 -30.444
  770   2HB   ASP 104          HB3       ASP 104  23.519  -1.366 -30.789
  771    H    ASP 105           H        ASP 105  25.087   1.568 -29.171
  772    HA   ASP 105           HA       ASP 105  22.614   2.888 -28.181
  773   1HB   ASP 105          HB2       ASP 105  24.652   3.902 -27.424
  774   2HB   ASP 105          HB3       ASP 105  25.333   3.900 -29.044
  775    HA   PRO 106           HA       PRO 106  21.506   2.575 -32.531
  776   1HB   PRO 106          HB2       PRO 106  19.091   3.860 -32.528
  777   2HB   PRO 106          HB3       PRO 106  19.339   2.200 -31.914
  778   1HG   PRO 106          HG2       PRO 106  19.257   4.764 -30.295
  779   2HG   PRO 106          HG3       PRO 106  18.388   3.230 -29.977
  780   1HD   PRO 106          HD2       PRO 106  20.729   3.830 -28.744
  781   2HD   PRO 106          HD3       PRO 106  20.388   2.158 -29.276
  782    H    ALA 107           H        ALA 107  21.900   5.624 -30.773
  783    HA   ALA 107           HA       ALA 107  21.853   7.286 -33.131
  784   1HB   ALA 107          HB1       ALA 107  21.482   8.176 -30.841
  785   2HB   ALA 107          HB2       ALA 107  23.169   7.790 -30.434
  786   3HB   ALA 107          HB3       ALA 107  22.816   8.996 -31.682
  787    H    ARG 108           H        ARG 108  24.082   4.928 -31.980
  788    HA   ARG 108           HA       ARG 108  26.374   6.126 -33.490
  789   1HB   ARG 108          HB2       ARG 108  26.264   4.181 -31.142
  790   2HB   ARG 108          HB3       ARG 108  27.731   4.500 -32.069
  791   1HG   ARG 108          HG2       ARG 108  27.706   6.833 -31.506
  792   2HG   ARG 108          HG3       ARG 108  26.152   6.683 -30.675
  793   1HD   ARG 108          HD2       ARG 108  27.106   5.413 -28.877
  794   2HD   ARG 108          HD3       ARG 108  28.548   5.032 -29.814
  795    HE   ARG 108           HE       ARG 108  29.529   6.970 -29.214
  796   1HH1  ARG 108          HH21      ARG 108  26.060   7.308 -28.349
  797   2HH1  ARG 108          HH22      ARG 108  26.323   8.779 -27.481
  798   1HH2  ARG 108          HH12      ARG 108  29.818   8.901 -28.042
  799   2HH2  ARG 108          HH11      ARG 108  28.486   9.690 -27.294
  800    H    ALA 109           H        ALA 109  23.909   4.057 -34.032
  801    HA   ALA 109           HA       ALA 109  25.216   1.744 -35.076
  802   1HB   ALA 109          HB1       ALA 109  22.949   1.733 -34.165
  803   2HB   ALA 109          HB2       ALA 109  22.405   2.851 -35.438
  804   3HB   ALA 109          HB3       ALA 109  22.953   1.220 -35.867
  805    H    GLN 110           H        GLN 110  26.785   3.281 -36.258
  806    HA   GLN 110           HA       GLN 110  26.071   4.955 -38.370
  807   1HB   GLN 110          HB2       GLN 110  28.623   3.435 -37.715
  808   2HB   GLN 110          HB3       GLN 110  28.542   4.651 -38.988
  809   1HG   GLN 110          HG2       GLN 110  28.345   6.427 -37.524
  810   2HG   GLN 110          HG3       GLN 110  27.542   5.494 -36.274
  811   1HE2  GLN 110          HE22      GLN 110  28.786   4.195 -34.794
  812   2HE2  GLN 110          HE21      GLN 110  30.514   4.437 -34.624
  813    H    GLY 111           H        GLY 111  25.934   4.779 -40.490
  814   1HA   GLY 111          HA1       GLY 111  26.805   2.925 -42.306
  815   2HA   GLY 111          HA2       GLY 111  25.224   2.290 -41.787
  816    H    THR 112           H        THR 112  23.557   4.227 -41.456
  817    HA   THR 112           HA       THR 112  23.841   6.635 -42.880
  818    HB   THR 112           HB       THR 112  23.516   5.333 -44.911
  819    HG1  THR 112           HG1      THR 112  21.869   6.456 -45.720
  820   1HG2  THR 112          HG21      THR 112  21.480   4.022 -45.363
  821   2HG2  THR 112          HG22      THR 112  22.430   3.304 -44.060
  822   3HG2  THR 112          HG23      THR 112  20.962   4.231 -43.681
  823    H    GLU 113           H        GLU 113  21.630   7.822 -42.758
  824    HA   GLU 113           HA       GLU 113  20.783   7.675 -40.031
  825   1HB   GLU 113          HB2       GLU 113  19.187   9.411 -40.612
  826   2HB   GLU 113          HB3       GLU 113  20.792   9.771 -41.247
  827   1HG   GLU 113          HG2       GLU 113  20.053   8.980 -43.508
  828   2HG   GLU 113          HG3       GLU 113  18.439   8.684 -42.859
  829    H    GLU 114           H        GLU 114  19.528   6.230 -43.005
  830    HA   GLU 114           HA       GLU 114  17.026   5.396 -41.901
  831   1HB   GLU 114          HB2       GLU 114  17.503   5.578 -44.323
  832   2HB   GLU 114          HB3       GLU 114  18.635   4.224 -44.209
  833   1HG   GLU 114          HG2       GLU 114  16.810   2.717 -43.536
  834   2HG   GLU 114          HG3       GLU 114  15.672   4.068 -43.502
  835    H    GLU 115           H        GLU 115  20.292   4.004 -41.912
  836    HA   GLU 115           HA       GLU 115  19.480   1.440 -40.868
  837   1HB   GLU 115          HB2       GLU 115  21.542   1.826 -42.251
  838   2HB   GLU 115          HB3       GLU 115  22.232   2.747 -40.913
  839   1HG   GLU 115          HG2       GLU 115  23.140   0.529 -40.889
  840   2HG   GLU 115          HG3       GLU 115  22.124   0.731 -39.474
  841    H    LYS 116           H        LYS 116  20.913   4.475 -39.505
  842    HA   LYS 116           HA       LYS 116  20.873   3.712 -36.787
  843   1HB   LYS 116          HB2       LYS 116  20.496   6.401 -38.165
  844   2HB   LYS 116          HB3       LYS 116  20.461   6.220 -36.399
  845   1HG   LYS 116          HG2       LYS 116  22.733   5.126 -36.544
  846   2HG   LYS 116          HG3       LYS 116  22.773   5.570 -38.266
  847   1HD   LYS 116          HD2       LYS 116  22.458   7.981 -37.573
  848   2HD   LYS 116          HD3       LYS 116  22.530   7.451 -35.876
  849   1HE   LYS 116          HE2       LYS 116  24.794   6.381 -36.463
  850   2HE   LYS 116          HE3       LYS 116  24.707   7.261 -37.996
  851   1HZ   LYS 116          HZ1       LYS 116  25.952   8.537 -36.384
  852   2HZ   LYS 116          HZ2       LYS 116  24.553   9.330 -36.642
  853   3HZ   LYS 116          HZ3       LYS 116  24.759   8.440 -35.270
  854    H    TRP 117           H        TRP 117  18.208   5.207 -38.735
  855    HA   TRP 117           HA       TRP 117  16.313   5.188 -36.648
  856   1HB   TRP 117          HB2       TRP 117  15.943   6.489 -38.612
  857   2HB   TRP 117          HB3       TRP 117  16.093   5.087 -39.663
  858    HD1  TRP 117           HD1      TRP 117  13.919   4.419 -40.664
  859    HE1  TRP 117           HE1      TRP 117  11.482   4.258 -39.962
  860    HE3  TRP 117           HE3      TRP 117  14.336   6.280 -35.899
  861    HZ2  TRP 117           HZ2      TRP 117   9.880   4.855 -37.604
  862    HZ3  TRP 117           HZ3      TRP 117  12.364   6.360 -34.427
  863    HH2  TRP 117           HH2      TRP 117  10.140   5.613 -35.250
  864    H    ALA 118           H        ALA 118  17.215   2.544 -38.929
  865    HA   ALA 118           HA       ALA 118  15.084   0.842 -38.059
  866   1HB   ALA 118          HB1       ALA 118  16.201   0.552 -40.215
  867   2HB   ALA 118          HB2       ALA 118  17.722   0.125 -39.387
  868   3HB   ALA 118          HB3       ALA 118  16.291  -0.922 -39.234
  869    H    PHE 119           H        PHE 119  18.487   1.242 -37.030
  870    HA   PHE 119           HA       PHE 119  18.326  -0.784 -35.017
  871   1HB   PHE 119          HB2       PHE 119  20.264   1.416 -35.628
  872   2HB   PHE 119          HB3       PHE 119  20.292   0.705 -34.021
  873    HD1  PHE 119           HD1      PHE 119  21.337   0.217 -37.441
  874    HD2  PHE 119           HD2      PHE 119  20.442  -1.842 -33.761
  875    HE1  PHE 119           HE1      PHE 119  22.619  -1.757 -38.233
  876    HE2  PHE 119           HE2      PHE 119  21.692  -3.827 -34.571
  877    HZ   PHE 119           HZ       PHE 119  22.787  -3.787 -36.805
  878    H    PHE 120           H        PHE 120  17.412   2.651 -34.982
  879    HA   PHE 120           HA       PHE 120  16.890   2.777 -32.184
  880   1HB   PHE 120          HB2       PHE 120  15.970   4.306 -34.589
  881   2HB   PHE 120          HB3       PHE 120  14.876   4.316 -33.228
  882    HD1  PHE 120           HD1      PHE 120  15.682   5.055 -30.953
  883    HD2  PHE 120           HD2      PHE 120  17.959   5.713 -34.553
  884    HE1  PHE 120           HE1      PHE 120  16.996   6.808 -29.809
  885    HE2  PHE 120           HE2      PHE 120  19.251   7.490 -33.410
  886    HZ   PHE 120           HZ       PHE 120  18.751   8.074 -31.049
  887    H    GLN 121           H        GLN 121  14.681   1.712 -34.852
  888    HA   GLN 121           HA       GLN 121  12.634   0.770 -33.134
  889   1HB   GLN 121          HB2       GLN 121  13.508   0.242 -35.947
  890   2HB   GLN 121          HB3       GLN 121  12.655  -1.100 -35.192
  891   1HG   GLN 121          HG2       GLN 121  11.214   0.504 -36.485
  892   2HG   GLN 121          HG3       GLN 121  10.701   0.137 -34.841
  893   1HE2  GLN 121          HE22      GLN 121  13.017   2.533 -36.360
  894   2HE2  GLN 121          HE21      GLN 121  12.260   3.913 -35.620
  895    H    ARG 122           H        ARG 122  15.537  -1.052 -34.286
  896    HA   ARG 122           HA       ARG 122  14.788  -3.469 -33.015
  897   1HB   ARG 122          HB2       ARG 122  17.575  -2.379 -33.612
  898   2HB   ARG 122          HB3       ARG 122  17.253  -4.037 -33.113
  899   1HG   ARG 122          HG2       ARG 122  16.033  -4.539 -35.117
  900   2HG   ARG 122          HG3       ARG 122  15.955  -2.846 -35.593
  901   1HD   ARG 122          HD2       ARG 122  18.495  -2.860 -35.729
  902   2HD   ARG 122          HD3       ARG 122  18.425  -4.615 -35.544
  903    HE   ARG 122           HE       ARG 122  16.889  -4.562 -37.579
  904   1HH1  ARG 122          HH21      ARG 122  19.594  -2.246 -37.221
  905   2HH1  ARG 122          HH22      ARG 122  19.611  -1.827 -38.904
  906   1HH2  ARG 122          HH11      ARG 122  17.034  -4.043 -39.824
  907   2HH2  ARG 122          HH12      ARG 122  18.212  -2.902 -40.370
  908    H    VAL 123           H        VAL 123  16.794  -0.764 -31.698
  909    HA   VAL 123           HA       VAL 123  17.147  -2.182 -29.186
  910    HB   VAL 123           HB       VAL 123  17.703   0.697 -30.045
  911   1HG1  VAL 123          HG11      VAL 123  19.213   0.758 -28.021
  912   2HG1  VAL 123          HG12      VAL 123  17.494   0.715 -27.638
  913   3HG1  VAL 123          HG13      VAL 123  18.474  -0.760 -27.477
  914   1HG2  VAL 123          HG21      VAL 123  20.058  -0.046 -30.123
  915   2HG2  VAL 123          HG22      VAL 123  19.579  -1.686 -29.642
  916   3HG2  VAL 123          HG23      VAL 123  19.088  -1.031 -31.216
  917    H    ARG 124           H        ARG 124  14.823   0.277 -30.410
  918    HA   ARG 124           HA       ARG 124  13.586   0.963 -27.947
  919   1HB   ARG 124          HB2       ARG 124  13.126   2.148 -30.052
  920   2HB   ARG 124          HB3       ARG 124  12.541   0.677 -30.799
  921   1HG   ARG 124          HG2       ARG 124  10.802   0.953 -28.642
  922   2HG   ARG 124          HG3       ARG 124  11.149   2.620 -29.079
  923   1HD   ARG 124          HD2       ARG 124   9.236   1.976 -30.333
  924   2HD   ARG 124          HD3       ARG 124  10.578   2.008 -31.484
  925    HE   ARG 124           HE       ARG 124  10.086  -0.624 -30.306
  926   1HH1  ARG 124          HH11      ARG 124   9.284   1.523 -33.023
  927   2HH1  ARG 124          HH12      ARG 124   8.282   0.358 -33.813
  928   1HH2  ARG 124          HH21      ARG 124   8.829  -2.252 -31.457
  929   2HH2  ARG 124          HH22      ARG 124   8.150  -1.829 -32.979
  930    H    ASP 125           H        ASP 125  12.779  -1.597 -30.352
  931    HA   ASP 125           HA       ASP 125  10.591  -2.540 -28.833
  932   1HB   ASP 125          HB2       ASP 125  11.163  -2.915 -31.338
  933   2HB   ASP 125          HB3       ASP 125  12.137  -4.284 -30.789
  934    H    GLU 126           H        GLU 126  14.004  -3.728 -29.021
  935    HA   GLU 126           HA       GLU 126  13.493  -5.900 -27.258
  936   1HB   GLU 126          HB2       GLU 126  16.050  -4.563 -28.179
  937   2HB   GLU 126          HB3       GLU 126  16.051  -5.939 -27.074
  938   1HG   GLU 126          HG2       GLU 126  14.736  -5.994 -29.828
  939   2HG   GLU 126          HG3       GLU 126  16.367  -6.555 -29.486
  940    H    ILE 127           H        ILE 127  14.513  -2.540 -26.586
  941    HA   ILE 127           HA       ILE 127  14.962  -2.931 -23.782
  942    HB   ILE 127           HB       ILE 127  14.149  -0.567 -25.509
  943   1HG1  ILE 127          HG12      ILE 127  16.569  -1.144 -23.746
  944   2HG1  ILE 127          HG13      ILE 127  16.529  -1.428 -25.478
  945   1HG2  ILE 127          HG21      ILE 127  12.994  -0.222 -23.323
  946   2HG2  ILE 127          HG22      ILE 127  14.553  -0.422 -22.493
  947   3HG2  ILE 127          HG23      ILE 127  14.276   0.932 -23.623
  948   1HD1  ILE 127          HD11      ILE 127  16.462   1.251 -24.046
  949   2HD1  ILE 127          HD12      ILE 127  17.665   0.630 -25.181
  950   3HD1  ILE 127          HD13      ILE 127  16.048   1.070 -25.768
  951    H    GLY 128           H        GLY 128  11.980  -2.011 -25.631
  952   1HA   GLY 128          HA1       GLY 128  10.179  -2.018 -23.506
  953   2HA   GLY 128          HA2       GLY 128   9.789  -2.482 -25.178
  954    H    ASN 129           H        ASN 129  11.220  -4.816 -25.522
  955    HA   ASN 129           HA       ASN 129   9.525  -6.682 -24.238
  956   1HB   ASN 129          HB2       ASN 129  12.127  -7.159 -25.749
  957   2HB   ASN 129          HB3       ASN 129  11.009  -8.430 -25.266
  958   1HD2  ASN 129          HD22      ASN 129  11.860  -7.526 -28.048
  959   2HD2  ASN 129          HD21      ASN 129  10.408  -6.909 -28.822
  960    H    ARG 130           H        ARG 130  12.866  -5.680 -23.421
  961    HA   ARG 130           HA       ARG 130  13.029  -7.801 -21.437
  962   1HB   ARG 130          HB2       ARG 130  15.002  -6.927 -22.693
  963   2HB   ARG 130          HB3       ARG 130  14.836  -5.380 -21.861
  964   1HG   ARG 130          HG2       ARG 130  16.596  -6.779 -20.863
  965   2HG   ARG 130          HG3       ARG 130  15.305  -6.453 -19.713
  966   1HD   ARG 130          HD2       ARG 130  14.353  -8.734 -20.125
  967   2HD   ARG 130          HD3       ARG 130  15.685  -9.050 -21.245
  968    HE   ARG 130           HE       ARG 130  17.125  -9.313 -19.468
  969   1HH1  ARG 130          HH11      ARG 130  14.109  -7.832 -18.242
  970   2HH1  ARG 130          HH12      ARG 130  14.458  -8.249 -16.577
  971   1HH2  ARG 130          HH21      ARG 130  17.611  -9.679 -17.248
  972   2HH2  ARG 130          HH22      ARG 130  16.454  -9.294 -16.012
  973    H    LEU 131           H        LEU 131  12.057  -4.386 -21.437
  974    HA   LEU 131           HA       LEU 131  11.947  -4.097 -18.571
  975   1HB   LEU 131          HB2       LEU 131  11.706  -2.350 -20.684
  976   2HB   LEU 131          HB3       LEU 131  10.029  -2.538 -20.217
  977    HG   LEU 131           HG       LEU 131  11.014  -0.654 -19.128
  978   1HD1  LEU 131          HD11      LEU 131  10.658  -2.837 -17.048
  979   2HD1  LEU 131          HD12      LEU 131  10.568  -1.099 -16.754
  980   3HD1  LEU 131          HD13      LEU 131   9.359  -1.896 -17.784
  981   1HD2  LEU 131          HD21      LEU 131  13.386  -1.445 -19.203
  982   2HD2  LEU 131          HD22      LEU 131  12.906  -0.660 -17.703
  983   3HD2  LEU 131          HD23      LEU 131  13.056  -2.414 -17.745
  984    H    LYS 132           H        LYS 132   9.615  -5.108 -21.095
  985    HA   LYS 132           HA       LYS 132   7.344  -5.537 -19.544
  986   1HB   LYS 132          HB2       LYS 132   7.411  -5.756 -21.980
  987   2HB   LYS 132          HB3       LYS 132   8.476  -7.143 -21.863
  988   1HG   LYS 132          HG2       LYS 132   6.703  -8.467 -20.778
  989   2HG   LYS 132          HG3       LYS 132   5.604  -7.070 -20.904
  990   1HD   LYS 132          HD2       LYS 132   5.862  -7.106 -23.396
  991   2HD   LYS 132          HD3       LYS 132   7.008  -8.435 -23.262
  992   1HE   LYS 132          HE2       LYS 132   4.917  -9.384 -23.906
  993   2HE   LYS 132          HE3       LYS 132   5.226  -9.865 -22.237
  994   1HZ   LYS 132          HZ1       LYS 132   2.938  -9.158 -22.578
  995   2HZ   LYS 132          HZ2       LYS 132   3.657  -8.141 -21.530
  996   3HZ   LYS 132          HZ3       LYS 132   3.400  -7.683 -23.083
  997    H    GLU 133           H        GLU 133  10.051  -7.840 -20.092
  998    HA   GLU 133           HA       GLU 133   9.009  -9.780 -18.315
  999   1HB   GLU 133          HB2       GLU 133  11.911  -9.317 -19.074
 1000   2HB   GLU 133          HB3       GLU 133  11.257 -10.743 -18.240
 1001   1HG   GLU 133          HG2       GLU 133   9.794 -11.237 -20.145
 1002   2HG   GLU 133          HG3       GLU 133  10.407  -9.834 -21.013
 1003    H    PHE 134           H        PHE 134  11.351  -7.127 -17.698
 1004    HA   PHE 134           HA       PHE 134  11.857  -7.804 -15.005
 1005   1HB   PHE 134          HB2       PHE 134  13.225  -6.213 -16.144
 1006   2HB   PHE 134          HB3       PHE 134  11.840  -5.165 -16.472
 1007    HD1  PHE 134           HD1      PHE 134  13.738  -6.612 -13.535
 1008    HD2  PHE 134           HD2      PHE 134  11.474  -3.299 -15.108
 1009    HE1  PHE 134           HE1      PHE 134  14.139  -5.335 -11.449
 1010    HE2  PHE 134           HE2      PHE 134  11.876  -2.024 -13.039
 1011    HZ   PHE 134           HZ       PHE 134  13.211  -3.043 -11.189
 1012    H    ALA 135           H        ALA 135   9.093  -6.110 -16.387
 1013    HA   ALA 135           HA       ALA 135   8.068  -5.354 -13.771
 1014   1HB   ALA 135          HB1       ALA 135   6.746  -5.298 -16.528
 1015   2HB   ALA 135          HB2       ALA 135   6.162  -4.468 -15.069
 1016   3HB   ALA 135          HB3       ALA 135   7.693  -3.971 -15.826
 1017    H    GLU 136           H        GLU 136   7.446  -7.888 -16.180
 1018    HA   GLU 136           HA       GLU 136   5.028  -8.794 -14.853
 1019   1HB   GLU 136          HB2       GLU 136   5.168  -8.651 -17.301
 1020   2HB   GLU 136          HB3       GLU 136   6.548  -9.745 -17.310
 1021   1HG   GLU 136          HG2       GLU 136   4.652 -10.993 -18.001
 1022   2HG   GLU 136          HG3       GLU 136   5.106 -11.576 -16.412
 1023    H    THR 137           H        THR 137   8.227 -10.164 -15.642
 1024    HA   THR 137           HA       THR 137   7.637 -12.586 -14.081
 1025    HB   THR 137           HB       THR 137   9.242 -13.670 -15.448
 1026    HG1  THR 137           HG1      THR 137  10.403 -12.550 -17.004
 1027   1HG2  THR 137          HG21      THR 137   6.981 -13.222 -16.502
 1028   2HG2  THR 137          HG22      THR 137   7.722 -11.834 -17.344
 1029   3HG2  THR 137          HG23      THR 137   8.305 -13.478 -17.654
 1030    H    GLY 138           H        GLY 138   9.558  -9.686 -14.025
 1031   1HA   GLY 138          HA1       GLY 138  10.899  -8.868 -12.333
 1032   2HA   GLY 138          HA2       GLY 138  10.727 -10.384 -11.442
 1033    H    LYS 139           H        LYS 139  11.758 -10.607 -14.839
 1034    HA   LYS 139           HA       LYS 139  14.266 -11.799 -14.092
 1035   1HB   LYS 139          HB2       LYS 139  12.990 -10.901 -16.700
 1036   2HB   LYS 139          HB3       LYS 139  14.671 -11.457 -16.624
 1037   1HG   LYS 139          HG2       LYS 139  14.002 -13.610 -15.706
 1038   2HG   LYS 139          HG3       LYS 139  12.318 -13.097 -15.590
 1039   1HD   LYS 139          HD2       LYS 139  12.727 -14.598 -17.511
 1040   2HD   LYS 139          HD3       LYS 139  12.114 -13.017 -18.019
 1041   1HE   LYS 139          HE2       LYS 139  14.357 -12.274 -18.610
 1042   2HE   LYS 139          HE3       LYS 139  15.059 -13.792 -18.021
 1043   1HZ   LYS 139          HZ1       LYS 139  14.774 -13.788 -20.437
 1044   2HZ   LYS 139          HZ2       LYS 139  13.845 -14.953 -19.772
 1045   3HZ   LYS 139          HZ3       LYS 139  13.157 -13.550 -20.290
  Start of MODEL    7
    1   1H    MET   1           H1       MET   1   7.136  -1.222   3.927
    2   2H    MET   1           H2       MET   1   7.968   0.190   4.005
    3   3H    MET   1           H3       MET   1   6.334   0.211   4.037
    4    HA   MET   1           HA       MET   1   8.000  -0.653   1.794
    5   1HB   MET   1          HB2       MET   1   6.066  -0.938   0.465
    6   2HB   MET   1          HB3       MET   1   5.806  -1.857   1.935
    7   1HG   MET   1          HG2       MET   1   4.590   0.864   1.283
    8   2HG   MET   1          HG3       MET   1   3.792  -0.691   1.130
    9   1HE   MET   1          HE1       MET   1   1.709   0.242   2.423
   10   2HE   MET   1          HE2       MET   1   1.800   1.020   4.018
   11   3HE   MET   1          HE3       MET   1   2.526   1.813   2.604
   12    H    GLU   2           H        GLU   2   7.698   0.790  -0.184
   13    HA   GLU   2           HA       GLU   2   6.913   3.541   0.277
   14   1HB   GLU   2          HB2       GLU   2   9.057   4.513  -0.293
   15   2HB   GLU   2          HB3       GLU   2   9.196   3.606   1.197
   16   1HG   GLU   2          HG2       GLU   2  10.077   2.567  -1.536
   17   2HG   GLU   2          HG3       GLU   2  11.132   3.405  -0.409
   18    H    ASN   3           H        ASN   3   7.326   4.765  -1.909
   19    HA   ASN   3           HA       ASN   3   6.462   3.132  -4.165
   20   1HB   ASN   3          HB2       ASN   3   5.925   5.650  -3.649
   21   2HB   ASN   3          HB3       ASN   3   7.555   5.977  -4.257
   22   1HD2  ASN   3          HD22      ASN   3   8.001   5.378  -6.583
   23   2HD2  ASN   3          HD21      ASN   3   6.590   5.409  -7.658
   24    H    LYS   4           H        LYS   4   7.909   2.400  -5.794
   25    HA   LYS   4           HA       LYS   4  10.754   2.243  -5.049
   26   1HB   LYS   4          HB2       LYS   4   9.015   1.160  -7.297
   27   2HB   LYS   4          HB3       LYS   4  10.746   1.247  -7.531
   28   1HG   LYS   4          HG2       LYS   4  10.113  -0.952  -6.846
   29   2HG   LYS   4          HG3       LYS   4  11.175  -0.223  -5.660
   30   1HD   LYS   4          HD2       LYS   4   8.173  -0.153  -5.273
   31   2HD   LYS   4          HD3       LYS   4   9.054  -1.636  -4.947
   32   1HE   LYS   4          HE2       LYS   4   9.735   1.025  -3.623
   33   2HE   LYS   4          HE3       LYS   4   8.614  -0.152  -2.956
   34   1HZ   LYS   4          HZ1       LYS   4  10.727  -0.426  -1.981
   35   2HZ   LYS   4          HZ2       LYS   4  10.422  -1.760  -2.874
   36   3HZ   LYS   4          HZ3       LYS   4  11.512  -0.653  -3.415
   37    H    ILE   5           H        ILE   5  12.354   2.724  -6.775
   38    HA   ILE   5           HA       ILE   5  11.854   5.117  -8.377
   39    HB   ILE   5           HB       ILE   5  14.156   4.871  -6.399
   40   1HG1  ILE   5          HG12      ILE   5  13.049   7.198  -5.596
   41   2HG1  ILE   5          HG13      ILE   5  11.584   6.345  -6.053
   42   1HG2  ILE   5          HG21      ILE   5  13.425   7.145  -8.279
   43   2HG2  ILE   5          HG22      ILE   5  14.760   7.168  -7.107
   44   3HG2  ILE   5          HG23      ILE   5  14.803   6.048  -8.464
   45   1HD1  ILE   5          HD11      ILE   5  12.293   4.456  -4.517
   46   2HD1  ILE   5          HD12      ILE   5  13.731   5.396  -4.103
   47   3HD1  ILE   5          HD13      ILE   5  12.120   6.008  -3.676
   48    H    ILE   6           H        ILE   6  13.208   4.912 -10.283
   49    HA   ILE   6           HA       ILE   6  15.208   2.757 -10.278
   50    HB   ILE   6           HB       ILE   6  13.172   1.601 -10.932
   51   1HG1  ILE   6          HG12      ILE   6  14.971   1.952 -13.370
   52   2HG1  ILE   6          HG13      ILE   6  15.411   1.024 -11.931
   53   1HG2  ILE   6          HG21      ILE   6  11.892   3.510 -11.882
   54   2HG2  ILE   6          HG22      ILE   6  12.985   3.521 -13.293
   55   3HG2  ILE   6          HG23      ILE   6  11.926   2.138 -12.977
   56   1HD1  ILE   6          HD11      ILE   6  13.110   0.418 -13.816
   57   2HD1  ILE   6          HD12      ILE   6  14.620  -0.483 -13.627
   58   3HD1  ILE   6          HD13      ILE   6  13.447  -0.447 -12.293
   59    H    TYR   7           H        TYR   7  16.798   3.003 -11.922
   60    HA   TYR   7           HA       TYR   7  16.739   5.615 -13.312
   61   1HB   TYR   7          HB2       TYR   7  17.948   5.372 -10.942
   62   2HB   TYR   7          HB3       TYR   7  19.208   4.615 -11.885
   63    HD1  TYR   7           HD1      TYR   7  17.603   7.433 -13.657
   64    HD2  TYR   7           HD2      TYR   7  20.512   6.365 -10.653
   65    HE1  TYR   7           HE1      TYR   7  18.415   9.744 -13.637
   66    HE2  TYR   7           HE2      TYR   7  21.343   8.701 -10.649
   67    HH   TYR   7           HH       TYR   7  19.796  11.288 -12.578
   68    H    PHE   8           H        PHE   8  17.567   5.511 -15.339
   69    HA   PHE   8           HA       PHE   8  18.987   3.017 -16.221
   70   1HB   PHE   8          HB2       PHE   8  17.272   4.917 -17.869
   71   2HB   PHE   8          HB3       PHE   8  18.123   3.513 -18.476
   72    HD1  PHE   8           HD1      PHE   8  17.390   1.181 -17.766
   73    HD2  PHE   8           HD2      PHE   8  15.115   4.717 -16.817
   74    HE1  PHE   8           HE1      PHE   8  15.449  -0.233 -17.151
   75    HE2  PHE   8           HE2      PHE   8  13.184   3.288 -16.223
   76    HZ   PHE   8           HZ       PHE   8  13.370   0.822 -16.300
   77    H    LEU   9           H        LEU   9  21.090   3.349 -16.677
   78    HA   LEU   9           HA       LEU   9  22.071   6.144 -17.002
   79   1HB   LEU   9          HB2       LEU   9  22.957   3.780 -15.390
   80   2HB   LEU   9          HB3       LEU   9  24.216   4.717 -16.170
   81    HG   LEU   9           HG       LEU   9  23.587   6.739 -15.076
   82   1HD1  LEU   9          HD11      LEU   9  21.259   5.230 -13.830
   83   2HD1  LEU   9          HD12      LEU   9  21.833   6.840 -13.334
   84   3HD1  LEU   9          HD13      LEU   9  21.162   6.618 -14.941
   85   1HD2  LEU   9          HD21      LEU   9  24.044   6.120 -12.728
   86   2HD2  LEU   9          HD22      LEU   9  23.639   4.432 -13.107
   87   3HD2  LEU   9          HD23      LEU   9  25.057   5.193 -13.842
   88    H    CYS  10           H        CYS  10  23.557   6.617 -18.557
   89    HA   CYS  10           HA       CYS  10  24.657   4.478 -20.289
   90   1HB   CYS  10          HB2       CYS  10  23.629   5.555 -22.293
   91   2HB   CYS  10          HB3       CYS  10  22.388   4.993 -21.160
   92    HG   CYS  10           HG       CYS  10  22.121   7.317 -19.883
   93    H    THR  11           H        THR  11  25.793   5.774 -22.269
   94    HA   THR  11           HA       THR  11  27.697   7.592 -21.073
   95    HB   THR  11           HB       THR  11  28.750   7.233 -23.413
   96    HG1  THR  11           HG1      THR  11  27.775   5.089 -24.208
   97   1HG2  THR  11          HG21      THR  11  28.133   4.771 -21.707
   98   2HG2  THR  11          HG22      THR  11  29.470   4.966 -22.855
   99   3HG2  THR  11          HG23      THR  11  29.413   5.966 -21.381
  100    H    GLY  12           H        GLY  12  24.660   8.144 -22.399
  101   1HA   GLY  12          HA1       GLY  12  25.011  10.938 -22.510
  102   2HA   GLY  12          HA2       GLY  12  25.003  10.321 -24.172
  103    H    ASN  13           H        ASN  13  23.046  11.415 -21.696
  104    HA   ASN  13           HA       ASN  13  20.924   9.526 -21.739
  105   1HB   ASN  13          HB2       ASN  13  21.505  11.049 -19.823
  106   2HB   ASN  13          HB3       ASN  13  20.773  12.382 -20.740
  107   1HD2  ASN  13          HD22      ASN  13  19.304   9.026 -20.718
  108   2HD2  ASN  13          HD21      ASN  13  17.950   9.525 -19.727
  109    H    SER  14           H        SER  14  21.064   9.897 -24.383
  110    HA   SER  14           HA       SER  14  18.844  11.784 -25.069
  111   1HB   SER  14          HB2       SER  14  21.371  11.100 -26.605
  112   2HB   SER  14          HB3       SER  14  20.074  12.171 -27.175
  113    HG   SER  14           HG       SER  14  20.474  13.569 -25.572
  114    H    CYS  15           H        CYS  15  19.935   8.477 -25.371
  115    HA   CYS  15           HA       CYS  15  17.858   8.013 -27.476
  116   1HB   CYS  15          HB2       CYS  15  20.655   6.801 -27.289
  117   2HB   CYS  15          HB3       CYS  15  19.433   6.431 -28.520
  118    HG   CYS  15           HG       CYS  15  21.491   7.878 -29.314
  119    H    ARG  16           H        ARG  16  19.744   5.367 -26.435
  120    HA   ARG  16           HA       ARG  16  17.624   3.726 -25.849
  121   1HB   ARG  16          HB2       ARG  16  19.294   2.189 -24.976
  122   2HB   ARG  16          HB3       ARG  16  19.910   3.045 -26.384
  123   1HG   ARG  16          HG2       ARG  16  20.949   4.679 -24.539
  124   2HG   ARG  16          HG3       ARG  16  20.723   3.313 -23.479
  125   1HD   ARG  16          HD2       ARG  16  22.604   2.363 -24.243
  126   2HD   ARG  16          HD3       ARG  16  22.003   2.357 -25.903
  127    HE   ARG  16           HE       ARG  16  22.741   4.786 -26.005
  128   1HH1  ARG  16          HH11      ARG  16  24.592   2.492 -23.961
  129   2HH1  ARG  16          HH12      ARG  16  26.046   3.453 -24.175
  130   1HH2  ARG  16          HH21      ARG  16  24.393   6.047 -25.907
  131   2HH2  ARG  16          HH22      ARG  16  25.820   5.693 -24.933
  132    H    SER  17           H        SER  17  19.314   5.784 -23.466
  133    HA   SER  17           HA       SER  17  18.121   4.601 -21.131
  134   1HB   SER  17          HB2       SER  17  18.934   6.824 -20.151
  135   2HB   SER  17          HB3       SER  17  20.148   5.803 -20.918
  136    HG   SER  17           HG       SER  17  20.520   7.366 -22.278
  137    H    GLN  18           H        GLN  18  17.333   7.456 -23.127
  138    HA   GLN  18           HA       GLN  18  15.051   8.306 -21.650
  139   1HB   GLN  18          HB2       GLN  18  15.895   8.673 -24.566
  140   2HB   GLN  18          HB3       GLN  18  14.476   9.434 -23.880
  141   1HG   GLN  18          HG2       GLN  18  17.250   9.812 -22.674
  142   2HG   GLN  18          HG3       GLN  18  16.629  10.832 -23.965
  143   1HE2  GLN  18          HE22      GLN  18  17.122  11.151 -20.789
  144   2HE2  GLN  18          HE21      GLN  18  15.674  12.045 -20.369
  145    H    MET  19           H        MET  19  15.365   6.206 -24.521
  146    HA   MET  19           HA       MET  19  12.619   5.570 -24.803
  147   1HB   MET  19          HB2       MET  19  15.024   3.818 -25.482
  148   2HB   MET  19          HB3       MET  19  13.367   3.562 -26.030
  149   1HG   MET  19          HG2       MET  19  13.500   5.972 -26.982
  150   2HG   MET  19          HG3       MET  19  15.244   5.825 -26.773
  151   1HE   MET  19          HE1       MET  19  16.101   2.900 -29.289
  152   2HE   MET  19          HE2       MET  19  16.771   4.041 -28.101
  153   3HE   MET  19          HE3       MET  19  15.723   2.699 -27.567
  154    H    ALA  20           H        ALA  20  15.134   3.868 -22.826
  155    HA   ALA  20           HA       ALA  20  13.434   1.810 -21.879
  156   1HB   ALA  20          HB1       ALA  20  15.814   3.111 -20.471
  157   2HB   ALA  20          HB2       ALA  20  15.107   1.527 -20.101
  158   3HB   ALA  20          HB3       ALA  20  15.914   1.792 -21.659
  159    H    GLU  21           H        GLU  21  14.163   4.996 -20.426
  160    HA   GLU  21           HA       GLU  21  12.463   4.772 -18.208
  161   1HB   GLU  21          HB2       GLU  21  14.140   6.576 -18.735
  162   2HB   GLU  21          HB3       GLU  21  12.945   7.297 -19.825
  163   1HG   GLU  21          HG2       GLU  21  11.379   7.348 -17.770
  164   2HG   GLU  21          HG3       GLU  21  12.801   6.919 -16.821
  165    H    GLY  22           H        GLY  22  11.616   5.774 -21.592
  166   1HA   GLY  22          HA1       GLY  22   8.916   6.444 -21.179
  167   2HA   GLY  22          HA2       GLY  22   9.635   5.799 -22.682
  168    H    TRP  23           H        TRP  23  10.333   3.264 -22.150
  169    HA   TRP  23           HA       TRP  23   7.844   1.842 -22.151
  170   1HB   TRP  23          HB2       TRP  23  10.724   0.941 -21.724
  171   2HB   TRP  23          HB3       TRP  23   9.365  -0.171 -21.754
  172    HD1  TRP  23           HD1      TRP  23  11.757   1.487 -24.028
  173    HE1  TRP  23           HE1      TRP  23  11.206   0.985 -26.454
  174    HE3  TRP  23           HE3      TRP  23   7.072  -0.460 -23.381
  175    HZ2  TRP  23           HZ2      TRP  23   8.941  -0.101 -27.978
  176    HZ3  TRP  23           HZ3      TRP  23   5.808  -1.355 -25.312
  177    HH2  TRP  23           HH2      TRP  23   6.757  -1.225 -27.601
  178    H    ALA  24           H        ALA  24  10.290   2.388 -19.594
  179    HA   ALA  24           HA       ALA  24   9.140   0.619 -17.737
  180   1HB   ALA  24          HB1       ALA  24  11.449   1.371 -17.606
  181   2HB   ALA  24          HB2       ALA  24  10.934   3.035 -17.354
  182   3HB   ALA  24          HB3       ALA  24  10.620   1.800 -16.107
  183    H    LYS  25           H        LYS  25   8.569   4.187 -18.116
  184    HA   LYS  25           HA       LYS  25   6.796   4.384 -15.920
  185   1HB   LYS  25          HB2       LYS  25   6.607   5.831 -18.584
  186   2HB   LYS  25          HB3       LYS  25   5.679   6.242 -17.130
  187   1HG   LYS  25          HG2       LYS  25   7.725   6.823 -15.918
  188   2HG   LYS  25          HG3       LYS  25   8.712   6.351 -17.305
  189   1HD   LYS  25          HD2       LYS  25   7.246   8.079 -18.635
  190   2HD   LYS  25          HD3       LYS  25   6.836   8.728 -17.048
  191   1HE   LYS  25          HE2       LYS  25   9.649   8.355 -18.182
  192   2HE   LYS  25          HE3       LYS  25   8.754   9.861 -18.252
  193   1HZ   LYS  25          HZ1       LYS  25  10.411   9.683 -16.452
  194   2HZ   LYS  25          HZ2       LYS  25   8.905  10.092 -15.909
  195   3HZ   LYS  25          HZ3       LYS  25   9.495   8.574 -15.689
  196    H    GLN  26           H        GLN  26   6.171   3.047 -19.164
  197    HA   GLN  26           HA       GLN  26   3.333   2.920 -18.749
  198   1HB   GLN  26          HB2       GLN  26   4.800   1.049 -20.626
  199   2HB   GLN  26          HB3       GLN  26   3.135   1.595 -20.682
  200   1HG   GLN  26          HG2       GLN  26   5.643   3.017 -21.487
  201   2HG   GLN  26          HG3       GLN  26   4.189   2.716 -22.415
  202   1HE2  GLN  26          HE22      GLN  26   5.917   5.136 -20.955
  203   2HE2  GLN  26          HE21      GLN  26   4.624   6.296 -20.683
  204    H    TYR  27           H        TYR  27   5.837   0.354 -18.681
  205    HA   TYR  27           HA       TYR  27   3.937  -1.642 -17.871
  206   1HB   TYR  27          HB2       TYR  27   6.979  -1.669 -17.767
  207   2HB   TYR  27          HB3       TYR  27   5.950  -3.057 -17.470
  208    HD1  TYR  27           HD1      TYR  27   4.134  -3.563 -19.405
  209    HD2  TYR  27           HD2      TYR  27   7.894  -1.524 -19.909
  210    HE1  TYR  27           HE1      TYR  27   4.183  -4.254 -21.782
  211    HE2  TYR  27           HE2      TYR  27   8.028  -2.327 -22.249
  212    HH   TYR  27           HH       TYR  27   6.920  -3.456 -23.965
  213    H    LEU  28           H        LEU  28   6.472   0.146 -16.044
  214    HA   LEU  28           HA       LEU  28   6.004  -1.306 -13.582
  215   1HB   LEU  28          HB2       LEU  28   7.313   1.417 -14.034
  216   2HB   LEU  28          HB3       LEU  28   7.425   0.451 -12.606
  217    HG   LEU  28           HG       LEU  28   8.579  -0.343 -15.293
  218   1HD1  LEU  28          HD11      LEU  28   9.695   1.555 -14.090
  219   2HD1  LEU  28          HD12      LEU  28   9.955   0.483 -12.702
  220   3HD1  LEU  28          HD13      LEU  28  10.725   0.116 -14.263
  221   1HD2  LEU  28          HD21      LEU  28   7.903  -2.340 -13.976
  222   2HD2  LEU  28          HD22      LEU  28   9.650  -2.190 -14.089
  223   3HD2  LEU  28          HD23      LEU  28   8.821  -1.729 -12.586
  224    H    GLY  29           H        GLY  29   4.939   1.811 -14.864
  225   1HA   GLY  29          HA1       GLY  29   3.070   3.085 -14.317
  226   2HA   GLY  29          HA2       GLY  29   2.778   2.082 -12.881
  227    H    ASP  30           H        ASP  30   2.771   4.706 -12.452
  228    HA   ASP  30           HA       ASP  30   5.275   5.877 -11.737
  229   1HB   ASP  30          HB2       ASP  30   3.206   7.162 -12.198
  230   2HB   ASP  30          HB3       ASP  30   2.461   6.485 -10.747
  231    H    GLU  31           H        GLU  31   3.864   3.182 -10.487
  232    HA   GLU  31           HA       GLU  31   4.226   3.392  -7.643
  233   1HB   GLU  31          HB2       GLU  31   4.302   1.043  -9.570
  234   2HB   GLU  31          HB3       GLU  31   4.430   0.861  -7.823
  235   1HG   GLU  31          HG2       GLU  31   2.078   2.135  -9.264
  236   2HG   GLU  31          HG3       GLU  31   2.159   0.449  -8.749
  237    H    TRP  32           H        TRP  32   6.369   3.481 -10.277
  238    HA   TRP  32           HA       TRP  32   8.728   3.176  -8.541
  239   1HB   TRP  32          HB2       TRP  32   8.538   2.404 -11.479
  240   2HB   TRP  32          HB3       TRP  32   9.950   2.272 -10.446
  241    HD1  TRP  32           HD1      TRP  32   6.334   0.843 -10.450
  242    HE1  TRP  32           HE1      TRP  32   6.399  -1.648  -9.902
  243    HE3  TRP  32           HE3      TRP  32  11.393   0.290  -9.816
  244    HZ2  TRP  32           HZ2      TRP  32   8.378  -3.651  -9.379
  245    HZ3  TRP  32           HZ3      TRP  32  12.341  -1.942  -9.323
  246    HH2  TRP  32           HH2      TRP  32  10.852  -3.934  -9.149
  247    H    LYS  33           H        LYS  33   9.568   5.247  -8.440
  248    HA   LYS  33           HA       LYS  33   8.835   7.339 -10.284
  249   1HB   LYS  33          HB2       LYS  33  10.989   7.162  -8.123
  250   2HB   LYS  33          HB3       LYS  33  10.569   8.633  -9.009
  251   1HG   LYS  33          HG2       LYS  33   8.958   7.138  -6.942
  252   2HG   LYS  33          HG3       LYS  33   9.557   8.779  -6.873
  253   1HD   LYS  33          HD2       LYS  33   7.286   7.768  -8.641
  254   2HD   LYS  33          HD3       LYS  33   7.139   8.740  -7.177
  255   1HE   LYS  33          HE2       LYS  33   8.383  10.598  -8.262
  256   2HE   LYS  33          HE3       LYS  33   8.536   9.637  -9.738
  257   1HZ   LYS  33          HZ1       LYS  33   6.098   9.609  -9.887
  258   2HZ   LYS  33          HZ2       LYS  33   5.988  10.567  -8.559
  259   3HZ   LYS  33          HZ3       LYS  33   6.685  11.142  -9.916
  260    H    VAL  34           H        VAL  34   9.413   6.777 -12.351
  261    HA   VAL  34           HA       VAL  34  11.938   5.528 -12.895
  262    HB   VAL  34           HB       VAL  34  10.038   6.623 -14.984
  263   1HG1  VAL  34          HG11      VAL  34  12.308   5.364 -15.425
  264   2HG1  VAL  34          HG12      VAL  34  11.377   3.925 -15.001
  265   3HG1  VAL  34          HG13      VAL  34  10.854   4.962 -16.353
  266   1HG2  VAL  34          HG21      VAL  34   9.536   4.131 -13.316
  267   2HG2  VAL  34          HG22      VAL  34   8.437   5.502 -13.609
  268   3HG2  VAL  34          HG23      VAL  34   8.829   4.394 -14.920
  269    H    TYR  35           H        TYR  35  13.794   6.502 -13.588
  270    HA   TYR  35           HA       TYR  35  13.724   9.190 -14.850
  271   1HB   TYR  35          HB2       TYR  35  15.590   8.347 -12.593
  272   2HB   TYR  35          HB3       TYR  35  15.672   9.861 -13.476
  273    HD1  TYR  35           HD1      TYR  35  14.228   8.131 -10.656
  274    HD2  TYR  35           HD2      TYR  35  13.731  11.532 -13.267
  275    HE1  TYR  35           HE1      TYR  35  12.815   9.235  -8.949
  276    HE2  TYR  35           HE2      TYR  35  12.278  12.622 -11.586
  277    HH   TYR  35           HH       TYR  35  11.302  12.452  -9.472
  278    H    SER  36           H        SER  36  15.910   9.622 -15.942
  279    HA   SER  36           HA       SER  36  17.700   7.337 -16.165
  280   1HB   SER  36          HB2       SER  36  17.794   7.389 -18.574
  281   2HB   SER  36          HB3       SER  36  16.168   6.971 -18.047
  282    HG   SER  36           HG       SER  36  15.464   9.018 -18.552
  283    H    ALA  37           H        ALA  37  19.799   8.001 -17.135
  284    HA   ALA  37           HA       ALA  37  20.454  10.791 -17.387
  285   1HB   ALA  37          HB1       ALA  37  20.191  10.710 -14.929
  286   2HB   ALA  37          HB2       ALA  37  21.319   9.333 -14.843
  287   3HB   ALA  37          HB3       ALA  37  21.866  10.944 -15.368
  288    H    GLY  38           H        GLY  38  23.123  10.763 -16.928
  289   1HA   GLY  38          HA1       GLY  38  24.562   8.401 -17.456
  290   2HA   GLY  38          HA2       GLY  38  24.309   9.259 -18.994
  291    H    ILE  39           H        ILE  39  26.773   9.189 -18.636
  292    HA   ILE  39           HA       ILE  39  28.097  10.993 -16.921
  293    HB   ILE  39           HB       ILE  39  28.607   9.590 -19.558
  294   1HG1  ILE  39          HG12      ILE  39  30.059   9.544 -16.873
  295   2HG1  ILE  39          HG13      ILE  39  28.752   8.458 -17.334
  296   1HG2  ILE  39          HG21      ILE  39  30.589  11.572 -18.403
  297   2HG2  ILE  39          HG22      ILE  39  30.894  10.425 -19.732
  298   3HG2  ILE  39          HG23      ILE  39  29.722  11.703 -19.957
  299   1HD1  ILE  39          HD11      ILE  39  31.480   8.582 -18.661
  300   2HD1  ILE  39          HD12      ILE  39  30.866   7.325 -17.593
  301   3HD1  ILE  39          HD13      ILE  39  30.115   7.556 -19.186
  302    H    GLU  40           H        GLU  40  26.133  11.588 -19.792
  303    HA   GLU  40           HA       GLU  40  26.370  14.413 -19.365
  304   1HB   GLU  40          HB2       GLU  40  26.905  14.978 -21.693
  305   2HB   GLU  40          HB3       GLU  40  28.232  14.167 -20.869
  306   1HG   GLU  40          HG2       GLU  40  27.645  12.027 -21.972
  307   2HG   GLU  40          HG3       GLU  40  26.273  12.802 -22.772
  308    H    ALA  41           H        ALA  41  24.760  15.579 -20.816
  309    HA   ALA  41           HA       ALA  41  22.661  13.940 -22.039
  310   1HB   ALA  41          HB1       ALA  41  21.901  14.169 -19.700
  311   2HB   ALA  41          HB2       ALA  41  22.183  15.923 -19.750
  312   3HB   ALA  41          HB3       ALA  41  20.913  15.204 -20.757
  313    H    HIS  42           H        HIS  42  21.808  15.068 -23.779
  314    HA   HIS  42           HA       HIS  42  22.385  17.978 -24.094
  315   1HB   HIS  42          HB2       HIS  42  22.828  15.730 -26.106
  316   2HB   HIS  42          HB3       HIS  42  22.745  17.424 -26.559
  317    HD1  HIS  42           HD1      HIS  42  24.698  17.527 -23.483
  318    HD2  HIS  42           HD2      HIS  42  25.296  16.463 -27.511
  319    HE1  HIS  42           HE1      HIS  42  27.207  17.718 -23.912
  320    H    GLY  43           H        GLY  43  19.976  16.139 -23.338
  321   1HA   GLY  43          HA1       GLY  43  17.662  16.458 -23.663
  322   2HA   GLY  43          HA2       GLY  43  17.966  17.332 -25.170
  323    H    LEU  44           H        LEU  44  16.073  15.383 -25.258
  324    HA   LEU  44           HA       LEU  44  17.296  12.825 -25.913
  325   1HB   LEU  44          HB2       LEU  44  15.212  11.864 -25.870
  326   2HB   LEU  44          HB3       LEU  44  15.263  12.994 -24.522
  327    HG   LEU  44           HG       LEU  44  13.783  13.315 -27.164
  328   1HD1  LEU  44          HD11      LEU  44  12.934  11.698 -25.404
  329   2HD1  LEU  44          HD12      LEU  44  12.730  13.066 -24.303
  330   3HD1  LEU  44          HD13      LEU  44  11.809  12.993 -25.824
  331   1HD2  LEU  44          HD21      LEU  44  14.393  15.584 -26.460
  332   2HD2  LEU  44          HD22      LEU  44  12.686  15.311 -26.131
  333   3HD2  LEU  44          HD23      LEU  44  13.850  15.245 -24.793
  334    H    ASN  45           H        ASN  45  17.019  11.661 -27.811
  335    HA   ASN  45           HA       ASN  45  17.675  13.263 -30.117
  336   1HB   ASN  45          HB2       ASN  45  18.790  11.136 -29.361
  337   2HB   ASN  45          HB3       ASN  45  17.335  10.243 -29.773
  338   1HD2  ASN  45          HD22      ASN  45  20.346  11.117 -30.895
  339   2HD2  ASN  45          HD21      ASN  45  20.072  10.953 -32.612
  340    HA   PRO  46           HA       PRO  46  13.505  13.306 -31.717
  341   1HB   PRO  46          HB2       PRO  46  13.906  13.689 -34.429
  342   2HB   PRO  46          HB3       PRO  46  14.045  14.966 -33.185
  343   1HG   PRO  46          HG2       PRO  46  16.264  13.302 -34.405
  344   2HG   PRO  46          HG3       PRO  46  16.218  15.079 -34.157
  345   1HD   PRO  46          HD2       PRO  46  17.507  13.456 -32.421
  346   2HD   PRO  46          HD3       PRO  46  16.554  14.845 -31.818
  347    H    ASN  47           H        ASN  47  15.880  10.981 -33.040
  348    HA   ASN  47           HA       ASN  47  13.861   9.356 -34.388
  349   1HB   ASN  47          HB2       ASN  47  16.603   8.579 -33.373
  350   2HB   ASN  47          HB3       ASN  47  15.596   7.626 -34.449
  351   1HD2  ASN  47          HD22      ASN  47  17.995  10.038 -34.238
  352   2HD2  ASN  47          HD21      ASN  47  18.123  10.395 -35.955
  353    H    ALA  48           H        ALA  48  15.314   9.587 -31.146
  354    HA   ALA  48           HA       ALA  48  14.249   7.121 -30.144
  355   1HB   ALA  48          HB1       ALA  48  14.771   8.003 -27.937
  356   2HB   ALA  48          HB2       ALA  48  16.110   8.393 -29.029
  357   3HB   ALA  48          HB3       ALA  48  14.949   9.644 -28.561
  358    H    VAL  49           H        VAL  49  13.099  10.546 -30.153
  359    HA   VAL  49           HA       VAL  49  10.620  10.062 -28.890
  360    HB   VAL  49           HB       VAL  49  11.297  12.133 -31.024
  361   1HG1  VAL  49          HG11      VAL  49   8.848  11.902 -30.844
  362   2HG1  VAL  49          HG12      VAL  49   8.958  12.007 -29.070
  363   3HG1  VAL  49          HG13      VAL  49   9.376  13.405 -30.082
  364   1HG2  VAL  49          HG21      VAL  49  12.705  12.308 -28.984
  365   2HG2  VAL  49          HG22      VAL  49  11.577  13.658 -29.108
  366   3HG2  VAL  49          HG23      VAL  49  11.239  12.327 -27.985
  367    H    LYS  50           H        LYS  50  11.394   9.973 -32.462
  368    HA   LYS  50           HA       LYS  50   8.823   9.096 -33.264
  369   1HB   LYS  50          HB2       LYS  50  11.583   8.556 -34.454
  370   2HB   LYS  50          HB3       LYS  50  10.107   7.887 -35.126
  371   1HG   LYS  50          HG2       LYS  50   9.198  10.251 -35.346
  372   2HG   LYS  50          HG3       LYS  50  10.810  10.828 -34.899
  373   1HD   LYS  50          HD2       LYS  50  10.689  10.805 -37.319
  374   2HD   LYS  50          HD3       LYS  50  11.775   9.520 -36.809
  375   1HE   LYS  50          HE2       LYS  50  10.456   8.595 -38.552
  376   2HE   LYS  50          HE3       LYS  50   9.840   7.866 -37.072
  377   1HZ   LYS  50          HZ1       LYS  50   7.998   9.470 -37.147
  378   2HZ   LYS  50          HZ2       LYS  50   8.594  10.141 -38.516
  379   3HZ   LYS  50          HZ3       LYS  50   8.061   8.605 -38.527
  380    H    ALA  51           H        ALA  51  11.629   7.114 -32.202
  381    HA   ALA  51           HA       ALA  51  10.527   4.617 -32.832
  382   1HB   ALA  51          HB1       ALA  51  12.899   5.044 -32.209
  383   2HB   ALA  51          HB2       ALA  51  12.405   5.349 -30.534
  384   3HB   ALA  51          HB3       ALA  51  12.202   3.737 -31.240
  385    H    MET  52           H        MET  52  10.269   6.539 -29.800
  386    HA   MET  52           HA       MET  52   8.556   4.612 -28.506
  387   1HB   MET  52          HB2       MET  52   8.967   7.578 -27.942
  388   2HB   MET  52          HB3       MET  52   8.110   6.446 -26.900
  389   1HG   MET  52          HG2       MET  52  11.052   6.529 -27.553
  390   2HG   MET  52          HG3       MET  52  10.264   6.645 -25.990
  391   1HE   MET  52          HE1       MET  52   9.188   2.948 -25.301
  392   2HE   MET  52          HE2       MET  52   9.002   4.652 -24.875
  393   3HE   MET  52          HE3       MET  52   8.219   3.993 -26.346
  394    H    LYS  53           H        LYS  53   7.900   7.535 -30.503
  395    HA   LYS  53           HA       LYS  53   5.107   7.508 -30.169
  396   1HB   LYS  53          HB2       LYS  53   6.871   9.028 -31.664
  397   2HB   LYS  53          HB3       LYS  53   6.081   8.085 -32.913
  398   1HG   LYS  53          HG2       LYS  53   4.438   9.630 -32.827
  399   2HG   LYS  53          HG3       LYS  53   3.905   8.856 -31.341
  400   1HD   LYS  53          HD2       LYS  53   5.747  11.251 -31.646
  401   2HD   LYS  53          HD3       LYS  53   4.084  11.249 -31.042
  402   1HE   LYS  53          HE2       LYS  53   4.836   9.998 -29.006
  403   2HE   LYS  53          HE3       LYS  53   6.487   9.999 -29.630
  404   1HZ   LYS  53          HZ1       LYS  53   4.901  12.415 -28.950
  405   2HZ   LYS  53          HZ2       LYS  53   6.192  11.871 -28.115
  406   3HZ   LYS  53          HZ3       LYS  53   6.387  12.463 -29.617
  407    H    GLU  54           H        GLU  54   7.214   5.433 -32.119
  408    HA   GLU  54           HA       GLU  54   5.166   4.451 -33.828
  409   1HB   GLU  54          HB2       GLU  54   7.741   4.636 -34.143
  410   2HB   GLU  54          HB3       GLU  54   7.801   3.064 -33.369
  411   1HG   GLU  54          HG2       GLU  54   6.187   3.793 -35.865
  412   2HG   GLU  54          HG3       GLU  54   7.829   3.181 -35.911
  413    H    VAL  55           H        VAL  55   5.896   3.780 -30.540
  414    HA   VAL  55           HA       VAL  55   4.186   1.330 -30.656
  415    HB   VAL  55           HB       VAL  55   5.262   0.723 -28.497
  416   1HG1  VAL  55          HG11      VAL  55   5.976  -0.248 -30.643
  417   2HG1  VAL  55          HG12      VAL  55   7.125   1.078 -30.881
  418   3HG1  VAL  55          HG13      VAL  55   7.356  -0.071 -29.557
  419   1HG2  VAL  55          HG21      VAL  55   6.034   3.064 -27.891
  420   2HG2  VAL  55          HG22      VAL  55   7.277   1.831 -27.736
  421   3HG2  VAL  55          HG23      VAL  55   7.296   2.899 -29.139
  422    H    GLY  56           H        GLY  56   3.985   4.595 -30.011
  423   1HA   GLY  56          HA1       GLY  56   1.990   5.621 -29.427
  424   2HA   GLY  56          HA2       GLY  56   1.413   4.139 -28.646
  425    H    ILE  57           H        ILE  57   4.621   5.624 -28.073
  426    HA   ILE  57           HA       ILE  57   3.803   6.407 -25.319
  427    HB   ILE  57           HB       ILE  57   6.310   5.006 -26.325
  428   1HG1  ILE  57          HG12      ILE  57   4.275   4.156 -24.226
  429   2HG1  ILE  57          HG13      ILE  57   4.306   3.563 -25.880
  430   1HG2  ILE  57          HG21      ILE  57   5.792   6.244 -23.586
  431   2HG2  ILE  57          HG22      ILE  57   7.108   5.111 -23.902
  432   3HG2  ILE  57          HG23      ILE  57   7.096   6.653 -24.725
  433   1HD1  ILE  57          HD11      ILE  57   6.553   2.573 -25.516
  434   2HD1  ILE  57          HD12      ILE  57   6.457   3.033 -23.803
  435   3HD1  ILE  57          HD13      ILE  57   5.291   1.895 -24.484
  436    H    ASP  58           H        ASP  58   5.201   8.153 -24.528
  437    HA   ASP  58           HA       ASP  58   6.596   9.743 -26.566
  438   1HB   ASP  58          HB2       ASP  58   4.473  10.939 -26.335
  439   2HB   ASP  58          HB3       ASP  58   4.592  10.873 -24.561
  440    H    ILE  59           H        ILE  59   8.372  10.711 -25.767
  441    HA   ILE  59           HA       ILE  59   9.074  10.407 -22.897
  442    HB   ILE  59           HB       ILE  59  11.460  10.060 -23.735
  443   1HG1  ILE  59          HG12      ILE  59  10.122   9.101 -26.301
  444   2HG1  ILE  59          HG13      ILE  59  10.950  10.645 -26.160
  445   1HG2  ILE  59          HG21      ILE  59  10.067   8.340 -22.643
  446   2HG2  ILE  59          HG22      ILE  59   9.384   7.867 -24.208
  447   3HG2  ILE  59          HG23      ILE  59  11.105   7.609 -23.863
  448   1HD1  ILE  59          HD11      ILE  59  12.238   7.903 -25.773
  449   2HD1  ILE  59          HD12      ILE  59  12.431   8.997 -27.148
  450   3HD1  ILE  59          HD13      ILE  59  13.060   9.459 -25.569
  451    H    SER  60           H        SER  60   8.474  12.514 -25.466
  452    HA   SER  60           HA       SER  60  10.436  14.541 -25.140
  453   1HB   SER  60          HB2       SER  60   7.514  15.082 -25.715
  454   2HB   SER  60          HB3       SER  60   8.943  15.938 -26.317
  455    HG   SER  60           HG       SER  60   7.837  13.449 -27.029
  456    H    ASN  61           H        ASN  61   7.569  13.694 -23.314
  457    HA   ASN  61           HA       ASN  61   7.357  15.987 -21.667
  458   1HB   ASN  61          HB2       ASN  61   5.903  14.637 -20.287
  459   2HB   ASN  61          HB3       ASN  61   5.569  14.289 -21.976
  460   1HD2  ASN  61          HD22      ASN  61   6.199  12.227 -22.846
  461   2HD2  ASN  61          HD21      ASN  61   6.618  10.867 -21.822
  462    H    GLN  62           H        GLN  62   9.910  13.582 -21.536
  463    HA   GLN  62           HA       GLN  62  10.118  13.986 -18.582
  464   1HB   GLN  62          HB2       GLN  62  10.933  11.886 -18.343
  465   2HB   GLN  62          HB3       GLN  62   9.774  11.684 -19.652
  466   1HG   GLN  62          HG2       GLN  62  11.896  12.044 -21.192
  467   2HG   GLN  62          HG3       GLN  62  12.802  11.683 -19.738
  468   1HE2  GLN  62          HE22      GLN  62  13.252  10.151 -21.793
  469   2HE2  GLN  62          HE21      GLN  62  12.532   8.537 -21.631
  470    H    THR  63           H        THR  63  11.863  14.441 -21.589
  471    HA   THR  63           HA       THR  63  13.869  15.237 -22.155
  472    HB   THR  63           HB       THR  63  14.619  17.314 -21.023
  473    HG1  THR  63           HG1      THR  63  13.009  16.372 -19.059
  474   1HG2  THR  63          HG21      THR  63  12.683  18.653 -21.612
  475   2HG2  THR  63          HG22      THR  63  12.886  17.353 -22.796
  476   3HG2  THR  63          HG23      THR  63  11.621  17.232 -21.553
  477    H    SER  64           H        SER  64  16.234  16.040 -21.070
  478    HA   SER  64           HA       SER  64  17.164  13.547 -19.792
  479   1HB   SER  64          HB2       SER  64  18.576  15.420 -21.725
  480   2HB   SER  64          HB3       SER  64  19.102  13.816 -21.211
  481    HG   SER  64           HG       SER  64  18.044  13.066 -22.778
  482    H    ASP  65           H        ASP  65  19.081  13.692 -18.472
  483    HA   ASP  65           HA       ASP  65  20.210  16.272 -17.787
  484   1HB   ASP  65          HB2       ASP  65  18.118  16.151 -16.340
  485   2HB   ASP  65          HB3       ASP  65  18.785  14.697 -15.596
  486    H    ILE  66           H        ILE  66  22.048  15.963 -16.279
  487    HA   ILE  66           HA       ILE  66  23.443  13.403 -16.661
  488    HB   ILE  66           HB       ILE  66  25.084  14.716 -15.024
  489   1HG1  ILE  66          HG12      ILE  66  23.460  16.740 -14.863
  490   2HG1  ILE  66          HG13      ILE  66  25.182  16.988 -15.058
  491   1HG2  ILE  66          HG21      ILE  66  24.785  15.182 -17.986
  492   2HG2  ILE  66          HG22      ILE  66  26.262  15.505 -17.033
  493   3HG2  ILE  66          HG23      ILE  66  25.639  13.858 -17.163
  494   1HD1  ILE  66          HD11      ILE  66  23.216  17.185 -17.384
  495   2HD1  ILE  66          HD12      ILE  66  23.864  18.546 -16.452
  496   3HD1  ILE  66          HD13      ILE  66  24.949  17.541 -17.425
  497    H    ILE  67           H        ILE  67  24.424  12.421 -14.669
  498    HA   ILE  67           HA       ILE  67  22.374  11.446 -13.028
  499    HB   ILE  67           HB       ILE  67  25.396  11.331 -12.855
  500   1HG1  ILE  67          HG12      ILE  67  23.348   9.152 -13.498
  501   2HG1  ILE  67          HG13      ILE  67  24.058  10.184 -14.735
  502   1HG2  ILE  67          HG21      ILE  67  24.612  11.043 -10.556
  503   2HG2  ILE  67          HG22      ILE  67  23.375   9.885 -11.080
  504   3HG2  ILE  67          HG23      ILE  67  25.104   9.475 -11.178
  505   1HD1  ILE  67          HD11      ILE  67  26.333   9.409 -14.082
  506   2HD1  ILE  67          HD12      ILE  67  25.566   8.222 -12.991
  507   3HD1  ILE  67          HD13      ILE  67  25.263   8.155 -14.734
  508    H    ASP  68           H        ASP  68  21.773  11.815 -10.942
  509    HA   ASP  68           HA       ASP  68  22.952  14.109  -9.460
  510   1HB   ASP  68          HB2       ASP  68  20.931  14.889 -10.694
  511   2HB   ASP  68          HB3       ASP  68  19.971  13.656  -9.869
  512    H    SER  69           H        SER  69  23.059  13.831  -7.287
  513    HA   SER  69           HA       SER  69  23.255  11.310  -6.247
  514   1HB   SER  69          HB2       SER  69  22.763  13.843  -4.659
  515   2HB   SER  69          HB3       SER  69  23.687  12.413  -4.159
  516    HG   SER  69           HG       SER  69  25.037  14.128  -4.892
  517    H    ASP  70           H        ASP  70  20.356  13.276  -6.410
  518    HA   ASP  70           HA       ASP  70  19.031  12.134  -4.126
  519   1HB   ASP  70          HB2       ASP  70  18.539  14.388  -5.053
  520   2HB   ASP  70          HB3       ASP  70  17.877  13.627  -6.507
  521    H    ILE  71           H        ILE  71  19.643  10.938  -7.266
  522    HA   ILE  71           HA       ILE  71  17.468   8.918  -7.034
  523    HB   ILE  71           HB       ILE  71  18.865   9.925  -9.528
  524   1HG1  ILE  71          HG12      ILE  71  15.932  10.477  -8.965
  525   2HG1  ILE  71          HG13      ILE  71  17.137  11.584  -8.328
  526   1HG2  ILE  71          HG21      ILE  71  17.100   8.629 -10.691
  527   2HG2  ILE  71          HG22      ILE  71  18.052   7.599  -9.618
  528   3HG2  ILE  71          HG23      ILE  71  16.430   8.120  -9.128
  529   1HD1  ILE  71          HD11      ILE  71  16.906  10.871 -11.264
  530   2HD1  ILE  71          HD12      ILE  71  16.347  12.365 -10.483
  531   3HD1  ILE  71          HD13      ILE  71  18.080  11.985 -10.515
  532    H    LEU  72           H        LEU  72  20.935   9.524  -7.978
  533    HA   LEU  72           HA       LEU  72  21.486   6.886  -8.601
  534   1HB   LEU  72          HB2       LEU  72  23.757   7.321  -8.597
  535   2HB   LEU  72          HB3       LEU  72  22.958   8.851  -9.010
  536    HG   LEU  72           HG       LEU  72  23.313   9.306  -6.427
  537   1HD1  LEU  72          HD11      LEU  72  25.597   8.588  -5.713
  538   2HD1  LEU  72          HD12      LEU  72  24.436   7.285  -5.744
  539   3HD1  LEU  72          HD13      LEU  72  25.626   7.435  -7.060
  540   1HD2  LEU  72          HD21      LEU  72  25.409  10.516  -7.048
  541   2HD2  LEU  72          HD22      LEU  72  25.530   9.536  -8.526
  542   3HD2  LEU  72          HD23      LEU  72  24.188  10.678  -8.312
  543    H    ASN  73           H        ASN  73  21.659   8.299  -5.338
  544    HA   ASN  73           HA       ASN  73  22.488   5.707  -4.265
  545   1HB   ASN  73          HB2       ASN  73  23.304   6.787  -2.476
  546   2HB   ASN  73          HB3       ASN  73  23.302   8.176  -3.545
  547   1HD2  ASN  73          HD22      ASN  73  21.154   9.614  -3.379
  548   2HD2  ASN  73          HD21      ASN  73  20.462   9.714  -1.784
  549    H    ASN  74           H        ASN  74  19.586   6.856  -5.156
  550    HA   ASN  74           HA       ASN  74  18.064   5.948  -2.743
  551   1HB   ASN  74          HB2       ASN  74  18.071   8.376  -3.250
  552   2HB   ASN  74          HB3       ASN  74  17.554   8.025  -4.893
  553   1HD2  ASN  74          HD22      ASN  74  15.781   9.426  -4.609
  554   2HD2  ASN  74          HD21      ASN  74  14.349   8.920  -3.725
  555    H    ALA  75           H        ALA  75  18.422   5.656  -6.242
  556    HA   ALA  75           HA       ALA  75  15.999   4.472  -6.969
  557   1HB   ALA  75          HB1       ALA  75  18.751   4.061  -8.115
  558   2HB   ALA  75          HB2       ALA  75  17.193   3.696  -8.910
  559   3HB   ALA  75          HB3       ALA  75  17.619   5.368  -8.526
  560    H    ASP  76           H        ASP  76  15.060   2.649  -6.550
  561    HA   ASP  76           HA       ASP  76  16.011   0.699  -4.709
  562   1HB   ASP  76          HB2       ASP  76  13.616   1.299  -5.247
  563   2HB   ASP  76          HB3       ASP  76  13.792   0.469  -6.789
  564    H    LEU  77           H        LEU  77  16.134   1.092  -8.195
  565    HA   LEU  77           HA       LEU  77  18.146  -1.033  -8.431
  566   1HB   LEU  77          HB2       LEU  77  16.065  -2.233  -9.028
  567   2HB   LEU  77          HB3       LEU  77  15.600  -0.923 -10.115
  568    HG   LEU  77           HG       LEU  77  17.555  -1.436 -11.579
  569   1HD1  LEU  77          HD11      LEU  77  19.070  -2.503  -9.917
  570   2HD1  LEU  77          HD12      LEU  77  17.934  -3.857  -9.750
  571   3HD1  LEU  77          HD13      LEU  77  18.777  -3.563 -11.289
  572   1HD2  LEU  77          HD21      LEU  77  15.381  -2.396 -12.076
  573   2HD2  LEU  77          HD22      LEU  77  16.674  -3.515 -12.517
  574   3HD2  LEU  77          HD23      LEU  77  15.734  -3.795 -11.035
  575    H    VAL  78           H        VAL  78  19.658  -0.482  -9.980
  576    HA   VAL  78           HA       VAL  78  19.077   1.841 -11.748
  577    HB   VAL  78           HB       VAL  78  21.722   1.019 -10.471
  578   1HG1  VAL  78          HG11      VAL  78  22.557   3.162 -11.497
  579   2HG1  VAL  78          HG12      VAL  78  22.191   1.909 -12.687
  580   3HG1  VAL  78          HG13      VAL  78  21.058   3.255 -12.439
  581   1HG2  VAL  78          HG21      VAL  78  19.931   3.446 -10.035
  582   2HG2  VAL  78          HG22      VAL  78  20.309   2.180  -8.849
  583   3HG2  VAL  78          HG23      VAL  78  21.575   3.283  -9.393
  584    H    VAL  79           H        VAL  79  19.867   1.527 -13.937
  585    HA   VAL  79           HA       VAL  79  20.725  -1.240 -14.632
  586    HB   VAL  79           HB       VAL  79  18.709   0.436 -16.164
  587   1HG1  VAL  79          HG11      VAL  79  19.471  -2.506 -16.424
  588   2HG1  VAL  79          HG12      VAL  79  18.256  -1.655 -17.395
  589   3HG1  VAL  79          HG13      VAL  79  19.958  -1.210 -17.533
  590   1HG2  VAL  79          HG21      VAL  79  17.536  -0.166 -14.141
  591   2HG2  VAL  79          HG22      VAL  79  16.963  -1.220 -15.430
  592   3HG2  VAL  79          HG23      VAL  79  18.115  -1.841 -14.233
  593    H    THR  80           H        THR  80  22.370  -1.202 -16.192
  594    HA   THR  80           HA       THR  80  23.131   1.496 -17.237
  595    HB   THR  80           HB       THR  80  25.454   0.408 -17.463
  596    HG1  THR  80           HG1      THR  80  24.228  -1.363 -15.647
  597   1HG2  THR  80          HG21      THR  80  24.288   1.387 -14.842
  598   2HG2  THR  80          HG22      THR  80  26.035   1.203 -15.165
  599   3HG2  THR  80          HG23      THR  80  25.067   2.324 -16.126
  600    H    LEU  81           H        LEU  81  23.176   1.760 -19.316
  601    HA   LEU  81           HA       LEU  81  22.609  -0.591 -21.077
  602   1HB   LEU  81          HB2       LEU  81  21.903   2.365 -21.372
  603   2HB   LEU  81          HB3       LEU  81  21.622   1.114 -22.577
  604    HG   LEU  81           HG       LEU  81  20.112  -0.089 -20.983
  605   1HD1  LEU  81          HD11      LEU  81  20.637   0.792 -18.785
  606   2HD1  LEU  81          HD12      LEU  81  20.417   2.470 -19.338
  607   3HD1  LEU  81          HD13      LEU  81  19.037   1.361 -19.198
  608   1HD2  LEU  81          HD21      LEU  81  19.242   1.383 -22.774
  609   2HD2  LEU  81          HD22      LEU  81  18.207   1.431 -21.350
  610   3HD2  LEU  81          HD23      LEU  81  19.316   2.772 -21.664
  611    H    CYS  82           H        CYS  82  25.301   0.393 -20.114
  612    HA   CYS  82           HA       CYS  82  26.502   1.735 -22.380
  613   1HB   CYS  82          HB2       CYS  82  28.505   1.757 -20.993
  614   2HB   CYS  82          HB3       CYS  82  27.103   2.467 -20.201
  615    H    GLY  83           H        GLY  83  26.472   0.316 -24.124
  616   1HA   GLY  83          HA1       GLY  83  28.588  -1.761 -23.968
  617   2HA   GLY  83          HA2       GLY  83  27.018  -2.181 -24.668
  618    H    ASP  84           H        ASP  84  27.588   1.090 -25.260
  619    HA   ASP  84           HA       ASP  84  27.743   0.672 -28.101
  620   1HB   ASP  84          HB2       ASP  84  27.152   2.992 -28.181
  621   2HB   ASP  84          HB3       ASP  84  26.247   2.313 -26.826
  622    H    ALA  85           H        ALA  85  29.054   2.581 -29.236
  623    HA   ALA  85           HA       ALA  85  31.713   1.684 -29.223
  624   1HB   ALA  85          HB1       ALA  85  32.131   3.509 -30.812
  625   2HB   ALA  85          HB2       ALA  85  30.584   2.719 -31.172
  626   3HB   ALA  85          HB3       ALA  85  30.614   4.297 -30.342
  627    H    ALA  86           H        ALA  86  30.258   4.297 -27.318
  628    HA   ALA  86           HA       ALA  86  32.837   5.501 -26.642
  629   1HB   ALA  86          HB1       ALA  86  30.103   5.926 -25.364
  630   2HB   ALA  86          HB2       ALA  86  31.537   6.956 -25.209
  631   3HB   ALA  86          HB3       ALA  86  30.709   6.818 -26.776
  632    H    ASP  87           H        ASP  87  30.352   3.555 -24.970
  633    HA   ASP  87           HA       ASP  87  30.299   2.550 -22.942
  634   1HB   ASP  87          HB2       ASP  87  31.059   0.825 -24.430
  635   2HB   ASP  87          HB3       ASP  87  32.753   1.237 -24.124
  636    H    LYS  88           H        LYS  88  31.514   5.106 -22.622
  637    HA   LYS  88           HA       LYS  88  33.711   4.988 -20.814
  638   1HB   LYS  88          HB2       LYS  88  31.514   7.079 -21.110
  639   2HB   LYS  88          HB3       LYS  88  32.993   7.282 -20.162
  640   1HG   LYS  88          HG2       LYS  88  34.383   7.071 -22.168
  641   2HG   LYS  88          HG3       LYS  88  32.976   6.686 -23.154
  642   1HD   LYS  88          HD2       LYS  88  33.547   8.973 -23.570
  643   2HD   LYS  88          HD3       LYS  88  32.005   8.897 -22.734
  644   1HE   LYS  88          HE2       LYS  88  33.251  10.726 -21.806
  645   2HE   LYS  88          HE3       LYS  88  33.161   9.466 -20.576
  646   1HZ   LYS  88          HZ1       LYS  88  35.381  10.414 -20.752
  647   2HZ   LYS  88          HZ2       LYS  88  35.447   8.840 -21.164
  648   3HZ   LYS  88          HZ3       LYS  88  35.505   9.999 -22.318
  649    H    CYS  89           H        CYS  89  30.334   4.394 -20.404
  650    HA   CYS  89           HA       CYS  89  28.918   4.045 -18.864
  651   1HB   CYS  89          HB2       CYS  89  30.251   1.902 -19.208
  652   2HB   CYS  89          HB3       CYS  89  30.845   2.159 -17.564
  653    HA   PRO  90           HA       PRO  90  29.689   6.713 -15.258
  654   1HB   PRO  90          HB2       PRO  90  27.132   6.632 -14.257
  655   2HB   PRO  90          HB3       PRO  90  27.697   7.764 -15.521
  656   1HG   PRO  90          HG2       PRO  90  26.284   5.118 -15.849
  657   2HG   PRO  90          HG3       PRO  90  25.909   6.666 -16.684
  658   1HD   PRO  90          HD2       PRO  90  27.303   4.702 -17.859
  659   2HD   PRO  90          HD3       PRO  90  27.804   6.404 -18.106
  660    H    MET  91           H        MET  91  30.180   6.062 -13.107
  661    HA   MET  91           HA       MET  91  29.838   3.306 -12.325
  662   1HB   MET  91          HB2       MET  91  30.978   3.960 -10.281
  663   2HB   MET  91          HB3       MET  91  31.853   4.557 -11.690
  664   1HG   MET  91          HG2       MET  91  30.871   6.820 -11.324
  665   2HG   MET  91          HG3       MET  91  30.018   6.208  -9.902
  666   1HE   MET  91          HE1       MET  91  30.974   8.173  -8.446
  667   2HE   MET  91          HE2       MET  91  32.700   8.579  -8.340
  668   3HE   MET  91          HE3       MET  91  31.829   8.804  -9.873
  669    H    THR  92           H        THR  92  28.615   2.631 -10.466
  670    HA   THR  92           HA       THR  92  26.391   4.386  -9.586
  671    HB   THR  92           HB       THR  92  25.228   2.157  -9.327
  672    HG1  THR  92           HG1      THR  92  26.966   0.761  -9.275
  673   1HG2  THR  92          HG21      THR  92  24.976   3.630 -11.370
  674   2HG2  THR  92          HG22      THR  92  26.226   2.658 -12.171
  675   3HG2  THR  92          HG23      THR  92  24.698   1.910 -11.684
  676    HA   PRO  93           HA       PRO  93  28.079   3.712  -5.541
  677   1HB   PRO  93          HB2       PRO  93  25.974   3.988  -3.842
  678   2HB   PRO  93          HB3       PRO  93  26.539   5.341  -4.870
  679   1HG   PRO  93          HG2       PRO  93  24.249   3.431  -5.379
  680   2HG   PRO  93          HG3       PRO  93  24.254   5.205  -5.518
  681   1HD   PRO  93          HD2       PRO  93  24.600   3.566  -7.676
  682   2HD   PRO  93          HD3       PRO  93  25.346   5.191  -7.559
  683    HA   PRO  94           HA       PRO  94  27.360  -0.610  -4.425
  684   1HB   PRO  94          HB2       PRO  94  28.232  -0.764  -1.857
  685   2HB   PRO  94          HB3       PRO  94  29.345  -0.448  -3.223
  686   1HG   PRO  94          HG2       PRO  94  28.100   1.561  -1.329
  687   2HG   PRO  94          HG3       PRO  94  29.812   1.437  -1.845
  688   1HD   PRO  94          HD2       PRO  94  27.968   3.144  -3.006
  689   2HD   PRO  94          HD3       PRO  94  29.348   2.445  -3.916
  690    H    HIS  95           H        HIS  95  25.807   2.045  -2.759
  691    HA   HIS  95           HA       HIS  95  24.181   0.628  -0.948
  692   1HB   HIS  95          HB2       HIS  95  24.708   3.098  -0.953
  693   2HB   HIS  95          HB3       HIS  95  23.597   3.294  -2.310
  694    HD1  HIS  95           HD1      HIS  95  21.292   4.210  -1.390
  695    HD2  HIS  95           HD2      HIS  95  23.337   1.618   1.243
  696    HE1  HIS  95           HE1      HIS  95  19.848   4.003   0.679
  697    H    VAL  96           H        VAL  96  23.859   0.957  -4.449
  698    HA   VAL  96           HA       VAL  96  21.018   0.145  -4.278
  699    HB   VAL  96           HB       VAL  96  20.730   1.169  -6.396
  700   1HG1  VAL  96          HG11      VAL  96  20.507   2.505  -4.304
  701   2HG1  VAL  96          HG12      VAL  96  22.138   3.146  -4.577
  702   3HG1  VAL  96          HG13      VAL  96  20.839   3.458  -5.748
  703   1HG2  VAL  96          HG21      VAL  96  22.629   0.918  -7.668
  704   2HG2  VAL  96          HG22      VAL  96  22.538   2.659  -7.364
  705   3HG2  VAL  96          HG23      VAL  96  23.681   1.640  -6.456
  706    H    LYS  97           H        LYS  97  20.220  -1.416  -5.747
  707    HA   LYS  97           HA       LYS  97  22.070  -3.549  -6.535
  708   1HB   LYS  97          HB2       LYS  97  19.744  -3.978  -5.666
  709   2HB   LYS  97          HB3       LYS  97  19.081  -3.126  -7.069
  710   1HG   LYS  97          HG2       LYS  97  20.051  -4.831  -8.578
  711   2HG   LYS  97          HG3       LYS  97  20.801  -5.644  -7.187
  712   1HD   LYS  97          HD2       LYS  97  18.550  -6.117  -6.249
  713   2HD   LYS  97          HD3       LYS  97  17.803  -5.223  -7.575
  714   1HE   LYS  97          HE2       LYS  97  17.592  -7.546  -8.085
  715   2HE   LYS  97          HE3       LYS  97  18.761  -6.852  -9.211
  716   1HZ   LYS  97          HZ1       LYS  97  20.532  -7.825  -7.852
  717   2HZ   LYS  97          HZ2       LYS  97  19.442  -8.435  -6.792
  718   3HZ   LYS  97          HZ3       LYS  97  19.490  -8.983  -8.322
  719    H    ARG  98           H        ARG  98  22.480  -4.012  -8.800
  720    HA   ARG  98           HA       ARG  98  21.573  -1.951 -10.691
  721   1HB   ARG  98          HB2       ARG  98  24.084  -1.664  -9.832
  722   2HB   ARG  98          HB3       ARG  98  24.392  -2.934 -11.019
  723   1HG   ARG  98          HG2       ARG  98  22.755  -1.158 -12.436
  724   2HG   ARG  98          HG3       ARG  98  23.628  -0.073 -11.380
  725   1HD   ARG  98          HD2       ARG  98  24.913  -2.121 -13.248
  726   2HD   ARG  98          HD3       ARG  98  24.573  -0.431 -13.655
  727    HE   ARG  98           HE       ARG  98  26.079  -0.269 -11.355
  728   1HH1  ARG  98          HH21      ARG  98  26.528  -1.291 -14.744
  729   2HH1  ARG  98          HH22      ARG  98  28.241  -1.053 -14.708
  730   1HH2  ARG  98          HH11      ARG  98  28.211   0.198 -11.371
  731   2HH2  ARG  98          HH12      ARG  98  29.251  -0.147 -12.725
  732    H    GLU  99           H        GLU  99  21.514  -2.582 -12.862
  733    HA   GLU  99           HA       GLU  99  21.909  -5.435 -13.599
  734   1HB   GLU  99          HB2       GLU  99  19.593  -3.534 -14.008
  735   2HB   GLU  99          HB3       GLU  99  20.010  -4.588 -15.343
  736   1HG   GLU  99          HG2       GLU  99  19.526  -5.706 -12.569
  737   2HG   GLU  99          HG3       GLU  99  18.204  -5.361 -13.681
  738    H    HIS 100           H        HIS 100  22.419  -5.574 -15.969
  739    HA   HIS 100           HA       HIS 100  23.565  -3.126 -17.172
  740   1HB   HIS 100          HB2       HIS 100  25.343  -4.091 -15.794
  741   2HB   HIS 100          HB3       HIS 100  25.104  -5.676 -16.540
  742    HD1  HIS 100           HD1      HIS 100  26.256  -2.119 -17.525
  743    HD2  HIS 100           HD2      HIS 100  26.443  -6.145 -18.753
  744    HE1  HIS 100           HE1      HIS 100  27.936  -2.223 -19.468
  745    H    TRP 101           H        TRP 101  22.670  -3.077 -19.130
  746    HA   TRP 101           HA       TRP 101  21.863  -5.611 -20.502
  747   1HB   TRP 101          HB2       TRP 101  20.495  -2.889 -20.402
  748   2HB   TRP 101          HB3       TRP 101  19.966  -4.237 -21.382
  749    HD1  TRP 101           HD1      TRP 101  20.694  -5.639 -18.045
  750    HE1  TRP 101           HE1      TRP 101  18.597  -5.928 -16.681
  751    HE3  TRP 101           HE3      TRP 101  17.461  -3.011 -21.031
  752    HZ2  TRP 101           HZ2      TRP 101  15.799  -5.189 -16.871
  753    HZ3  TRP 101           HZ3      TRP 101  15.044  -2.942 -20.467
  754    HH2  TRP 101           HH2      TRP 101  14.210  -4.028 -18.381
  755    H    GLY 102           H        GLY 102  24.327  -3.532 -20.819
  756   1HA   GLY 102          HA1       GLY 102  24.100  -1.849 -22.900
  757   2HA   GLY 102          HA2       GLY 102  25.577  -2.741 -22.544
  758    H    PHE 103           H        PHE 103  24.121  -1.777 -25.043
  759    HA   PHE 103           HA       PHE 103  24.483  -4.194 -26.698
  760   1HB   PHE 103          HB2       PHE 103  22.362  -3.070 -27.998
  761   2HB   PHE 103          HB3       PHE 103  22.296  -4.412 -26.901
  762    HD1  PHE 103           HD1      PHE 103  22.354  -0.625 -26.365
  763    HD2  PHE 103           HD2      PHE 103  20.423  -4.409 -25.577
  764    HE1  PHE 103           HE1      PHE 103  20.849   0.462 -24.750
  765    HE2  PHE 103           HE2      PHE 103  18.895  -3.290 -23.988
  766    HZ   PHE 103           HZ       PHE 103  19.150  -0.865 -23.515
  767    H    ASP 104           H        ASP 104  23.222  -1.199 -28.072
  768    HA   ASP 104           HA       ASP 104  25.788   0.084 -28.252
  769   1HB   ASP 104          HB2       ASP 104  25.980  -1.491 -30.171
  770   2HB   ASP 104          HB3       ASP 104  24.454  -0.882 -30.812
  771    H    ASP 105           H        ASP 105  25.471   2.297 -29.113
  772    HA   ASP 105           HA       ASP 105  22.817   3.283 -28.314
  773   1HB   ASP 105          HB2       ASP 105  24.967   4.498 -27.743
  774   2HB   ASP 105          HB3       ASP 105  25.092   4.954 -29.438
  775    HA   PRO 106           HA       PRO 106  21.614   2.866 -32.592
  776   1HB   PRO 106          HB2       PRO 106  19.246   4.295 -32.576
  777   2HB   PRO 106          HB3       PRO 106  19.431   2.604 -32.038
  778   1HG   PRO 106          HG2       PRO 106  19.348   5.093 -30.345
  779   2HG   PRO 106          HG3       PRO 106  18.574   3.510 -30.031
  780   1HD   PRO 106          HD2       PRO 106  20.922   4.288 -28.865
  781   2HD   PRO 106          HD3       PRO 106  20.629   2.582 -29.313
  782    H    ALA 107           H        ALA 107  22.034   6.053 -31.101
  783    HA   ALA 107           HA       ALA 107  22.018   7.483 -33.613
  784   1HB   ALA 107          HB1       ALA 107  23.315   8.268 -30.974
  785   2HB   ALA 107          HB2       ALA 107  23.007   9.327 -32.359
  786   3HB   ALA 107          HB3       ALA 107  21.644   8.644 -31.462
  787    H    ARG 108           H        ARG 108  24.216   5.220 -32.245
  788    HA   ARG 108           HA       ARG 108  26.475   6.271 -33.894
  789   1HB   ARG 108          HB2       ARG 108  26.571   4.537 -31.381
  790   2HB   ARG 108          HB3       ARG 108  27.955   4.999 -32.382
  791   1HG   ARG 108          HG2       ARG 108  27.284   7.423 -32.010
  792   2HG   ARG 108          HG3       ARG 108  26.163   6.861 -30.772
  793   1HD   ARG 108          HD2       ARG 108  29.021   5.922 -30.555
  794   2HD   ARG 108          HD3       ARG 108  28.764   7.635 -30.327
  795    HE   ARG 108           HE       ARG 108  28.161   5.542 -28.458
  796   1HH1  ARG 108          HH21      ARG 108  27.036   8.781 -29.434
  797   2HH1  ARG 108          HH22      ARG 108  26.681   9.268 -27.819
  798   1HH2  ARG 108          HH11      ARG 108  27.808   6.178 -26.430
  799   2HH2  ARG 108          HH12      ARG 108  27.150   7.743 -26.015
  800    H    ALA 109           H        ALA 109  24.019   4.173 -34.196
  801    HA   ALA 109           HA       ALA 109  25.315   1.863 -35.296
  802   1HB   ALA 109          HB1       ALA 109  23.049   1.832 -34.339
  803   2HB   ALA 109          HB2       ALA 109  22.485   2.949 -35.601
  804   3HB   ALA 109          HB3       ALA 109  23.030   1.322 -36.044
  805    H    GLN 110           H        GLN 110  26.848   3.456 -36.462
  806    HA   GLN 110           HA       GLN 110  26.055   5.215 -38.479
  807   1HB   GLN 110          HB2       GLN 110  28.647   3.714 -37.949
  808   2HB   GLN 110          HB3       GLN 110  28.515   4.986 -39.163
  809   1HG   GLN 110          HG2       GLN 110  28.320   6.688 -37.612
  810   2HG   GLN 110          HG3       GLN 110  27.562   5.684 -36.390
  811   1HE2  GLN 110          HE22      GLN 110  28.866   4.336 -34.999
  812   2HE2  GLN 110          HE21      GLN 110  30.591   4.608 -34.857
  813    H    GLY 111           H        GLY 111  25.874   5.129 -40.607
  814   1HA   GLY 111          HA1       GLY 111  26.758   3.361 -42.505
  815   2HA   GLY 111          HA2       GLY 111  25.190   2.685 -41.998
  816    H    THR 112           H        THR 112  23.488   4.577 -41.602
  817    HA   THR 112           HA       THR 112  23.711   7.033 -42.925
  818    HB   THR 112           HB       THR 112  23.445   5.818 -45.017
  819    HG1  THR 112           HG1      THR 112  21.784   6.937 -45.800
  820   1HG2  THR 112          HG21      THR 112  20.933   4.582 -43.827
  821   2HG2  THR 112          HG22      THR 112  21.402   4.507 -45.538
  822   3HG2  THR 112          HG23      THR 112  22.419   3.738 -44.318
  823    H    GLU 113           H        GLU 113  21.417   8.103 -42.840
  824    HA   GLU 113           HA       GLU 113  20.602   7.939 -40.110
  825   1HB   GLU 113          HB2       GLU 113  18.911   9.581 -40.698
  826   2HB   GLU 113          HB3       GLU 113  20.480  10.009 -41.381
  827   1HG   GLU 113          HG2       GLU 113  19.731   9.119 -43.602
  828   2HG   GLU 113          HG3       GLU 113  18.150   8.756 -42.906
  829    H    GLU 114           H        GLU 114  19.399   6.367 -43.043
  830    HA   GLU 114           HA       GLU 114  16.968   5.424 -41.867
  831   1HB   GLU 114          HB2       GLU 114  17.364   5.634 -44.301
  832   2HB   GLU 114          HB3       GLU 114  18.537   4.308 -44.225
  833   1HG   GLU 114          HG2       GLU 114  16.765   2.756 -43.496
  834   2HG   GLU 114          HG3       GLU 114  15.602   4.083 -43.417
  835    H    GLU 115           H        GLU 115  20.297   4.158 -41.979
  836    HA   GLU 115           HA       GLU 115  19.607   1.561 -40.897
  837   1HB   GLU 115          HB2       GLU 115  22.238   3.068 -41.156
  838   2HB   GLU 115          HB3       GLU 115  22.123   1.494 -40.381
  839   1HG   GLU 115          HG2       GLU 115  21.213   2.021 -43.239
  840   2HG   GLU 115          HG3       GLU 115  22.827   1.468 -42.805
  841    H    LYS 116           H        LYS 116  20.847   4.668 -39.581
  842    HA   LYS 116           HA       LYS 116  20.909   3.901 -36.855
  843   1HB   LYS 116          HB2       LYS 116  20.408   6.583 -38.209
  844   2HB   LYS 116          HB3       LYS 116  20.478   6.386 -36.446
  845   1HG   LYS 116          HG2       LYS 116  22.770   5.386 -36.700
  846   2HG   LYS 116          HG3       LYS 116  22.705   5.770 -38.433
  847   1HD   LYS 116          HD2       LYS 116  22.360   8.196 -37.811
  848   2HD   LYS 116          HD3       LYS 116  22.549   7.733 -36.105
  849   1HE   LYS 116          HE2       LYS 116  24.813   6.711 -36.793
  850   2HE   LYS 116          HE3       LYS 116  24.608   7.543 -38.345
  851   1HZ   LYS 116          HZ1       LYS 116  25.897   8.906 -36.867
  852   2HZ   LYS 116          HZ2       LYS 116  24.449   9.639 -37.023
  853   3HZ   LYS 116          HZ3       LYS 116  24.802   8.776 -35.660
  854    H    TRP 117           H        TRP 117  18.188   5.384 -38.727
  855    HA   TRP 117           HA       TRP 117  16.307   5.353 -36.648
  856   1HB   TRP 117          HB2       TRP 117  15.898   6.616 -38.617
  857   2HB   TRP 117          HB3       TRP 117  16.101   5.214 -39.658
  858    HD1  TRP 117           HD1      TRP 117  13.956   4.639 -40.757
  859    HE1  TRP 117           HE1      TRP 117  11.526   4.322 -40.093
  860    HE3  TRP 117           HE3      TRP 117  14.260   6.131 -35.863
  861    HZ2  TRP 117           HZ2      TRP 117   9.865   4.737 -37.738
  862    HZ3  TRP 117           HZ3      TRP 117  12.276   6.050 -34.416
  863    HH2  TRP 117           HH2      TRP 117  10.063   5.345 -35.331
  864    H    ALA 118           H        ALA 118  17.180   2.678 -38.917
  865    HA   ALA 118           HA       ALA 118  15.092   0.949 -37.999
  866   1HB   ALA 118          HB1       ALA 118  16.400  -0.832 -39.078
  867   2HB   ALA 118          HB2       ALA 118  16.239   0.591 -40.128
  868   3HB   ALA 118          HB3       ALA 118  17.774   0.279 -39.276
  869    H    PHE 119           H        PHE 119  18.492   1.436 -37.019
  870    HA   PHE 119           HA       PHE 119  18.493  -0.566 -35.021
  871   1HB   PHE 119          HB2       PHE 119  20.432   0.893 -36.146
  872   2HB   PHE 119          HB3       PHE 119  20.229   1.855 -34.693
  873    HD1  PHE 119           HD1      PHE 119  20.705   0.787 -32.440
  874    HD2  PHE 119           HD2      PHE 119  21.357  -1.333 -36.136
  875    HE1  PHE 119           HE1      PHE 119  22.108  -0.859 -31.241
  876    HE2  PHE 119           HE2      PHE 119  22.761  -2.988 -34.930
  877    HZ   PHE 119           HZ       PHE 119  23.142  -2.754 -32.481
  878    H    PHE 120           H        PHE 120  17.502   2.861 -34.863
  879    HA   PHE 120           HA       PHE 120  17.075   2.998 -32.046
  880   1HB   PHE 120          HB2       PHE 120  15.848   4.435 -34.420
  881   2HB   PHE 120          HB3       PHE 120  15.060   4.555 -32.868
  882    HD1  PHE 120           HD1      PHE 120  17.889   5.738 -34.845
  883    HD2  PHE 120           HD2      PHE 120  16.177   5.568 -30.894
  884    HE1  PHE 120           HE1      PHE 120  19.466   7.484 -34.099
  885    HE2  PHE 120           HE2      PHE 120  17.721   7.375 -30.171
  886    HZ   PHE 120           HZ       PHE 120  19.360   8.328 -31.761
  887    H    GLN 121           H        GLN 121  14.806   1.910 -34.627
  888    HA   GLN 121           HA       GLN 121  12.732   1.216 -32.783
  889   1HB   GLN 121          HB2       GLN 121  13.406   0.299 -35.608
  890   2HB   GLN 121          HB3       GLN 121  11.954  -0.236 -34.764
  891   1HG   GLN 121          HG2       GLN 121  11.023   1.933 -34.681
  892   2HG   GLN 121          HG3       GLN 121  12.560   2.726 -35.039
  893   1HE2  GLN 121          HE22      GLN 121  13.490   2.551 -37.170
  894   2HE2  GLN 121          HE21      GLN 121  12.471   2.217 -38.556
  895    H    ARG 122           H        ARG 122  15.517  -0.688 -34.015
  896    HA   ARG 122           HA       ARG 122  14.666  -3.151 -32.793
  897   1HB   ARG 122          HB2       ARG 122  17.429  -2.137 -33.603
  898   2HB   ARG 122          HB3       ARG 122  17.120  -3.773 -33.015
  899   1HG   ARG 122          HG2       ARG 122  15.678  -4.285 -34.891
  900   2HG   ARG 122          HG3       ARG 122  15.721  -2.612 -35.462
  901   1HD   ARG 122          HD2       ARG 122  18.200  -2.816 -35.776
  902   2HD   ARG 122          HD3       ARG 122  18.079  -4.533 -35.336
  903    HE   ARG 122           HE       ARG 122  16.224  -4.094 -37.391
  904   1HH1  ARG 122          HH21      ARG 122  19.752  -3.968 -37.014
  905   2HH1  ARG 122          HH22      ARG 122  20.085  -4.275 -38.677
  906   1HH2  ARG 122          HH11      ARG 122  16.666  -4.516 -39.609
  907   2HH2  ARG 122          HH12      ARG 122  18.286  -4.605 -40.181
  908    H    VAL 123           H        VAL 123  16.905  -0.543 -31.586
  909    HA   VAL 123           HA       VAL 123  17.404  -1.921 -29.112
  910    HB   VAL 123           HB       VAL 123  17.680   0.984 -30.010
  911   1HG1  VAL 123          HG11      VAL 123  18.671  -0.252 -27.404
  912   2HG1  VAL 123          HG12      VAL 123  19.160   1.334 -28.041
  913   3HG1  VAL 123          HG13      VAL 123  17.482   1.059 -27.576
  914   1HG2  VAL 123          HG21      VAL 123  19.783  -1.167 -29.471
  915   2HG2  VAL 123          HG22      VAL 123  19.196  -0.715 -31.078
  916   3HG2  VAL 123          HG23      VAL 123  20.073   0.468 -30.099
  917    H    ARG 124           H        ARG 124  14.948   0.514 -30.129
  918    HA   ARG 124           HA       ARG 124  13.657   0.900 -27.649
  919   1HB   ARG 124          HB2       ARG 124  13.151   2.253 -29.589
  920   2HB   ARG 124          HB3       ARG 124  12.794   0.853 -30.552
  921   1HG   ARG 124          HG2       ARG 124  10.848   0.650 -28.582
  922   2HG   ARG 124          HG3       ARG 124  11.049   2.387 -28.728
  923   1HD   ARG 124          HD2       ARG 124   9.289   1.586 -30.221
  924   2HD   ARG 124          HD3       ARG 124  10.639   2.225 -31.162
  925    HE   ARG 124           HE       ARG 124  11.090  -0.539 -30.937
  926   1HH1  ARG 124          HH21      ARG 124   8.781   1.686 -32.378
  927   2HH1  ARG 124          HH22      ARG 124   8.320   0.645 -33.688
  928   1HH2  ARG 124          HH11      ARG 124  10.620  -1.920 -32.742
  929   2HH2  ARG 124          HH12      ARG 124   9.421  -1.453 -33.894
  930    H    ASP 125           H        ASP 125  13.020  -1.596 -30.209
  931    HA   ASP 125           HA       ASP 125  10.852  -2.758 -28.786
  932   1HB   ASP 125          HB2       ASP 125  11.126  -3.102 -31.173
  933   2HB   ASP 125          HB3       ASP 125  12.688  -3.888 -30.936
  934    H    GLU 126           H        GLU 126  14.354  -3.649 -28.918
  935    HA   GLU 126           HA       GLU 126  14.063  -6.003 -27.375
  936   1HB   GLU 126          HB2       GLU 126  15.931  -5.508 -28.876
  937   2HB   GLU 126          HB3       GLU 126  16.516  -4.249 -27.773
  938   1HG   GLU 126          HG2       GLU 126  16.978  -5.894 -26.045
  939   2HG   GLU 126          HG3       GLU 126  16.121  -7.154 -26.934
  940    H    ILE 127           H        ILE 127  14.852  -2.631 -26.424
  941    HA   ILE 127           HA       ILE 127  15.155  -3.097 -23.621
  942    HB   ILE 127           HB       ILE 127  14.335  -0.706 -25.309
  943   1HG1  ILE 127          HG12      ILE 127  16.819  -1.277 -23.620
  944   2HG1  ILE 127          HG13      ILE 127  16.722  -1.561 -25.353
  945   1HG2  ILE 127          HG21      ILE 127  13.221  -0.406 -23.114
  946   2HG2  ILE 127          HG22      ILE 127  14.783  -0.655 -22.296
  947   3HG2  ILE 127          HG23      ILE 127  14.521   0.736 -23.381
  948   1HD1  ILE 127          HD11      ILE 127  17.806   0.513 -25.137
  949   2HD1  ILE 127          HD12      ILE 127  16.149   0.931 -25.612
  950   3HD1  ILE 127          HD13      ILE 127  16.675   1.109 -23.919
  951    H    GLY 128           H        GLY 128  12.249  -2.211 -25.605
  952   1HA   GLY 128          HA1       GLY 128  10.369  -2.102 -23.554
  953   2HA   GLY 128          HA2       GLY 128  10.031  -2.594 -25.227
  954    H    ASN 129           H        ASN 129  11.478  -4.986 -25.401
  955    HA   ASN 129           HA       ASN 129   9.729  -6.835 -24.157
  956   1HB   ASN 129          HB2       ASN 129  12.382  -7.139 -25.594
  957   2HB   ASN 129          HB3       ASN 129  11.683  -8.505 -24.737
  958   1HD2  ASN 129          HD22      ASN 129  11.048  -6.184 -27.397
  959   2HD2  ASN 129          HD21      ASN 129   9.885  -7.201 -28.206
  960    H    ARG 130           H        ARG 130  13.112  -5.963 -23.235
  961    HA   ARG 130           HA       ARG 130  12.922  -7.763 -20.951
  962   1HB   ARG 130          HB2       ARG 130  14.974  -5.780 -21.885
  963   2HB   ARG 130          HB3       ARG 130  14.956  -6.172 -20.171
  964   1HG   ARG 130          HG2       ARG 130  15.179  -8.232 -22.377
  965   2HG   ARG 130          HG3       ARG 130  16.520  -7.583 -21.449
  966   1HD   ARG 130          HD2       ARG 130  14.221  -9.296 -20.382
  967   2HD   ARG 130          HD3       ARG 130  15.891  -9.791 -20.589
  968    HE   ARG 130           HE       ARG 130  14.719  -8.628 -18.314
  969   1HH1  ARG 130          HH11      ARG 130  17.806  -8.349 -20.085
  970   2HH1  ARG 130          HH12      ARG 130  18.704  -7.930 -18.671
  971   1HH2  ARG 130          HH21      ARG 130  15.907  -8.163 -16.484
  972   2HH2  ARG 130          HH22      ARG 130  17.608  -7.816 -16.554
  973    H    LEU 131           H        LEU 131  12.029  -4.343 -21.398
  974    HA   LEU 131           HA       LEU 131  11.787  -3.863 -18.586
  975   1HB   LEU 131          HB2       LEU 131  11.493  -2.277 -20.871
  976   2HB   LEU 131          HB3       LEU 131   9.859  -2.409 -20.267
  977    HG   LEU 131           HG       LEU 131  10.880  -0.477 -19.332
  978   1HD1  LEU 131          HD11      LEU 131  10.712  -0.847 -16.896
  979   2HD1  LEU 131          HD12      LEU 131   9.404  -1.677 -17.769
  980   3HD1  LEU 131          HD13      LEU 131  10.779  -2.585 -17.143
  981   1HD2  LEU 131          HD21      LEU 131  12.925  -0.351 -18.193
  982   2HD2  LEU 131          HD22      LEU 131  13.087  -2.105 -18.057
  983   3HD2  LEU 131          HD23      LEU 131  13.257  -1.298 -19.635
  984    H    LYS 132           H        LYS 132   9.531  -5.114 -21.086
  985    HA   LYS 132           HA       LYS 132   7.277  -5.428 -19.431
  986   1HB   LYS 132          HB2       LYS 132   7.283  -5.706 -21.899
  987   2HB   LYS 132          HB3       LYS 132   8.193  -7.202 -21.738
  988   1HG   LYS 132          HG2       LYS 132   6.371  -8.280 -20.543
  989   2HG   LYS 132          HG3       LYS 132   5.446  -6.760 -20.507
  990   1HD   LYS 132          HD2       LYS 132   5.362  -6.725 -22.970
  991   2HD   LYS 132          HD3       LYS 132   6.291  -8.222 -23.060
  992   1HE   LYS 132          HE2       LYS 132   3.575  -7.963 -21.679
  993   2HE   LYS 132          HE3       LYS 132   3.780  -8.424 -23.371
  994   1HZ   LYS 132          HZ1       LYS 132   3.559 -10.375 -22.066
  995   2HZ   LYS 132          HZ2       LYS 132   5.098 -10.341 -22.595
  996   3HZ   LYS 132          HZ3       LYS 132   4.741  -9.974 -21.026
  997    H    GLU 133           H        GLU 133   9.899  -7.778 -20.131
  998    HA   GLU 133           HA       GLU 133   8.855  -9.692 -18.333
  999   1HB   GLU 133          HB2       GLU 133  11.741  -9.423 -19.209
 1000   2HB   GLU 133          HB3       GLU 133  10.997 -10.810 -18.373
 1001   1HG   GLU 133          HG2       GLU 133   9.399 -11.077 -20.253
 1002   2HG   GLU 133          HG3       GLU 133  10.180  -9.755 -21.111
 1003    H    PHE 134           H        PHE 134  11.155  -7.037 -17.741
 1004    HA   PHE 134           HA       PHE 134  11.824  -7.785 -15.108
 1005   1HB   PHE 134          HB2       PHE 134  13.124  -6.128 -16.246
 1006   2HB   PHE 134          HB3       PHE 134  11.712  -5.116 -16.526
 1007    HD1  PHE 134           HD1      PHE 134  13.479  -6.677 -13.560
 1008    HD2  PHE 134           HD2      PHE 134  11.516  -3.215 -15.216
 1009    HE1  PHE 134           HE1      PHE 134  13.828  -5.445 -11.434
 1010    HE2  PHE 134           HE2      PHE 134  11.879  -1.981 -13.116
 1011    HZ   PHE 134           HZ       PHE 134  13.036  -3.102 -11.205
 1012    H    ALA 135           H        ALA 135   9.018  -6.041 -16.381
 1013    HA   ALA 135           HA       ALA 135   8.074  -5.299 -13.735
 1014   1HB   ALA 135          HB1       ALA 135   7.718  -3.879 -15.766
 1015   2HB   ALA 135          HB2       ALA 135   6.726  -5.164 -16.478
 1016   3HB   ALA 135          HB3       ALA 135   6.178  -4.336 -15.002
 1017    H    GLU 136           H        GLU 136   7.369  -7.763 -16.165
 1018    HA   GLU 136           HA       GLU 136   4.951  -8.669 -14.842
 1019   1HB   GLU 136          HB2       GLU 136   5.003  -8.435 -17.242
 1020   2HB   GLU 136          HB3       GLU 136   6.429  -9.479 -17.369
 1021   1HG   GLU 136          HG2       GLU 136   5.193 -11.428 -16.719
 1022   2HG   GLU 136          HG3       GLU 136   3.774 -10.459 -16.291
 1023    H    THR 137           H        THR 137   8.205  -9.937 -15.483
 1024    HA   THR 137           HA       THR 137   7.515 -12.436 -14.042
 1025    HB   THR 137           HB       THR 137   9.061 -13.601 -15.379
 1026    HG1  THR 137           HG1      THR 137   9.858 -11.047 -16.277
 1027   1HG2  THR 137          HG21      THR 137   8.159 -13.383 -17.607
 1028   2HG2  THR 137          HG22      THR 137   6.849 -13.140 -16.440
 1029   3HG2  THR 137          HG23      THR 137   7.573 -11.742 -17.280
 1030    H    GLY 138           H        GLY 138   9.549  -9.614 -13.953
 1031   1HA   GLY 138          HA1       GLY 138  10.837  -8.907 -12.132
 1032   2HA   GLY 138          HA2       GLY 138  10.870 -10.547 -11.477
 1033    H    LYS 139           H        LYS 139  11.550 -10.306 -14.906
 1034    HA   LYS 139           HA       LYS 139  14.360 -10.937 -14.359
 1035   1HB   LYS 139          HB2       LYS 139  12.654 -11.614 -16.761
 1036   2HB   LYS 139          HB3       LYS 139  14.351 -12.047 -16.547
 1037   1HG   LYS 139          HG2       LYS 139  12.077 -12.918 -14.726
 1038   2HG   LYS 139          HG3       LYS 139  12.759 -13.896 -16.031
 1039   1HD   LYS 139          HD2       LYS 139  14.936 -13.951 -14.850
 1040   2HD   LYS 139          HD3       LYS 139  14.256 -12.943 -13.545
 1041   1HE   LYS 139          HE2       LYS 139  12.527 -14.636 -13.103
 1042   2HE   LYS 139          HE3       LYS 139  13.182 -15.663 -14.385
 1043   1HZ   LYS 139          HZ1       LYS 139  13.979 -16.352 -12.216
 1044   2HZ   LYS 139          HZ2       LYS 139  15.240 -15.836 -13.107
 1045   3HZ   LYS 139          HZ3       LYS 139  14.634 -14.890 -11.918
  Start of MODEL    8
    1   1H    MET   1           H1       MET   1   1.818   2.068   3.711
    2   2H    MET   1           H2       MET   1   3.305   1.401   3.548
    3   3H    MET   1           H3       MET   1   3.165   2.940   4.072
    4    HA   MET   1           HA       MET   1   2.446   1.963   1.396
    5   1HB   MET   1          HB2       MET   1   2.358   4.793   2.536
    6   2HB   MET   1          HB3       MET   1   2.277   4.410   0.818
    7   1HG   MET   1          HG2       MET   1   0.265   3.538   2.923
    8   2HG   MET   1          HG3       MET   1   0.059   4.806   1.723
    9   1HE   MET   1          HE1       MET   1  -2.507   2.113   0.531
   10   2HE   MET   1          HE2       MET   1  -2.077   2.523   2.206
   11   3HE   MET   1          HE3       MET   1  -2.257   3.811   0.993
   12    H    GLU   2           H        GLU   2   4.014   2.171  -0.203
   13    HA   GLU   2           HA       GLU   2   6.468   3.643   0.264
   14   1HB   GLU   2          HB2       GLU   2   6.899   1.443   1.384
   15   2HB   GLU   2          HB3       GLU   2   6.458   0.602  -0.098
   16   1HG   GLU   2          HG2       GLU   2   8.879   0.673   0.224
   17   2HG   GLU   2          HG3       GLU   2   8.428   1.514  -1.245
   18    H    ASN   3           H        ASN   3   7.725   3.693  -1.833
   19    HA   ASN   3           HA       ASN   3   6.271   2.807  -4.251
   20   1HB   ASN   3          HB2       ASN   3   5.696   5.278  -3.520
   21   2HB   ASN   3          HB3       ASN   3   7.349   5.647  -4.024
   22   1HD2  ASN   3          HD22      ASN   3   7.919   5.091  -6.364
   23   2HD2  ASN   3          HD21      ASN   3   6.576   5.237  -7.516
   24    H    LYS   4           H        LYS   4   7.838   2.157  -5.819
   25    HA   LYS   4           HA       LYS   4  10.601   2.034  -4.829
   26   1HB   LYS   4          HB2       LYS   4   8.968   0.579  -6.825
   27   2HB   LYS   4          HB3       LYS   4  10.497   1.100  -7.515
   28   1HG   LYS   4          HG2       LYS   4  10.879  -1.059  -6.579
   29   2HG   LYS   4          HG3       LYS   4  11.698   0.115  -5.547
   30   1HD   LYS   4          HD2       LYS   4   9.535   0.027  -4.075
   31   2HD   LYS   4          HD3       LYS   4   9.123  -1.414  -4.999
   32   1HE   LYS   4          HE2       LYS   4  11.626  -0.944  -3.308
   33   2HE   LYS   4          HE3       LYS   4  10.235  -1.938  -2.861
   34   1HZ   LYS   4          HZ1       LYS   4  12.236  -2.504  -4.967
   35   2HZ   LYS   4          HZ2       LYS   4  11.898  -3.382  -3.641
   36   3HZ   LYS   4          HZ3       LYS   4  10.807  -3.340  -4.852
   37    H    ILE   5           H        ILE   5  12.335   2.454  -6.555
   38    HA   ILE   5           HA       ILE   5  11.871   4.868  -8.128
   39    HB   ILE   5           HB       ILE   5  14.172   4.605  -6.171
   40   1HG1  ILE   5          HG12      ILE   5  13.042   6.804  -5.167
   41   2HG1  ILE   5          HG13      ILE   5  11.568   6.011  -5.697
   42   1HG2  ILE   5          HG21      ILE   5  13.291   6.983  -7.862
   43   2HG2  ILE   5          HG22      ILE   5  14.681   6.957  -6.758
   44   3HG2  ILE   5          HG23      ILE   5  14.686   5.950  -8.201
   45   1HD1  ILE   5          HD11      ILE   5  13.728   4.847  -3.877
   46   2HD1  ILE   5          HD12      ILE   5  12.160   5.483  -3.342
   47   3HD1  ILE   5          HD13      ILE   5  12.241   3.996  -4.303
   48    H    ILE   6           H        ILE   6  13.260   4.731 -10.019
   49    HA   ILE   6           HA       ILE   6  15.335   2.656 -10.089
   50    HB   ILE   6           HB       ILE   6  13.352   1.406 -10.699
   51   1HG1  ILE   6          HG12      ILE   6  14.996   1.951 -13.211
   52   2HG1  ILE   6          HG13      ILE   6  15.520   0.943 -11.858
   53   1HG2  ILE   6          HG21      ILE   6  11.934   3.310 -11.506
   54   2HG2  ILE   6          HG22      ILE   6  12.916   3.356 -12.992
   55   3HG2  ILE   6          HG23      ILE   6  11.926   1.940 -12.603
   56   1HD1  ILE   6          HD11      ILE   6  13.562  -0.549 -12.252
   57   2HD1  ILE   6          HD12      ILE   6  13.157   0.410 -13.700
   58   3HD1  ILE   6          HD13      ILE   6  14.687  -0.467 -13.626
   59    H    TYR   7           H        TYR   7  16.871   3.010 -11.784
   60    HA   TYR   7           HA       TYR   7  16.621   5.609 -13.192
   61   1HB   TYR   7          HB2       TYR   7  17.921   5.478 -10.882
   62   2HB   TYR   7          HB3       TYR   7  19.181   4.719 -11.823
   63    HD1  TYR   7           HD1      TYR   7  17.543   7.354 -13.783
   64    HD2  TYR   7           HD2      TYR   7  20.359   6.622 -10.589
   65    HE1  TYR   7           HE1      TYR   7  18.240   9.704 -13.862
   66    HE2  TYR   7           HE2      TYR   7  21.085   8.984 -10.694
   67    HH   TYR   7           HH       TYR   7  20.507  11.114 -11.502
   68    H    PHE   8           H        PHE   8  17.279   5.484 -15.273
   69    HA   PHE   8           HA       PHE   8  18.849   3.096 -16.192
   70   1HB   PHE   8          HB2       PHE   8  16.982   4.919 -17.768
   71   2HB   PHE   8          HB3       PHE   8  17.883   3.556 -18.412
   72    HD1  PHE   8           HD1      PHE   8  17.349   1.185 -17.521
   73    HD2  PHE   8           HD2      PHE   8  14.822   4.604 -16.810
   74    HE1  PHE   8           HE1      PHE   8  15.507  -0.327 -16.858
   75    HE2  PHE   8           HE2      PHE   8  12.972   3.065 -16.206
   76    HZ   PHE   8           HZ       PHE   8  13.331   0.627 -16.128
   77    H    LEU   9           H        LEU   9  20.890   3.532 -16.925
   78    HA   LEU   9           HA       LEU   9  21.643   6.399 -17.283
   79   1HB   LEU   9          HB2       LEU   9  23.206   4.153 -15.981
   80   2HB   LEU   9          HB3       LEU   9  23.761   5.803 -16.239
   81    HG   LEU   9           HG       LEU   9  21.531   4.947 -14.352
   82   1HD1  LEU   9          HD11      LEU   9  24.292   6.142 -13.840
   83   2HD1  LEU   9          HD12      LEU   9  23.085   5.704 -12.615
   84   3HD1  LEU   9          HD13      LEU   9  23.840   4.442 -13.601
   85   1HD2  LEU   9          HD21      LEU   9  21.667   7.386 -13.621
   86   2HD2  LEU   9          HD22      LEU   9  22.547   7.698 -15.138
   87   3HD2  LEU   9          HD23      LEU   9  20.879   7.102 -15.167
   88    H    CYS  10           H        CYS  10  23.103   6.907 -18.886
   89    HA   CYS  10           HA       CYS  10  24.299   4.712 -20.522
   90   1HB   CYS  10          HB2       CYS  10  22.525   7.007 -21.484
   91   2HB   CYS  10          HB3       CYS  10  23.570   6.105 -22.577
   92    HG   CYS  10           HG       CYS  10  21.869   4.309 -20.513
   93    H    THR  11           H        THR  11  25.707   5.657 -22.256
   94    HA   THR  11           HA       THR  11  27.609   7.601 -21.290
   95    HB   THR  11           HB       THR  11  28.654   6.915 -23.550
   96    HG1  THR  11           HG1      THR  11  27.583   4.803 -24.222
   97   1HG2  THR  11          HG21      THR  11  29.269   5.785 -21.433
   98   2HG2  THR  11          HG22      THR  11  27.909   4.651 -21.634
   99   3HG2  THR  11          HG23      THR  11  29.238   4.655 -22.808
  100    H    GLY  12           H        GLY  12  24.930   8.612 -21.630
  101   1HA   GLY  12          HA1       GLY  12  24.873  11.033 -22.656
  102   2HA   GLY  12          HA2       GLY  12  24.798  10.118 -24.173
  103    H    ASN  13           H        ASN  13  22.926  11.479 -21.728
  104    HA   ASN  13           HA       ASN  13  20.788   9.519 -21.612
  105   1HB   ASN  13          HB2       ASN  13  21.336  11.145 -19.768
  106   2HB   ASN  13          HB3       ASN  13  20.778  12.453 -20.817
  107   1HD2  ASN  13          HD22      ASN  13  19.182   9.135 -20.340
  108   2HD2  ASN  13          HD21      ASN  13  17.715   9.866 -19.717
  109    H    SER  14           H        SER  14  21.055   9.695 -24.242
  110    HA   SER  14           HA       SER  14  19.011  11.677 -25.168
  111   1HB   SER  14          HB2       SER  14  21.562  10.778 -26.537
  112   2HB   SER  14          HB3       SER  14  20.352  11.881 -27.225
  113    HG   SER  14           HG       SER  14  20.753  13.344 -25.665
  114    H    CYS  15           H        CYS  15  19.862   8.297 -25.200
  115    HA   CYS  15           HA       CYS  15  17.679   7.810 -27.168
  116   1HB   CYS  15          HB2       CYS  15  20.441   6.527 -27.311
  117   2HB   CYS  15          HB3       CYS  15  19.065   6.200 -28.374
  118    HG   CYS  15           HG       CYS  15  21.202   7.600 -29.289
  119    H    ARG  16           H        ARG  16  19.978   5.445 -25.867
  120    HA   ARG  16           HA       ARG  16  18.037   3.543 -25.354
  121   1HB   ARG  16          HB2       ARG  16  20.743   4.012 -24.092
  122   2HB   ARG  16          HB3       ARG  16  19.836   2.544 -23.795
  123   1HG   ARG  16          HG2       ARG  16  20.091   1.763 -25.998
  124   2HG   ARG  16          HG3       ARG  16  20.539   3.351 -26.629
  125   1HD   ARG  16          HD2       ARG  16  22.216   1.821 -24.591
  126   2HD   ARG  16          HD3       ARG  16  22.490   1.752 -26.341
  127    HE   ARG  16           HE       ARG  16  22.462   4.429 -25.945
  128   1HH1  ARG  16          HH11      ARG  16  24.354   1.971 -24.182
  129   2HH1  ARG  16          HH12      ARG  16  25.804   2.976 -24.264
  130   1HH2  ARG  16          HH21      ARG  16  24.079   5.729 -25.679
  131   2HH2  ARG  16          HH22      ARG  16  25.527   5.296 -24.779
  132    H    SER  17           H        SER  17  19.496   5.675 -22.759
  133    HA   SER  17           HA       SER  17  17.843   4.497 -20.745
  134   1HB   SER  17          HB2       SER  17  18.618   6.512 -19.409
  135   2HB   SER  17          HB3       SER  17  19.865   5.486 -20.068
  136    HG   SER  17           HG       SER  17  20.603   7.295 -20.841
  137    H    GLN  18           H        GLN  18  17.439   7.363 -22.797
  138    HA   GLN  18           HA       GLN  18  15.108   8.435 -21.583
  139   1HB   GLN  18          HB2       GLN  18  16.308   8.551 -24.379
  140   2HB   GLN  18          HB3       GLN  18  14.772   9.296 -24.047
  141   1HG   GLN  18          HG2       GLN  18  17.268   9.923 -22.414
  142   2HG   GLN  18          HG3       GLN  18  16.873  10.774 -23.904
  143   1HE2  GLN  18          HE22      GLN  18  16.921  11.817 -20.962
  144   2HE2  GLN  18          HE21      GLN  18  15.300  12.495 -20.817
  145    H    MET  19           H        MET  19  15.437   6.274 -24.395
  146    HA   MET  19           HA       MET  19  12.746   5.625 -24.844
  147   1HB   MET  19          HB2       MET  19  15.265   3.948 -25.231
  148   2HB   MET  19          HB3       MET  19  13.695   3.542 -25.920
  149   1HG   MET  19          HG2       MET  19  13.742   5.347 -27.438
  150   2HG   MET  19          HG3       MET  19  14.905   6.254 -26.488
  151   1HE   MET  19          HE1       MET  19  15.966   2.802 -29.358
  152   2HE   MET  19          HE2       MET  19  15.096   2.490 -27.839
  153   3HE   MET  19          HE3       MET  19  14.346   3.489 -29.111
  154    H    ALA  20           H        ALA  20  15.105   3.955 -22.659
  155    HA   ALA  20           HA       ALA  20  13.342   1.899 -21.845
  156   1HB   ALA  20          HB1       ALA  20  15.783   1.826 -21.511
  157   2HB   ALA  20          HB2       ALA  20  15.675   3.147 -20.322
  158   3HB   ALA  20          HB3       ALA  20  14.920   1.578 -19.979
  159    H    GLU  21           H        GLU  21  14.007   5.050 -20.222
  160    HA   GLU  21           HA       GLU  21  12.178   4.710 -18.105
  161   1HB   GLU  21          HB2       GLU  21  13.832   6.546 -18.335
  162   2HB   GLU  21          HB3       GLU  21  12.810   7.288 -19.576
  163   1HG   GLU  21          HG2       GLU  21  10.966   7.205 -17.663
  164   2HG   GLU  21          HG3       GLU  21  12.357   6.992 -16.603
  165    H    GLY  22           H        GLY  22  11.546   5.728 -21.487
  166   1HA   GLY  22          HA1       GLY  22   8.818   6.451 -21.255
  167   2HA   GLY  22          HA2       GLY  22   9.628   5.786 -22.708
  168    H    TRP  23           H        TRP  23  10.272   3.272 -22.135
  169    HA   TRP  23           HA       TRP  23   7.764   1.860 -22.208
  170   1HB   TRP  23          HB2       TRP  23  10.639   0.947 -21.777
  171   2HB   TRP  23          HB3       TRP  23   9.278  -0.161 -21.829
  172    HD1  TRP  23           HD1      TRP  23  11.650   1.596 -24.080
  173    HE1  TRP  23           HE1      TRP  23  11.079   1.178 -26.516
  174    HE3  TRP  23           HE3      TRP  23   7.018  -0.473 -23.450
  175    HZ2  TRP  23           HZ2      TRP  23   8.838   0.060 -28.050
  176    HZ3  TRP  23           HZ3      TRP  23   5.737  -1.306 -25.397
  177    HH2  TRP  23           HH2      TRP  23   6.651  -1.077 -27.690
  178    H    ALA  24           H        ALA  24  10.159   2.419 -19.624
  179    HA   ALA  24           HA       ALA  24   9.036   0.586 -17.812
  180   1HB   ALA  24          HB1       ALA  24  10.528   1.671 -16.186
  181   2HB   ALA  24          HB2       ALA  24  11.351   1.436 -17.728
  182   3HB   ALA  24          HB3       ALA  24  10.744   3.046 -17.315
  183    H    LYS  25           H        LYS  25   8.426   4.159 -18.110
  184    HA   LYS  25           HA       LYS  25   6.619   4.300 -15.930
  185   1HB   LYS  25          HB2       LYS  25   6.665   5.811 -18.575
  186   2HB   LYS  25          HB3       LYS  25   5.430   6.105 -17.325
  187   1HG   LYS  25          HG2       LYS  25   7.085   6.622 -15.668
  188   2HG   LYS  25          HG3       LYS  25   8.408   6.267 -16.801
  189   1HD   LYS  25          HD2       LYS  25   6.406   8.533 -17.178
  190   2HD   LYS  25          HD3       LYS  25   7.979   8.677 -16.368
  191   1HE   LYS  25          HE2       LYS  25   8.885   7.508 -18.570
  192   2HE   LYS  25          HE3       LYS  25   7.397   8.138 -19.287
  193   1HZ   LYS  25          HZ1       LYS  25   9.501   9.722 -17.901
  194   2HZ   LYS  25          HZ2       LYS  25   9.303   9.599 -19.484
  195   3HZ   LYS  25          HZ3       LYS  25   8.133  10.378 -18.634
  196    H    GLN  26           H        GLN  26   6.115   3.019 -19.173
  197    HA   GLN  26           HA       GLN  26   3.260   2.812 -18.866
  198   1HB   GLN  26          HB2       GLN  26   4.815   0.955 -20.687
  199   2HB   GLN  26          HB3       GLN  26   3.136   1.451 -20.781
  200   1HG   GLN  26          HG2       GLN  26   5.610   2.945 -21.553
  201   2HG   GLN  26          HG3       GLN  26   4.184   2.595 -22.504
  202   1HE2  GLN  26          HE22      GLN  26   5.807   5.075 -21.022
  203   2HE2  GLN  26          HE21      GLN  26   4.472   6.193 -20.768
  204    H    TYR  27           H        TYR  27   5.808   0.303 -18.658
  205    HA   TYR  27           HA       TYR  27   3.894  -1.697 -17.851
  206   1HB   TYR  27          HB2       TYR  27   6.933  -1.742 -17.757
  207   2HB   TYR  27          HB3       TYR  27   5.883  -3.127 -17.510
  208    HD1  TYR  27           HD1      TYR  27   4.041  -3.484 -19.484
  209    HD2  TYR  27           HD2      TYR  27   7.908  -1.620 -19.880
  210    HE1  TYR  27           HE1      TYR  27   4.089  -4.099 -21.882
  211    HE2  TYR  27           HE2      TYR  27   8.019  -2.329 -22.246
  212    HH   TYR  27           HH       TYR  27   6.886  -3.366 -24.006
  213    H    LEU  28           H        LEU  28   6.397   0.150 -16.029
  214    HA   LEU  28           HA       LEU  28   5.997  -1.351 -13.573
  215   1HB   LEU  28          HB2       LEU  28   7.261   1.397 -14.027
  216   2HB   LEU  28          HB3       LEU  28   7.398   0.433 -12.601
  217    HG   LEU  28           HG       LEU  28   8.570  -0.305 -15.297
  218   1HD1  LEU  28          HD11      LEU  28   9.903   0.511 -12.679
  219   2HD1  LEU  28          HD12      LEU  28  10.709   0.163 -14.225
  220   3HD1  LEU  28          HD13      LEU  28   9.656   1.586 -14.068
  221   1HD2  LEU  28          HD21      LEU  28   7.936  -2.348 -14.053
  222   2HD2  LEU  28          HD22      LEU  28   9.683  -2.152 -14.125
  223   3HD2  LEU  28          HD23      LEU  28   8.814  -1.754 -12.625
  224    H    GLY  29           H        GLY  29   4.923   1.764 -14.852
  225   1HA   GLY  29          HA1       GLY  29   3.072   3.059 -14.291
  226   2HA   GLY  29          HA2       GLY  29   2.771   2.049 -12.860
  227    H    ASP  30           H        ASP  30   2.818   4.687 -12.428
  228    HA   ASP  30           HA       ASP  30   5.354   5.766 -11.676
  229   1HB   ASP  30          HB2       ASP  30   3.328   7.127 -12.140
  230   2HB   ASP  30          HB3       ASP  30   2.555   6.463 -10.698
  231    H    GLU  31           H        GLU  31   3.846   3.107 -10.480
  232    HA   GLU  31           HA       GLU  31   4.161   3.235  -7.638
  233   1HB   GLU  31          HB2       GLU  31   4.264   0.931  -9.613
  234   2HB   GLU  31          HB3       GLU  31   4.325   0.713  -7.867
  235   1HG   GLU  31          HG2       GLU  31   2.047   2.059  -9.362
  236   2HG   GLU  31          HG3       GLU  31   2.086   0.358  -8.897
  237    H    TRP  32           H        TRP  32   6.381   3.354 -10.211
  238    HA   TRP  32           HA       TRP  32   8.691   2.973  -8.419
  239   1HB   TRP  32          HB2       TRP  32   8.575   2.259 -11.376
  240   2HB   TRP  32          HB3       TRP  32   9.947   2.074 -10.298
  241    HD1  TRP  32           HD1      TRP  32   6.300   0.731 -10.438
  242    HE1  TRP  32           HE1      TRP  32   6.290  -1.768  -9.924
  243    HE3  TRP  32           HE3      TRP  32  11.332   0.035  -9.732
  244    HZ2  TRP  32           HZ2      TRP  32   8.208  -3.830  -9.394
  245    HZ3  TRP  32           HZ3      TRP  32  12.216  -2.235  -9.281
  246    HH2  TRP  32           HH2      TRP  32  10.673  -4.182  -9.131
  247    H    LYS  33           H        LYS  33   9.426   5.072  -8.208
  248    HA   LYS  33           HA       LYS  33   8.840   7.212 -10.046
  249   1HB   LYS  33          HB2       LYS  33  10.905   6.950  -7.805
  250   2HB   LYS  33          HB3       LYS  33  10.559   8.439  -8.687
  251   1HG   LYS  33          HG2       LYS  33   8.818   6.947  -6.726
  252   2HG   LYS  33          HG3       LYS  33   9.458   8.571  -6.588
  253   1HD   LYS  33          HD2       LYS  33   7.238   7.658  -8.469
  254   2HD   LYS  33          HD3       LYS  33   7.058   8.616  -7.000
  255   1HE   LYS  33          HE2       LYS  33   8.380  10.458  -8.001
  256   2HE   LYS  33          HE3       LYS  33   8.604   9.509  -9.477
  257   1HZ   LYS  33          HZ1       LYS  33   6.792  11.046  -9.749
  258   2HZ   LYS  33          HZ2       LYS  33   6.181   9.521  -9.768
  259   3HZ   LYS  33          HZ3       LYS  33   6.005  10.470  -8.441
  260    H    VAL  34           H        VAL  34   9.550   6.825 -12.089
  261    HA   VAL  34           HA       VAL  34  12.167   5.574 -12.441
  262    HB   VAL  34           HB       VAL  34  10.392   4.257 -13.153
  263   1HG1  VAL  34          HG11      VAL  34   8.743   4.878 -14.906
  264   2HG1  VAL  34          HG12      VAL  34   8.501   5.731 -13.384
  265   3HG1  VAL  34          HG13      VAL  34   9.282   6.575 -14.731
  266   1HG2  VAL  34          HG21      VAL  34  12.414   4.712 -14.802
  267   2HG2  VAL  34          HG22      VAL  34  11.034   3.674 -15.211
  268   3HG2  VAL  34          HG23      VAL  34  11.110   5.315 -15.856
  269    H    TYR  35           H        TYR  35  13.793   6.475 -13.521
  270    HA   TYR  35           HA       TYR  35  13.456   9.115 -14.846
  271   1HB   TYR  35          HB2       TYR  35  15.470   8.427 -12.659
  272   2HB   TYR  35          HB3       TYR  35  15.363   9.952 -13.517
  273    HD1  TYR  35           HD1      TYR  35  14.312   8.123 -10.616
  274    HD2  TYR  35           HD2      TYR  35  13.176  11.346 -13.252
  275    HE1  TYR  35           HE1      TYR  35  12.907   9.084  -8.825
  276    HE2  TYR  35           HE2      TYR  35  11.721  12.286 -11.480
  277    HH   TYR  35           HH       TYR  35  11.469  10.820  -8.208
  278    H    SER  36           H        SER  36  15.533   9.719 -15.989
  279    HA   SER  36           HA       SER  36  17.404   7.508 -16.438
  280   1HB   SER  36          HB2       SER  36  17.367   7.972 -18.872
  281   2HB   SER  36          HB3       SER  36  15.866   7.270 -18.273
  282    HG   SER  36           HG       SER  36  14.907   9.295 -18.375
  283    H    ALA  37           H        ALA  37  19.503   8.214 -17.109
  284    HA   ALA  37           HA       ALA  37  20.090  11.017 -17.503
  285   1HB   ALA  37          HB1       ALA  37  21.077   9.709 -14.930
  286   2HB   ALA  37          HB2       ALA  37  21.540  11.309 -15.550
  287   3HB   ALA  37          HB3       ALA  37  19.888  11.025 -15.046
  288    H    GLY  38           H        GLY  38  22.848  10.961 -17.037
  289   1HA   GLY  38          HA1       GLY  38  24.196   8.571 -17.688
  290   2HA   GLY  38          HA2       GLY  38  23.904   9.483 -19.187
  291    H    ILE  39           H        ILE  39  26.392   9.230 -18.860
  292    HA   ILE  39           HA       ILE  39  27.899  10.868 -17.163
  293    HB   ILE  39           HB       ILE  39  28.201   9.676 -19.949
  294   1HG1  ILE  39          HG12      ILE  39  29.501   9.048 -17.258
  295   2HG1  ILE  39          HG13      ILE  39  28.173   8.165 -18.019
  296   1HG2  ILE  39          HG21      ILE  39  29.567  11.655 -20.073
  297   2HG2  ILE  39          HG22      ILE  39  30.383  11.231 -18.540
  298   3HG2  ILE  39          HG23      ILE  39  30.581  10.234 -20.005
  299   1HD1  ILE  39          HD11      ILE  39  30.173   6.905 -18.362
  300   2HD1  ILE  39          HD12      ILE  39  29.681   7.588 -19.925
  301   3HD1  ILE  39          HD13      ILE  39  31.038   8.296 -19.008
  302    H    GLU  40           H        GLU  40  25.959  11.696 -19.989
  303    HA   GLU  40           HA       GLU  40  26.339  14.487 -19.476
  304   1HB   GLU  40          HB2       GLU  40  26.800  15.099 -21.799
  305   2HB   GLU  40          HB3       GLU  40  28.147  14.248 -21.051
  306   1HG   GLU  40          HG2       GLU  40  27.677  12.209 -22.253
  307   2HG   GLU  40          HG3       GLU  40  26.102  12.810 -22.788
  308    H    ALA  41           H        ALA  41  24.739  15.721 -20.861
  309    HA   ALA  41           HA       ALA  41  22.596  14.179 -22.106
  310   1HB   ALA  41          HB1       ALA  41  20.889  15.550 -20.831
  311   2HB   ALA  41          HB2       ALA  41  21.746  14.360 -19.825
  312   3HB   ALA  41          HB3       ALA  41  22.178  16.085 -19.745
  313    H    HIS  42           H        HIS  42  22.068  15.267 -23.925
  314    HA   HIS  42           HA       HIS  42  22.447  18.205 -24.068
  315   1HB   HIS  42          HB2       HIS  42  23.550  16.124 -26.001
  316   2HB   HIS  42          HB3       HIS  42  23.305  17.811 -26.450
  317    HD1  HIS  42           HD1      HIS  42  25.983  15.707 -24.849
  318    HD2  HIS  42           HD2      HIS  42  24.590  19.700 -24.793
  319    HE1  HIS  42           HE1      HIS  42  27.829  17.100 -23.842
  320    H    GLY  43           H        GLY  43  20.199  16.176 -23.669
  321   1HA   GLY  43          HA1       GLY  43  17.917  16.605 -24.159
  322   2HA   GLY  43          HA2       GLY  43  18.353  17.280 -25.735
  323    H    LEU  44           H        LEU  44  16.422  15.366 -25.606
  324    HA   LEU  44           HA       LEU  44  17.622  12.758 -26.125
  325   1HB   LEU  44          HB2       LEU  44  15.469  11.849 -26.081
  326   2HB   LEU  44          HB3       LEU  44  15.600  12.960 -24.723
  327    HG   LEU  44           HG       LEU  44  14.100  13.428 -27.340
  328   1HD1  LEU  44          HD11      LEU  44  13.117  11.794 -25.760
  329   2HD1  LEU  44          HD12      LEU  44  13.157  12.999 -24.467
  330   3HD1  LEU  44          HD13      LEU  44  12.113  13.253 -25.876
  331   1HD2  LEU  44          HD21      LEU  44  13.091  15.419 -26.172
  332   2HD2  LEU  44          HD22      LEU  44  14.316  15.256 -24.899
  333   3HD2  LEU  44          HD23      LEU  44  14.784  15.641 -26.582
  334    H    ASN  45           H        ASN  45  17.363  11.583 -28.041
  335    HA   ASN  45           HA       ASN  45  17.909  13.200 -30.357
  336   1HB   ASN  45          HB2       ASN  45  18.976  11.016 -29.734
  337   2HB   ASN  45          HB3       ASN  45  17.471  10.190 -30.123
  338   1HD2  ASN  45          HD22      ASN  45  20.425  10.646 -31.340
  339   2HD2  ASN  45          HD21      ASN  45  20.069  10.726 -33.052
  340    HA   PRO  46           HA       PRO  46  13.624  13.516 -31.820
  341   1HB   PRO  46          HB2       PRO  46  15.001  13.484 -34.515
  342   2HB   PRO  46          HB3       PRO  46  13.656  14.526 -33.951
  343   1HG   PRO  46          HG2       PRO  46  16.189  15.486 -34.000
  344   2HG   PRO  46          HG3       PRO  46  15.136  15.817 -32.586
  345   1HD   PRO  46          HD2       PRO  46  17.325  13.753 -32.856
  346   2HD   PRO  46          HD3       PRO  46  16.934  14.824 -31.474
  347    H    ASN  47           H        ASN  47  15.899  11.088 -33.178
  348    HA   ASN  47           HA       ASN  47  13.761   9.473 -34.344
  349   1HB   ASN  47          HB2       ASN  47  16.702   8.957 -33.818
  350   2HB   ASN  47          HB3       ASN  47  15.615   7.714 -34.420
  351   1HD2  ASN  47          HD22      ASN  47  17.995   8.920 -35.749
  352   2HD2  ASN  47          HD21      ASN  47  17.391   9.510 -37.275
  353    H    ALA  48           H        ALA  48  15.308   9.746 -31.174
  354    HA   ALA  48           HA       ALA  48  14.363   7.224 -30.159
  355   1HB   ALA  48          HB1       ALA  48  14.883   8.100 -27.976
  356   2HB   ALA  48          HB2       ALA  48  16.180   8.647 -29.054
  357   3HB   ALA  48          HB3       ALA  48  14.908   9.768 -28.552
  358    H    VAL  49           H        VAL  49  13.168  10.624 -30.106
  359    HA   VAL  49           HA       VAL  49  10.696  10.122 -28.853
  360    HB   VAL  49           HB       VAL  49  11.360  12.239 -30.953
  361   1HG1  VAL  49          HG11      VAL  49   9.116  12.126 -28.891
  362   2HG1  VAL  49          HG12      VAL  49   9.559  13.564 -29.832
  363   3HG1  VAL  49          HG13      VAL  49   8.950  12.135 -30.666
  364   1HG2  VAL  49          HG21      VAL  49  11.502  12.355 -27.920
  365   2HG2  VAL  49          HG22      VAL  49  12.898  12.345 -29.021
  366   3HG2  VAL  49          HG23      VAL  49  11.788  13.714 -29.023
  367    H    LYS  50           H        LYS  50  11.475  10.134 -32.397
  368    HA   LYS  50           HA       LYS  50   8.908   9.393 -33.282
  369   1HB   LYS  50          HB2       LYS  50  10.841  10.235 -34.677
  370   2HB   LYS  50          HB3       LYS  50  11.571   8.627 -34.549
  371   1HG   LYS  50          HG2       LYS  50   9.472   7.678 -35.610
  372   2HG   LYS  50          HG3       LYS  50   8.886   9.331 -35.823
  373   1HD   LYS  50          HD2       LYS  50  10.787   9.860 -37.280
  374   2HD   LYS  50          HD3       LYS  50  11.513   8.269 -36.965
  375   1HE   LYS  50          HE2       LYS  50   9.509   7.166 -37.948
  376   2HE   LYS  50          HE3       LYS  50   8.815   8.752 -38.307
  377   1HZ   LYS  50          HZ1       LYS  50   9.921   7.822 -40.236
  378   2HZ   LYS  50          HZ2       LYS  50  10.706   9.172 -39.775
  379   3HZ   LYS  50          HZ3       LYS  50  11.343   7.700 -39.448
  380    H    ALA  51           H        ALA  51  11.666   7.257 -32.315
  381    HA   ALA  51           HA       ALA  51  10.451   4.806 -32.971
  382   1HB   ALA  51          HB1       ALA  51  12.846   5.086 -32.381
  383   2HB   ALA  51          HB2       ALA  51  12.398   5.394 -30.692
  384   3HB   ALA  51          HB3       ALA  51  12.066   3.812 -31.427
  385    H    MET  52           H        MET  52  10.258   6.729 -29.909
  386    HA   MET  52           HA       MET  52   8.564   4.779 -28.633
  387   1HB   MET  52          HB2       MET  52   8.960   7.734 -28.013
  388   2HB   MET  52          HB3       MET  52   8.127   6.573 -26.985
  389   1HG   MET  52          HG2       MET  52  11.063   6.683 -27.684
  390   2HG   MET  52          HG3       MET  52  10.306   6.774 -26.110
  391   1HE   MET  52          HE1       MET  52   8.258   4.120 -26.480
  392   2HE   MET  52          HE2       MET  52   9.236   3.105 -25.415
  393   3HE   MET  52          HE3       MET  52   9.040   4.815 -25.026
  394    H    LYS  53           H        LYS  53   7.822   7.705 -30.607
  395    HA   LYS  53           HA       LYS  53   5.008   7.496 -30.237
  396   1HB   LYS  53          HB2       LYS  53   6.800   8.821 -32.246
  397   2HB   LYS  53          HB3       LYS  53   5.140   8.497 -32.736
  398   1HG   LYS  53          HG2       LYS  53   5.110  10.682 -31.815
  399   2HG   LYS  53          HG3       LYS  53   4.301   9.612 -30.664
  400   1HD   LYS  53          HD2       LYS  53   6.564   9.506 -29.415
  401   2HD   LYS  53          HD3       LYS  53   7.086  10.828 -30.453
  402   1HE   LYS  53          HE2       LYS  53   4.641  10.822 -28.630
  403   2HE   LYS  53          HE3       LYS  53   6.214  11.495 -28.193
  404   1HZ   LYS  53          HZ1       LYS  53   4.486  12.519 -30.368
  405   2HZ   LYS  53          HZ2       LYS  53   4.764  13.232 -28.930
  406   3HZ   LYS  53          HZ3       LYS  53   5.977  13.098 -30.002
  407    H    GLU  54           H        GLU  54   7.224   5.569 -32.212
  408    HA   GLU  54           HA       GLU  54   5.256   4.541 -33.986
  409   1HB   GLU  54          HB2       GLU  54   7.830   4.561 -34.211
  410   2HB   GLU  54          HB3       GLU  54   7.812   3.133 -33.174
  411   1HG   GLU  54          HG2       GLU  54   7.946   2.447 -35.474
  412   2HG   GLU  54          HG3       GLU  54   6.384   1.964 -34.840
  413    H    VAL  55           H        VAL  55   5.836   3.961 -30.621
  414    HA   VAL  55           HA       VAL  55   4.075   1.544 -30.718
  415    HB   VAL  55           HB       VAL  55   5.159   0.899 -28.581
  416   1HG1  VAL  55          HG11      VAL  55   5.841  -0.055 -30.752
  417   2HG1  VAL  55          HG12      VAL  55   7.032   1.242 -30.965
  418   3HG1  VAL  55          HG13      VAL  55   7.217   0.066 -29.654
  419   1HG2  VAL  55          HG21      VAL  55   7.228   3.046 -29.218
  420   2HG2  VAL  55          HG22      VAL  55   5.987   3.207 -27.948
  421   3HG2  VAL  55          HG23      VAL  55   7.211   1.953 -27.836
  422    H    GLY  56           H        GLY  56   3.965   4.812 -30.042
  423   1HA   GLY  56          HA1       GLY  56   2.026   5.909 -29.404
  424   2HA   GLY  56          HA2       GLY  56   1.372   4.416 -28.709
  425    H    ILE  57           H        ILE  57   4.621   5.781 -28.057
  426    HA   ILE  57           HA       ILE  57   3.825   6.451 -25.269
  427    HB   ILE  57           HB       ILE  57   6.330   5.109 -26.355
  428   1HG1  ILE  57          HG12      ILE  57   4.346   4.207 -24.226
  429   2HG1  ILE  57          HG13      ILE  57   4.351   3.640 -25.891
  430   1HG2  ILE  57          HG21      ILE  57   5.860   6.303 -23.589
  431   2HG2  ILE  57          HG22      ILE  57   7.177   5.185 -23.953
  432   3HG2  ILE  57          HG23      ILE  57   7.131   6.741 -24.754
  433   1HD1  ILE  57          HD11      ILE  57   5.382   1.958 -24.551
  434   2HD1  ILE  57          HD12      ILE  57   6.627   2.679 -25.574
  435   3HD1  ILE  57          HD13      ILE  57   6.533   3.100 -23.850
  436    H    ASP  58           H        ASP  58   5.232   8.199 -24.447
  437    HA   ASP  58           HA       ASP  58   6.462   9.907 -26.529
  438   1HB   ASP  58          HB2       ASP  58   4.358  11.034 -26.058
  439   2HB   ASP  58          HB3       ASP  58   4.602  10.854 -24.308
  440    H    ILE  59           H        ILE  59   8.313  10.862 -25.854
  441    HA   ILE  59           HA       ILE  59   9.138  10.614 -23.036
  442    HB   ILE  59           HB       ILE  59  11.489  10.126 -23.782
  443   1HG1  ILE  59          HG12      ILE  59  10.227   9.242 -26.416
  444   2HG1  ILE  59          HG13      ILE  59  11.097  10.758 -26.220
  445   1HG2  ILE  59          HG21      ILE  59  11.111   7.725 -23.869
  446   2HG2  ILE  59          HG22      ILE  59   9.912   8.449 -22.801
  447   3HG2  ILE  59          HG23      ILE  59   9.438   7.962 -24.429
  448   1HD1  ILE  59          HD11      ILE  59  12.280   7.973 -25.796
  449   2HD1  ILE  59          HD12      ILE  59  12.582   9.071 -27.148
  450   3HD1  ILE  59          HD13      ILE  59  13.132   9.503 -25.528
  451    H    SER  60           H        SER  60   8.250  12.699 -25.406
  452    HA   SER  60           HA       SER  60  10.242  14.741 -25.238
  453   1HB   SER  60          HB2       SER  60   7.268  15.249 -25.475
  454   2HB   SER  60          HB3       SER  60   8.612  16.178 -26.160
  455    HG   SER  60           HG       SER  60   7.521  13.688 -26.896
  456    H    ASN  61           H        ASN  61   7.655  13.681 -23.113
  457    HA   ASN  61           HA       ASN  61   7.594  15.800 -21.252
  458   1HB   ASN  61          HB2       ASN  61   6.448  14.217 -19.791
  459   2HB   ASN  61          HB3       ASN  61   5.865  14.044 -21.436
  460   1HD2  ASN  61          HD22      ASN  61   6.366  12.137 -22.616
  461   2HD2  ASN  61          HD21      ASN  61   6.984  10.688 -21.854
  462    H    GLN  62           H        GLN  62  10.376  13.877 -21.752
  463    HA   GLN  62           HA       GLN  62  11.218  14.209 -18.919
  464   1HB   GLN  62          HB2       GLN  62  12.220  11.890 -19.053
  465   2HB   GLN  62          HB3       GLN  62  10.456  11.945 -18.994
  466   1HG   GLN  62          HG2       GLN  62  10.234  11.478 -21.306
  467   2HG   GLN  62          HG3       GLN  62  11.945  11.813 -21.619
  468   1HE2  GLN  62          HE21      GLN  62  13.374  10.206 -21.604
  469   2HE2  GLN  62          HE22      GLN  62  12.930   8.515 -21.294
  470    H    THR  63           H        THR  63  11.929  16.079 -20.627
  471    HA   THR  63           HA       THR  63  14.104  15.806 -22.295
  472    HB   THR  63           HB       THR  63  14.567  18.242 -21.491
  473    HG1  THR  63           HG1      THR  63  13.541  18.079 -19.457
  474   1HG2  THR  63          HG21      THR  63  12.549  19.065 -22.640
  475   2HG2  THR  63          HG22      THR  63  13.206  17.655 -23.488
  476   3HG2  THR  63          HG23      THR  63  11.773  17.476 -22.453
  477    H    SER  64           H        SER  64  16.246  15.470 -22.131
  478    HA   SER  64           HA       SER  64  17.173  13.991 -20.129
  479   1HB   SER  64          HB2       SER  64  18.849  15.655 -22.038
  480   2HB   SER  64          HB3       SER  64  19.249  14.063 -21.374
  481    HG   SER  64           HG       SER  64  18.259  13.250 -22.973
  482    H    ASP  65           H        ASP  65  18.932  14.078 -18.724
  483    HA   ASP  65           HA       ASP  65  20.142  16.603 -17.943
  484   1HB   ASP  65          HB2       ASP  65  18.006  16.561 -16.601
  485   2HB   ASP  65          HB3       ASP  65  18.525  15.032 -15.889
  486    H    ILE  66           H        ILE  66  21.926  16.214 -16.437
  487    HA   ILE  66           HA       ILE  66  23.290  13.656 -16.892
  488    HB   ILE  66           HB       ILE  66  24.935  14.940 -15.204
  489   1HG1  ILE  66          HG12      ILE  66  23.342  16.974 -15.057
  490   2HG1  ILE  66          HG13      ILE  66  25.066  17.205 -15.254
  491   1HG2  ILE  66          HG21      ILE  66  24.697  15.401 -18.175
  492   2HG2  ILE  66          HG22      ILE  66  26.156  15.705 -17.191
  493   3HG2  ILE  66          HG23      ILE  66  25.517  14.063 -17.336
  494   1HD1  ILE  66          HD11      ILE  66  23.095  17.418 -17.573
  495   2HD1  ILE  66          HD12      ILE  66  23.769  18.772 -16.650
  496   3HD1  ILE  66          HD13      ILE  66  24.834  17.749 -17.625
  497    H    ILE  67           H        ILE  67  24.311  12.616 -14.995
  498    HA   ILE  67           HA       ILE  67  22.386  11.615 -13.199
  499    HB   ILE  67           HB       ILE  67  25.417  11.489 -13.392
  500   1HG1  ILE  67          HG12      ILE  67  23.283   9.340 -13.750
  501   2HG1  ILE  67          HG13      ILE  67  23.808  10.363 -15.074
  502   1HG2  ILE  67          HG21      ILE  67  23.683   9.916 -11.441
  503   2HG2  ILE  67          HG22      ILE  67  25.408   9.634 -11.763
  504   3HG2  ILE  67          HG23      ILE  67  24.912  11.129 -10.993
  505   1HD1  ILE  67          HD11      ILE  67  24.972   8.301 -15.253
  506   2HD1  ILE  67          HD12      ILE  67  26.147   9.546 -14.782
  507   3HD1  ILE  67          HD13      ILE  67  25.542   8.377 -13.579
  508    H    ASP  68           H        ASP  68  22.337  11.738 -10.922
  509    HA   ASP  68           HA       ASP  68  23.551  13.960  -9.498
  510   1HB   ASP  68          HB2       ASP  68  21.456  14.940 -10.543
  511   2HB   ASP  68          HB3       ASP  68  20.513  13.747  -9.640
  512    H    SER  69           H        SER  69  23.798  13.397  -7.362
  513    HA   SER  69           HA       SER  69  23.704  10.774  -6.549
  514   1HB   SER  69          HB2       SER  69  23.647  13.205  -4.743
  515   2HB   SER  69          HB3       SER  69  24.377  11.624  -4.409
  516    HG   SER  69           HG       SER  69  25.926  13.189  -5.078
  517    H    ASP  70           H        ASP  70  21.086  13.117  -6.413
  518    HA   ASP  70           HA       ASP  70  19.761  12.059  -4.098
  519   1HB   ASP  70          HB2       ASP  70  19.538  14.395  -4.892
  520   2HB   ASP  70          HB3       ASP  70  18.695  13.816  -6.336
  521    H    ILE  71           H        ILE  71  19.955  10.942  -7.313
  522    HA   ILE  71           HA       ILE  71  17.555   9.212  -6.956
  523    HB   ILE  71           HB       ILE  71  18.896  10.080  -9.523
  524   1HG1  ILE  71          HG12      ILE  71  16.031  10.811  -8.872
  525   2HG1  ILE  71          HG13      ILE  71  17.297  11.793  -8.154
  526   1HG2  ILE  71          HG21      ILE  71  16.374   8.426  -9.004
  527   2HG2  ILE  71          HG22      ILE  71  16.974   8.928 -10.606
  528   3HG2  ILE  71          HG23      ILE  71  17.920   7.816  -9.610
  529   1HD1  ILE  71          HD11      ILE  71  18.278  12.290 -10.307
  530   2HD1  ILE  71          HD12      ILE  71  17.064  11.271 -11.133
  531   3HD1  ILE  71          HD13      ILE  71  16.563  12.746 -10.276
  532    H    LEU  72           H        LEU  72  21.013   9.408  -8.007
  533    HA   LEU  72           HA       LEU  72  21.584   6.728  -8.439
  534   1HB   LEU  72          HB2       LEU  72  23.209   8.774  -6.882
  535   2HB   LEU  72          HB3       LEU  72  23.803   7.165  -7.194
  536    HG   LEU  72           HG       LEU  72  23.175   9.218  -9.315
  537   1HD1  LEU  72          HD11      LEU  72  25.767   8.125  -8.113
  538   2HD1  LEU  72          HD12      LEU  72  25.702   9.185  -9.526
  539   3HD1  LEU  72          HD13      LEU  72  25.132   9.776  -7.963
  540   1HD2  LEU  72          HD21      LEU  72  24.375   7.571 -10.828
  541   2HD2  LEU  72          HD22      LEU  72  24.321   6.386  -9.513
  542   3HD2  LEU  72          HD23      LEU  72  22.819   6.979 -10.251
  543    H    ASN  73           H        ASN  73  21.934   8.264  -5.218
  544    HA   ASN  73           HA       ASN  73  22.304   5.705  -3.976
  545   1HB   ASN  73          HB2       ASN  73  22.965   6.831  -2.122
  546   2HB   ASN  73          HB3       ASN  73  23.185   8.133  -3.276
  547   1HD2  ASN  73          HD22      ASN  73  21.122   9.666  -3.481
  548   2HD2  ASN  73          HD21      ASN  73  20.267   9.971  -1.986
  549    H    ASN  74           H        ASN  74  19.489   6.957  -5.057
  550    HA   ASN  74           HA       ASN  74  17.796   6.220  -2.710
  551   1HB   ASN  74          HB2       ASN  74  17.900   8.585  -3.460
  552   2HB   ASN  74          HB3       ASN  74  17.435   8.084  -5.080
  553   1HD2  ASN  74          HD22      ASN  74  15.905   9.864  -4.600
  554   2HD2  ASN  74          HD21      ASN  74  14.352   9.424  -3.904
  555    H    ALA  75           H        ALA  75  18.344   5.775  -6.181
  556    HA   ALA  75           HA       ALA  75  15.994   4.392  -6.866
  557   1HB   ALA  75          HB1       ALA  75  18.742   4.315  -8.112
  558   2HB   ALA  75          HB2       ALA  75  17.222   3.745  -8.859
  559   3HB   ALA  75          HB3       ALA  75  17.433   5.459  -8.483
  560    H    ASP  76           H        ASP  76  15.266   2.479  -6.381
  561    HA   ASP  76           HA       ASP  76  16.640   0.646  -4.664
  562   1HB   ASP  76          HB2       ASP  76  14.191   0.950  -4.666
  563   2HB   ASP  76          HB3       ASP  76  14.111   0.361  -6.331
  564    H    LEU  77           H        LEU  77  16.440   1.086  -8.117
  565    HA   LEU  77           HA       LEU  77  18.436  -1.029  -8.489
  566   1HB   LEU  77          HB2       LEU  77  16.351  -2.204  -9.076
  567   2HB   LEU  77          HB3       LEU  77  15.846  -0.853 -10.094
  568    HG   LEU  77           HG       LEU  77  17.765  -1.285 -11.629
  569   1HD1  LEU  77          HD11      LEU  77  19.343  -2.391 -10.066
  570   2HD1  LEU  77          HD12      LEU  77  18.229  -3.769  -9.917
  571   3HD1  LEU  77          HD13      LEU  77  19.018  -3.399 -11.466
  572   1HD2  LEU  77          HD21      LEU  77  15.577  -2.263 -12.095
  573   2HD2  LEU  77          HD22      LEU  77  16.871  -3.342 -12.625
  574   3HD2  LEU  77          HD23      LEU  77  15.986  -3.695 -11.124
  575    H    VAL  78           H        VAL  78  19.976  -0.332  -9.902
  576    HA   VAL  78           HA       VAL  78  19.373   2.023 -11.633
  577    HB   VAL  78           HB       VAL  78  22.027   1.197 -10.366
  578   1HG1  VAL  78          HG11      VAL  78  22.814   3.399 -11.312
  579   2HG1  VAL  78          HG12      VAL  78  22.430   2.207 -12.557
  580   3HG1  VAL  78          HG13      VAL  78  21.290   3.526 -12.207
  581   1HG2  VAL  78          HG21      VAL  78  20.212   3.594  -9.821
  582   2HG2  VAL  78          HG22      VAL  78  20.559   2.265  -8.694
  583   3HG2  VAL  78          HG23      VAL  78  21.843   3.381  -9.157
  584    H    VAL  79           H        VAL  79  19.954   1.718 -13.829
  585    HA   VAL  79           HA       VAL  79  20.964  -0.990 -14.576
  586    HB   VAL  79           HB       VAL  79  18.786   0.566 -16.005
  587   1HG1  VAL  79          HG11      VAL  79  20.070  -1.085 -17.371
  588   2HG1  VAL  79          HG12      VAL  79  19.633  -2.355 -16.219
  589   3HG1  VAL  79          HG13      VAL  79  18.377  -1.552 -17.179
  590   1HG2  VAL  79          HG21      VAL  79  17.756  -0.029 -13.907
  591   2HG2  VAL  79          HG22      VAL  79  17.157  -1.134 -15.140
  592   3HG2  VAL  79          HG23      VAL  79  18.398  -1.683 -13.998
  593    H    THR  80           H        THR  80  22.787  -0.751 -15.799
  594    HA   THR  80           HA       THR  80  23.173   1.841 -17.239
  595    HB   THR  80           HB       THR  80  25.562   0.787 -17.483
  596    HG1  THR  80           HG1      THR  80  24.918  -1.175 -16.315
  597   1HG2  THR  80          HG21      THR  80  24.531   2.024 -14.902
  598   2HG2  THR  80          HG22      THR  80  26.230   2.005 -15.439
  599   3HG2  THR  80          HG23      THR  80  25.028   2.879 -16.387
  600    H    LEU  81           H        LEU  81  22.953   1.873 -19.353
  601    HA   LEU  81           HA       LEU  81  22.422  -0.716 -20.726
  602   1HB   LEU  81          HB2       LEU  81  21.617   2.107 -21.461
  603   2HB   LEU  81          HB3       LEU  81  21.284   0.682 -22.417
  604    HG   LEU  81           HG       LEU  81  19.853  -0.236 -20.612
  605   1HD1  LEU  81          HD11      LEU  81  20.606   0.848 -18.571
  606   2HD1  LEU  81          HD12      LEU  81  20.360   2.468 -19.272
  607   3HD1  LEU  81          HD13      LEU  81  18.987   1.419 -18.885
  608   1HD2  LEU  81          HD21      LEU  81  18.802   1.048 -22.421
  609   2HD2  LEU  81          HD22      LEU  81  17.958   1.325 -20.905
  610   3HD2  LEU  81          HD23      LEU  81  19.065   2.559 -21.515
  611    H    CYS  82           H        CYS  82  25.130   0.301 -20.136
  612    HA   CYS  82           HA       CYS  82  26.237   1.523 -22.486
  613   1HB   CYS  82          HB2       CYS  82  28.328   1.405 -21.235
  614   2HB   CYS  82          HB3       CYS  82  27.019   2.121 -20.305
  615    H    GLY  83           H        GLY  83  26.316   0.260 -24.342
  616   1HA   GLY  83          HA1       GLY  83  28.232  -1.932 -24.312
  617   2HA   GLY  83          HA2       GLY  83  26.595  -2.406 -24.783
  618    H    ASP  84           H        ASP  84  27.844   0.815 -25.342
  619    HA   ASP  84           HA       ASP  84  27.553   0.553 -28.255
  620   1HB   ASP  84          HB2       ASP  84  26.885   2.876 -28.133
  621   2HB   ASP  84          HB3       ASP  84  26.057   2.047 -26.812
  622    H    ALA  85           H        ALA  85  28.668   2.629 -29.308
  623    HA   ALA  85           HA       ALA  85  31.325   1.871 -29.656
  624   1HB   ALA  85          HB1       ALA  85  30.042   4.570 -30.262
  625   2HB   ALA  85          HB2       ALA  85  31.531   3.934 -30.986
  626   3HB   ALA  85          HB3       ALA  85  29.983   3.130 -31.309
  627    H    ALA  86           H        ALA  86  30.043   4.224 -27.318
  628    HA   ALA  86           HA       ALA  86  32.733   5.243 -26.665
  629   1HB   ALA  86          HB1       ALA  86  30.781   6.768 -26.605
  630   2HB   ALA  86          HB2       ALA  86  30.032   5.764 -25.345
  631   3HB   ALA  86          HB3       ALA  86  31.552   6.617 -25.016
  632    H    ASP  87           H        ASP  87  30.126   3.395 -25.086
  633    HA   ASP  87           HA       ASP  87  30.005   2.161 -23.202
  634   1HB   ASP  87          HB2       ASP  87  30.900   0.580 -24.828
  635   2HB   ASP  87          HB3       ASP  87  32.550   0.942 -24.311
  636    H    LYS  88           H        LYS  88  31.459   4.716 -22.765
  637    HA   LYS  88           HA       LYS  88  33.554   4.368 -20.896
  638   1HB   LYS  88          HB2       LYS  88  31.519   6.614 -21.193
  639   2HB   LYS  88          HB3       LYS  88  32.929   6.682 -20.126
  640   1HG   LYS  88          HG2       LYS  88  34.457   6.453 -22.018
  641   2HG   LYS  88          HG3       LYS  88  33.116   6.179 -23.130
  642   1HD   LYS  88          HD2       LYS  88  33.887   8.417 -23.423
  643   2HD   LYS  88          HD3       LYS  88  32.266   8.464 -22.715
  644   1HE   LYS  88          HE2       LYS  88  33.237   8.911 -20.478
  645   2HE   LYS  88          HE3       LYS  88  34.870   8.743 -21.133
  646   1HZ   LYS  88          HZ1       LYS  88  32.950  10.861 -21.919
  647   2HZ   LYS  88          HZ2       LYS  88  34.228  11.059 -20.928
  648   3HZ   LYS  88          HZ3       LYS  88  34.471  10.699 -22.495
  649    H    CYS  89           H        CYS  89  30.075   4.237 -20.479
  650    HA   CYS  89           HA       CYS  89  28.685   3.596 -19.013
  651   1HB   CYS  89          HB2       CYS  89  30.192   1.536 -19.288
  652   2HB   CYS  89          HB3       CYS  89  30.670   1.854 -17.616
  653    HA   PRO  90           HA       PRO  90  29.355   6.649 -15.769
  654   1HB   PRO  90          HB2       PRO  90  26.783   6.537 -14.686
  655   2HB   PRO  90          HB3       PRO  90  27.359   7.618 -15.988
  656   1HG   PRO  90          HG2       PRO  90  25.861   5.029 -16.181
  657   2HG   PRO  90          HG3       PRO  90  25.699   6.493 -17.215
  658   1HD   PRO  90          HD2       PRO  90  27.002   4.242 -17.995
  659   2HD   PRO  90          HD3       PRO  90  27.545   5.869 -18.515
  660    H    MET  91           H        MET  91  29.797   6.552 -13.554
  661    HA   MET  91           HA       MET  91  29.939   4.002 -12.253
  662   1HB   MET  91          HB2       MET  91  30.435   6.827 -11.191
  663   2HB   MET  91          HB3       MET  91  30.845   5.320 -10.375
  664   1HG   MET  91          HG2       MET  91  32.862   6.010 -11.287
  665   2HG   MET  91          HG3       MET  91  32.311   4.746 -12.382
  666   1HE   MET  91          HE1       MET  91  34.702   6.657 -13.080
  667   2HE   MET  91          HE2       MET  91  34.067   5.431 -14.203
  668   3HE   MET  91          HE3       MET  91  34.329   7.097 -14.762
  669    H    THR  92           H        THR  92  28.866   3.433 -10.325
  670    HA   THR  92           HA       THR  92  26.401   4.871  -9.537
  671    HB   THR  92           HB       THR  92  25.542   2.513  -9.216
  672    HG1  THR  92           HG1      THR  92  27.417   1.333  -9.121
  673   1HG2  THR  92          HG21      THR  92  25.020   2.125 -11.536
  674   2HG2  THR  92          HG22      THR  92  25.150   3.880 -11.339
  675   3HG2  THR  92          HG23      THR  92  26.487   2.973 -12.073
  676    HA   PRO  93           HA       PRO  93  28.138   4.320  -5.432
  677   1HB   PRO  93          HB2       PRO  93  25.982   4.018  -3.775
  678   2HB   PRO  93          HB3       PRO  93  26.389   5.564  -4.580
  679   1HG   PRO  93          HG2       PRO  93  24.334   3.519  -5.370
  680   2HG   PRO  93          HG3       PRO  93  24.183   5.295  -5.372
  681   1HD   PRO  93          HD2       PRO  93  24.746   3.766  -7.613
  682   2HD   PRO  93          HD3       PRO  93  25.251   5.476  -7.440
  683    HA   PRO  94           HA       PRO  94  28.532  -0.041  -5.045
  684   1HB   PRO  94          HB2       PRO  94  29.466  -0.464  -2.516
  685   2HB   PRO  94          HB3       PRO  94  30.399   0.419  -3.763
  686   1HG   PRO  94          HG2       PRO  94  28.684   1.579  -1.550
  687   2HG   PRO  94          HG3       PRO  94  30.348   2.049  -2.025
  688   1HD   PRO  94          HD2       PRO  94  28.107   3.390  -2.891
  689   2HD   PRO  94          HD3       PRO  94  29.575   3.227  -3.908
  690    H    HIS  95           H        HIS  95  26.388   1.497  -2.680
  691    HA   HIS  95           HA       HIS  95  25.499  -0.907  -1.432
  692   1HB   HIS  95          HB2       HIS  95  25.502   1.348  -0.387
  693   2HB   HIS  95          HB3       HIS  95  24.250   1.873  -1.516
  694    HD1  HIS  95           HD1      HIS  95  24.675  -0.651   1.415
  695    HD2  HIS  95           HD2      HIS  95  21.755   1.395  -0.831
  696    HE1  HIS  95           HE1      HIS  95  22.449  -1.092   2.565
  697    H    VAL  96           H        VAL  96  24.274   0.899  -4.255
  698    HA   VAL  96           HA       VAL  96  21.631  -0.154  -4.033
  699    HB   VAL  96           HB       VAL  96  21.224   0.960  -6.157
  700   1HG1  VAL  96          HG11      VAL  96  21.024   2.156  -4.056
  701   2HG1  VAL  96          HG12      VAL  96  22.727   2.640  -4.115
  702   3HG1  VAL  96          HG13      VAL  96  21.581   3.220  -5.341
  703   1HG2  VAL  96          HG21      VAL  96  23.190   0.639  -7.433
  704   2HG2  VAL  96          HG22      VAL  96  22.953   2.373  -7.207
  705   3HG2  VAL  96          HG23      VAL  96  24.187   1.504  -6.261
  706    H    LYS  97           H        LYS  97  20.549  -1.487  -5.567
  707    HA   LYS  97           HA       LYS  97  22.076  -3.780  -6.557
  708   1HB   LYS  97          HB2       LYS  97  19.703  -3.928  -5.656
  709   2HB   LYS  97          HB3       LYS  97  19.163  -2.994  -7.061
  710   1HG   LYS  97          HG2       LYS  97  20.017  -4.781  -8.568
  711   2HG   LYS  97          HG3       LYS  97  20.579  -5.693  -7.155
  712   1HD   LYS  97          HD2       LYS  97  18.235  -5.873  -6.337
  713   2HD   LYS  97          HD3       LYS  97  17.683  -4.897  -7.699
  714   1HE   LYS  97          HE2       LYS  97  17.211  -7.175  -8.233
  715   2HE   LYS  97          HE3       LYS  97  18.525  -6.642  -9.283
  716   1HZ   LYS  97          HZ1       LYS  97  20.072  -7.826  -7.819
  717   2HZ   LYS  97          HZ2       LYS  97  18.850  -8.286  -6.832
  718   3HZ   LYS  97          HZ3       LYS  97  18.922  -8.843  -8.357
  719    H    ARG  98           H        ARG  98  22.604  -4.059  -8.754
  720    HA   ARG  98           HA       ARG  98  21.928  -1.866 -10.606
  721   1HB   ARG  98          HB2       ARG  98  24.127  -1.358  -9.669
  722   2HB   ARG  98          HB3       ARG  98  24.732  -2.945 -10.170
  723   1HG   ARG  98          HG2       ARG  98  24.479  -2.369 -12.522
  724   2HG   ARG  98          HG3       ARG  98  23.641  -0.852 -12.114
  725   1HD   ARG  98          HD2       ARG  98  25.649   0.033 -11.090
  726   2HD   ARG  98          HD3       ARG  98  26.495  -1.510 -11.290
  727    HE   ARG  98           HE       ARG  98  25.587  -0.644 -13.846
  728   1HH1  ARG  98          HH21      ARG  98  27.870   0.642 -11.461
  729   2HH1  ARG  98          HH22      ARG  98  29.177   0.793 -12.590
  730   1HH2  ARG  98          HH11      ARG  98  27.163  -0.246 -15.335
  731   2HH2  ARG  98          HH12      ARG  98  28.735   0.370 -14.902
  732    H    GLU  99           H        GLU  99  21.821  -2.446 -12.759
  733    HA   GLU  99           HA       GLU  99  22.182  -5.298 -13.539
  734   1HB   GLU  99          HB2       GLU  99  19.869  -3.385 -13.881
  735   2HB   GLU  99          HB3       GLU  99  20.247  -4.441 -15.227
  736   1HG   GLU  99          HG2       GLU  99  19.833  -5.550 -12.433
  737   2HG   GLU  99          HG3       GLU  99  18.489  -5.230 -13.531
  738    H    HIS 100           H        HIS 100  22.740  -5.508 -15.808
  739    HA   HIS 100           HA       HIS 100  23.889  -3.088 -17.098
  740   1HB   HIS 100          HB2       HIS 100  25.747  -4.198 -16.048
  741   2HB   HIS 100          HB3       HIS 100  25.197  -5.783 -16.597
  742    HD1  HIS 100           HD1      HIS 100  26.798  -2.573 -18.073
  743    HD2  HIS 100           HD2      HIS 100  25.903  -6.582 -19.004
  744    HE1  HIS 100           HE1      HIS 100  27.972  -3.079 -20.272
  745    H    TRP 101           H        TRP 101  22.800  -2.847 -18.907
  746    HA   TRP 101           HA       TRP 101  21.748  -5.193 -20.438
  747   1HB   TRP 101          HB2       TRP 101  20.480  -2.467 -19.939
  748   2HB   TRP 101          HB3       TRP 101  19.899  -3.641 -21.100
  749    HD1  TRP 101           HD1      TRP 101  20.684  -5.156 -17.711
  750    HE1  TRP 101           HE1      TRP 101  18.568  -5.675 -16.467
  751    HE3  TRP 101           HE3      TRP 101  17.370  -2.921 -20.910
  752    HZ2  TRP 101           HZ2      TRP 101  15.727  -5.006 -16.694
  753    HZ3  TRP 101           HZ3      TRP 101  14.935  -2.996 -20.423
  754    HH2  TRP 101           HH2      TRP 101  14.118  -3.981 -18.290
  755    H    GLY 102           H        GLY 102  24.300  -4.511 -21.068
  756   1HA   GLY 102          HA1       GLY 102  24.630  -2.157 -22.608
  757   2HA   GLY 102          HA2       GLY 102  25.693  -3.572 -22.603
  758    H    PHE 103           H        PHE 103  24.078  -1.674 -24.630
  759    HA   PHE 103           HA       PHE 103  24.327  -3.521 -26.792
  760   1HB   PHE 103          HB2       PHE 103  21.946  -2.743 -27.666
  761   2HB   PHE 103          HB3       PHE 103  22.160  -4.200 -26.728
  762    HD1  PHE 103           HD1      PHE 103  21.535  -0.531 -26.026
  763    HD2  PHE 103           HD2      PHE 103  20.544  -4.632 -25.120
  764    HE1  PHE 103           HE1      PHE 103  19.939   0.220 -24.282
  765    HE2  PHE 103           HE2      PHE 103  18.930  -3.865 -23.404
  766    HZ   PHE 103           HZ       PHE 103  18.695  -1.434 -22.919
  767    H    ASP 104           H        ASP 104  24.171  -2.218 -28.844
  768    HA   ASP 104           HA       ASP 104  25.666   0.139 -28.405
  769   1HB   ASP 104          HB2       ASP 104  26.023  -1.369 -30.336
  770   2HB   ASP 104          HB3       ASP 104  24.460  -0.869 -30.994
  771    H    ASP 105           H        ASP 105  25.256   2.240 -28.893
  772    HA   ASP 105           HA       ASP 105  22.565   3.146 -28.253
  773   1HB   ASP 105          HB2       ASP 105  24.723   4.392 -27.663
  774   2HB   ASP 105          HB3       ASP 105  24.792   4.888 -29.346
  775    HA   PRO 106           HA       PRO 106  21.411   2.771 -32.519
  776   1HB   PRO 106          HB2       PRO 106  18.977   4.033 -32.549
  777   2HB   PRO 106          HB3       PRO 106  19.255   2.401 -31.884
  778   1HG   PRO 106          HG2       PRO 106  19.106   5.005 -30.357
  779   2HG   PRO 106          HG3       PRO 106  18.323   3.444 -29.960
  780   1HD   PRO 106          HD2       PRO 106  20.668   4.264 -28.825
  781   2HD   PRO 106          HD3       PRO 106  20.385   2.540 -29.208
  782    H    ALA 107           H        ALA 107  21.791   5.958 -31.016
  783    HA   ALA 107           HA       ALA 107  21.773   7.355 -33.559
  784   1HB   ALA 107          HB1       ALA 107  21.237   8.516 -31.455
  785   2HB   ALA 107          HB2       ALA 107  22.890   8.219 -30.863
  786   3HB   ALA 107          HB3       ALA 107  22.624   9.254 -32.278
  787    H    ARG 108           H        ARG 108  23.956   5.178 -32.073
  788    HA   ARG 108           HA       ARG 108  26.315   6.352 -33.486
  789   1HB   ARG 108          HB2       ARG 108  26.255   4.491 -31.070
  790   2HB   ARG 108          HB3       ARG 108  27.700   5.126 -31.862
  791   1HG   ARG 108          HG2       ARG 108  27.015   7.440 -31.326
  792   2HG   ARG 108          HG3       ARG 108  25.564   6.840 -30.518
  793   1HD   ARG 108          HD2       ARG 108  26.975   5.656 -28.849
  794   2HD   ARG 108          HD3       ARG 108  28.427   6.308 -29.628
  795    HE   ARG 108           HE       ARG 108  27.117   8.583 -29.207
  796   1HH1  ARG 108          HH21      ARG 108  27.751   5.926 -26.865
  797   2HH1  ARG 108          HH22      ARG 108  27.401   6.919 -25.507
  798   1HH2  ARG 108          HH11      ARG 108  26.833   9.887 -27.324
  799   2HH2  ARG 108          HH12      ARG 108  27.019   9.180 -25.748
  800    H    ALA 109           H        ALA 109  23.966   4.108 -33.952
  801    HA   ALA 109           HA       ALA 109  25.394   1.907 -35.084
  802   1HB   ALA 109          HB1       ALA 109  22.545   2.918 -35.505
  803   2HB   ALA 109          HB2       ALA 109  23.165   1.331 -35.991
  804   3HB   ALA 109          HB3       ALA 109  23.076   1.758 -34.267
  805    H    GLN 110           H        GLN 110  26.935   3.594 -36.115
  806    HA   GLN 110           HA       GLN 110  26.193   5.360 -38.150
  807   1HB   GLN 110          HB2       GLN 110  28.802   3.940 -37.490
  808   2HB   GLN 110          HB3       GLN 110  28.695   5.217 -38.702
  809   1HG   GLN 110          HG2       GLN 110  28.353   6.900 -37.154
  810   2HG   GLN 110          HG3       GLN 110  27.566   5.860 -35.982
  811   1HE2  GLN 110          HE22      GLN 110  28.839   4.553 -34.528
  812   2HE2  GLN 110          HE21      GLN 110  30.544   4.884 -34.290
  813    H    GLY 111           H        GLY 111  26.004   5.256 -40.270
  814   1HA   GLY 111          HA1       GLY 111  27.081   3.543 -42.138
  815   2HA   GLY 111          HA2       GLY 111  25.539   2.782 -41.685
  816    H    THR 112           H        THR 112  23.719   4.607 -41.358
  817    HA   THR 112           HA       THR 112  23.871   7.032 -42.759
  818    HB   THR 112           HB       THR 112  23.721   5.656 -44.802
  819    HG1  THR 112           HG1      THR 112  22.657   7.463 -45.126
  820   1HG2  THR 112          HG21      THR 112  21.753   4.294 -45.326
  821   2HG2  THR 112          HG22      THR 112  22.651   3.622 -43.962
  822   3HG2  THR 112          HG23      THR 112  21.140   4.515 -43.678
  823    H    GLU 113           H        GLU 113  21.553   8.042 -42.736
  824    HA   GLU 113           HA       GLU 113  20.635   7.844 -40.045
  825   1HB   GLU 113          HB2       GLU 113  18.920   9.436 -40.692
  826   2HB   GLU 113          HB3       GLU 113  20.500   9.914 -41.312
  827   1HG   GLU 113          HG2       GLU 113  19.865   9.010 -43.565
  828   2HG   GLU 113          HG3       GLU 113  18.269   8.601 -42.931
  829    H    GLU 114           H        GLU 114  19.584   6.252 -43.024
  830    HA   GLU 114           HA       GLU 114  17.142   5.222 -41.952
  831   1HB   GLU 114          HB2       GLU 114  17.637   5.430 -44.368
  832   2HB   GLU 114          HB3       GLU 114  18.867   4.166 -44.230
  833   1HG   GLU 114          HG2       GLU 114  17.151   2.531 -43.563
  834   2HG   GLU 114          HG3       GLU 114  15.915   3.793 -43.558
  835    H    GLU 115           H        GLU 115  20.511   4.080 -41.935
  836    HA   GLU 115           HA       GLU 115  19.936   1.459 -40.900
  837   1HB   GLU 115          HB2       GLU 115  22.049   2.109 -42.123
  838   2HB   GLU 115          HB3       GLU 115  22.512   3.082 -40.729
  839   1HG   GLU 115          HG2       GLU 115  23.691   1.038 -40.559
  840   2HG   GLU 115          HG3       GLU 115  22.454   0.999 -39.313
  841    H    LYS 116           H        LYS 116  20.972   4.602 -39.488
  842    HA   LYS 116           HA       LYS 116  20.931   3.836 -36.766
  843   1HB   LYS 116          HB2       LYS 116  20.424   6.503 -38.147
  844   2HB   LYS 116          HB3       LYS 116  20.423   6.312 -36.382
  845   1HG   LYS 116          HG2       LYS 116  22.745   5.366 -36.530
  846   2HG   LYS 116          HG3       LYS 116  22.746   5.734 -38.268
  847   1HD   LYS 116          HD2       LYS 116  22.326   8.157 -37.690
  848   2HD   LYS 116          HD3       LYS 116  22.440   7.716 -35.972
  849   1HE   LYS 116          HE2       LYS 116  24.757   6.731 -36.545
  850   2HE   LYS 116          HE3       LYS 116  24.611   7.557 -38.107
  851   1HZ   LYS 116          HZ1       LYS 116  24.648   8.796 -35.419
  852   2HZ   LYS 116          HZ2       LYS 116  25.796   8.949 -36.570
  853   3HZ   LYS 116          HZ3       LYS 116  24.342   9.652 -36.797
  854    H    TRP 117           H        TRP 117  18.231   5.210 -38.761
  855    HA   TRP 117           HA       TRP 117  16.305   5.126 -36.708
  856   1HB   TRP 117          HB2       TRP 117  15.931   6.402 -38.693
  857   2HB   TRP 117          HB3       TRP 117  16.111   4.985 -39.723
  858    HD1  TRP 117           HD1      TRP 117  13.946   4.244 -40.699
  859    HE1  TRP 117           HE1      TRP 117  11.530   3.985 -39.961
  860    HE3  TRP 117           HE3      TRP 117  14.338   6.198 -35.969
  861    HZ2  TRP 117           HZ2      TRP 117   9.926   4.573 -37.604
  862    HZ3  TRP 117           HZ3      TRP 117  12.377   6.233 -34.478
  863    HH2  TRP 117           HH2      TRP 117  10.175   5.391 -35.269
  864    H    ALA 118           H        ALA 118  17.328   2.494 -38.961
  865    HA   ALA 118           HA       ALA 118  15.238   0.730 -38.091
  866   1HB   ALA 118          HB1       ALA 118  16.554  -1.018 -39.200
  867   2HB   ALA 118          HB2       ALA 118  16.368   0.422 -40.224
  868   3HB   ALA 118          HB3       ALA 118  17.916   0.114 -39.390
  869    H    PHE 119           H        PHE 119  18.605   1.297 -37.045
  870    HA   PHE 119           HA       PHE 119  18.607  -0.733 -35.062
  871   1HB   PHE 119          HB2       PHE 119  20.543   0.795 -36.110
  872   2HB   PHE 119          HB3       PHE 119  20.257   1.738 -34.656
  873    HD1  PHE 119           HD1      PHE 119  20.624   0.625 -32.386
  874    HD2  PHE 119           HD2      PHE 119  21.567  -1.375 -36.089
  875    HE1  PHE 119           HE1      PHE 119  21.998  -1.018 -31.148
  876    HE2  PHE 119           HE2      PHE 119  22.943  -3.021 -34.843
  877    HZ   PHE 119           HZ       PHE 119  23.162  -2.848 -32.369
  878    H    PHE 120           H        PHE 120  17.476   2.641 -34.982
  879    HA   PHE 120           HA       PHE 120  16.901   2.801 -32.198
  880   1HB   PHE 120          HB2       PHE 120  15.837   4.184 -34.651
  881   2HB   PHE 120          HB3       PHE 120  14.833   4.215 -33.224
  882    HD1  PHE 120           HD1      PHE 120  17.767   5.663 -34.809
  883    HD2  PHE 120           HD2      PHE 120  15.722   5.130 -31.050
  884    HE1  PHE 120           HE1      PHE 120  19.139   7.461 -33.811
  885    HE2  PHE 120           HE2      PHE 120  17.092   6.935 -30.065
  886    HZ   PHE 120           HZ       PHE 120  18.799   8.111 -31.437
  887    H    GLN 121           H        GLN 121  14.797   1.569 -34.863
  888    HA   GLN 121           HA       GLN 121  12.752   0.608 -33.153
  889   1HB   GLN 121          HB2       GLN 121  13.666   0.060 -35.949
  890   2HB   GLN 121          HB3       GLN 121  12.822  -1.282 -35.179
  891   1HG   GLN 121          HG2       GLN 121  11.378   0.297 -36.512
  892   2HG   GLN 121          HG3       GLN 121  10.850  -0.067 -34.873
  893   1HE2  GLN 121          HE22      GLN 121  13.144   2.371 -36.378
  894   2HE2  GLN 121          HE21      GLN 121  12.346   3.734 -35.650
  895    H    ARG 122           H        ARG 122  15.770  -1.117 -34.187
  896    HA   ARG 122           HA       ARG 122  15.060  -3.522 -32.832
  897   1HB   ARG 122          HB2       ARG 122  17.851  -2.386 -33.362
  898   2HB   ARG 122          HB3       ARG 122  17.522  -4.026 -32.825
  899   1HG   ARG 122          HG2       ARG 122  16.645  -2.835 -35.488
  900   2HG   ARG 122          HG3       ARG 122  17.999  -3.933 -35.223
  901   1HD   ARG 122          HD2       ARG 122  16.410  -5.677 -34.419
  902   2HD   ARG 122          HD3       ARG 122  15.056  -4.575 -34.758
  903    HE   ARG 122           HE       ARG 122  16.651  -4.816 -37.091
  904   1HH1  ARG 122          HH22      ARG 122  14.402  -6.773 -35.160
  905   2HH1  ARG 122          HH21      ARG 122  13.875  -7.735 -36.489
  906   1HH2  ARG 122          HH11      ARG 122  15.953  -6.102 -38.863
  907   2HH2  ARG 122          HH12      ARG 122  14.780  -7.344 -38.640
  908    H    VAL 123           H        VAL 123  16.955  -0.700 -31.589
  909    HA   VAL 123           HA       VAL 123  17.310  -1.973 -29.019
  910    HB   VAL 123           HB       VAL 123  17.636   0.887 -30.027
  911   1HG1  VAL 123          HG11      VAL 123  18.973   1.313 -27.977
  912   2HG1  VAL 123          HG12      VAL 123  17.267   1.054 -27.619
  913   3HG1  VAL 123          HG13      VAL 123  18.443  -0.248 -27.313
  914   1HG2  VAL 123          HG21      VAL 123  19.212  -0.845 -30.937
  915   2HG2  VAL 123          HG22      VAL 123  20.035   0.353 -29.937
  916   3HG2  VAL 123          HG23      VAL 123  19.689  -1.256 -29.280
  917    H    ARG 124           H        ARG 124  14.857   0.288 -30.356
  918    HA   ARG 124           HA       ARG 124  13.490   0.916 -27.954
  919   1HB   ARG 124          HB2       ARG 124  13.065   2.021 -30.146
  920   2HB   ARG 124          HB3       ARG 124  12.526   0.501 -30.824
  921   1HG   ARG 124          HG2       ARG 124  10.768   0.783 -28.711
  922   2HG   ARG 124          HG3       ARG 124  11.093   2.461 -29.125
  923   1HD   ARG 124          HD2       ARG 124   9.214   1.807 -30.412
  924   2HD   ARG 124          HD3       ARG 124  10.576   1.855 -31.545
  925    HE   ARG 124           HE       ARG 124  10.057  -0.781 -30.380
  926   1HH1  ARG 124          HH21      ARG 124   9.359   1.357 -33.136
  927   2HH1  ARG 124          HH22      ARG 124   8.361   0.198 -33.941
  928   1HH2  ARG 124          HH11      ARG 124   8.855  -2.401 -31.561
  929   2HH2  ARG 124          HH12      ARG 124   8.203  -1.990 -33.101
  930    H    ASP 125           H        ASP 125  12.874  -1.703 -30.353
  931    HA   ASP 125           HA       ASP 125  10.697  -2.691 -28.846
  932   1HB   ASP 125          HB2       ASP 125  11.299  -2.974 -31.365
  933   2HB   ASP 125          HB3       ASP 125  12.262  -4.362 -30.848
  934    H    GLU 126           H        GLU 126  14.158  -3.665 -28.971
  935    HA   GLU 126           HA       GLU 126  13.856  -5.982 -27.359
  936   1HB   GLU 126          HB2       GLU 126  15.730  -5.570 -28.857
  937   2HB   GLU 126          HB3       GLU 126  16.298  -4.237 -27.832
  938   1HG   GLU 126          HG2       GLU 126  16.760  -5.773 -26.000
  939   2HG   GLU 126          HG3       GLU 126  15.942  -7.097 -26.836
  940    H    ILE 127           H        ILE 127  14.634  -2.557 -26.512
  941    HA   ILE 127           HA       ILE 127  14.942  -2.976 -23.704
  942    HB   ILE 127           HB       ILE 127  14.138  -0.591 -25.410
  943   1HG1  ILE 127          HG12      ILE 127  16.571  -1.158 -23.653
  944   2HG1  ILE 127          HG13      ILE 127  16.537  -1.402 -25.393
  945   1HG2  ILE 127          HG21      ILE 127  14.241   0.864 -23.485
  946   2HG2  ILE 127          HG22      ILE 127  12.971  -0.311 -23.220
  947   3HG2  ILE 127          HG23      ILE 127  14.529  -0.513 -22.388
  948   1HD1  ILE 127          HD11      ILE 127  16.408   1.242 -23.899
  949   2HD1  ILE 127          HD12      ILE 127  17.627   0.683 -25.043
  950   3HD1  ILE 127          HD13      ILE 127  16.001   1.094 -25.625
  951    H    GLY 128           H        GLY 128  12.035  -2.039 -25.655
  952   1HA   GLY 128          HA1       GLY 128  10.136  -2.044 -23.644
  953   2HA   GLY 128          HA2       GLY 128   9.827  -2.542 -25.321
  954    H    ASN 129           H        ASN 129  11.275  -4.911 -25.516
  955    HA   ASN 129           HA       ASN 129   9.533  -6.763 -24.255
  956   1HB   ASN 129          HB2       ASN 129  12.145  -7.057 -25.764
  957   2HB   ASN 129          HB3       ASN 129  11.503  -8.427 -24.875
  958   1HD2  ASN 129          HD22      ASN 129  10.820  -6.209 -27.574
  959   2HD2  ASN 129          HD21      ASN 129   9.644  -7.247 -28.339
  960    H    ARG 130           H        ARG 130  12.915  -5.848 -23.389
  961    HA   ARG 130           HA       ARG 130  12.894  -7.803 -21.249
  962   1HB   ARG 130          HB2       ARG 130  14.997  -7.088 -22.322
  963   2HB   ARG 130          HB3       ARG 130  14.754  -5.442 -21.724
  964   1HG   ARG 130          HG2       ARG 130  16.352  -6.540 -20.310
  965   2HG   ARG 130          HG3       ARG 130  14.875  -6.284 -19.396
  966   1HD   ARG 130          HD2       ARG 130  14.247  -8.698 -19.836
  967   2HD   ARG 130          HD3       ARG 130  15.889  -8.934 -20.458
  968    HE   ARG 130           HE       ARG 130  14.978  -8.708 -17.717
  969   1HH1  ARG 130          HH12      ARG 130  17.875  -7.971 -19.685
  970   2HH1  ARG 130          HH11      ARG 130  18.887  -7.760 -18.301
  971   1HH2  ARG 130          HH21      ARG 130  16.358  -8.603 -15.957
  972   2HH2  ARG 130          HH22      ARG 130  17.978  -7.965 -16.131
  973    H    LEU 131           H        LEU 131  12.041  -4.323 -21.442
  974    HA   LEU 131           HA       LEU 131  11.817  -3.938 -18.621
  975   1HB   LEU 131          HB2       LEU 131  11.635  -2.276 -20.791
  976   2HB   LEU 131          HB3       LEU 131   9.947  -2.449 -20.388
  977    HG   LEU 131           HG       LEU 131  10.835  -0.532 -19.272
  978   1HD1  LEU 131          HD11      LEU 131   9.265  -1.794 -17.856
  979   2HD1  LEU 131          HD12      LEU 131  10.616  -2.675 -17.139
  980   3HD1  LEU 131          HD13      LEU 131  10.484  -0.940 -16.885
  981   1HD2  LEU 131          HD21      LEU 131  12.771  -0.390 -18.003
  982   2HD2  LEU 131          HD22      LEU 131  12.942  -2.139 -17.829
  983   3HD2  LEU 131          HD23      LEU 131  13.248  -1.344 -19.396
  984    H    LYS 132           H        LYS 132   9.511  -5.112 -21.131
  985    HA   LYS 132           HA       LYS 132   7.284  -5.380 -19.435
  986   1HB   LYS 132          HB2       LYS 132   7.202  -5.633 -21.905
  987   2HB   LYS 132          HB3       LYS 132   8.076  -7.160 -21.784
  988   1HG   LYS 132          HG2       LYS 132   6.267  -8.177 -20.501
  989   2HG   LYS 132          HG3       LYS 132   5.388  -6.630 -20.461
  990   1HD   LYS 132          HD2       LYS 132   5.217  -6.659 -22.939
  991   2HD   LYS 132          HD3       LYS 132   6.089  -8.207 -22.980
  992   1HE   LYS 132          HE2       LYS 132   4.294  -9.248 -21.603
  993   2HE   LYS 132          HE3       LYS 132   3.428  -7.707 -21.564
  994   1HZ   LYS 132          HZ1       LYS 132   2.549  -9.174 -23.264
  995   2HZ   LYS 132          HZ2       LYS 132   3.188  -7.857 -23.976
  996   3HZ   LYS 132          HZ3       LYS 132   3.991  -9.282 -24.012
  997    H    GLU 133           H        GLU 133   9.868  -7.759 -20.143
  998    HA   GLU 133           HA       GLU 133   8.811  -9.713 -18.389
  999   1HB   GLU 133          HB2       GLU 133  11.721  -9.307 -19.172
 1000   2HB   GLU 133          HB3       GLU 133  11.042 -10.734 -18.367
 1001   1HG   GLU 133          HG2       GLU 133   9.530 -11.115 -20.290
 1002   2HG   GLU 133          HG3       GLU 133  10.247  -9.743 -21.130
 1003    H    PHE 134           H        PHE 134  11.183  -7.107 -17.780
 1004    HA   PHE 134           HA       PHE 134  11.761  -7.803 -15.114
 1005   1HB   PHE 134          HB2       PHE 134  13.111  -6.238 -16.309
 1006   2HB   PHE 134          HB3       PHE 134  11.728  -5.173 -16.592
 1007    HD1  PHE 134           HD1      PHE 134  11.491  -3.279 -15.262
 1008    HD2  PHE 134           HD2      PHE 134  13.643  -6.665 -13.686
 1009    HE1  PHE 134           HE1      PHE 134  11.946  -2.006 -13.205
 1010    HE2  PHE 134           HE2      PHE 134  14.092  -5.392 -11.601
 1011    HZ   PHE 134           HZ       PHE 134  13.240  -3.068 -11.348
 1012    H    ALA 135           H        ALA 135   8.972  -6.111 -16.436
 1013    HA   ALA 135           HA       ALA 135   7.986  -5.325 -13.812
 1014   1HB   ALA 135          HB1       ALA 135   6.668  -5.238 -16.563
 1015   2HB   ALA 135          HB2       ALA 135   6.081  -4.422 -15.096
 1016   3HB   ALA 135          HB3       ALA 135   7.618  -3.925 -15.840
 1017    H    GLU 136           H        GLU 136   7.338  -7.853 -16.207
 1018    HA   GLU 136           HA       GLU 136   4.915  -8.752 -14.887
 1019   1HB   GLU 136          HB2       GLU 136   5.061  -8.605 -17.332
 1020   2HB   GLU 136          HB3       GLU 136   6.449  -9.689 -17.343
 1021   1HG   GLU 136          HG2       GLU 136   4.558 -10.945 -18.047
 1022   2HG   GLU 136          HG3       GLU 136   5.016 -11.536 -16.461
 1023    H    THR 137           H        THR 137   8.094 -10.151 -15.702
 1024    HA   THR 137           HA       THR 137   7.523 -12.560 -14.119
 1025    HB   THR 137           HB       THR 137   9.156 -13.626 -15.497
 1026    HG1  THR 137           HG1      THR 137  10.264 -12.485 -17.078
 1027   1HG2  THR 137          HG21      THR 137   6.872 -13.257 -16.525
 1028   2HG2  THR 137          HG22      THR 137   7.559 -11.846 -17.379
 1029   3HG2  THR 137          HG23      THR 137   8.197 -13.473 -17.688
 1030    H    GLY 138           H        GLY 138   9.411  -9.651 -14.083
 1031   1HA   GLY 138          HA1       GLY 138  10.689  -8.807 -12.330
 1032   2HA   GLY 138          HA2       GLY 138  10.700 -10.388 -11.546
 1033    H    LYS 139           H        LYS 139  11.521 -10.576 -14.930
 1034    HA   LYS 139           HA       LYS 139  14.141 -11.516 -14.186
 1035   1HB   LYS 139          HB2       LYS 139  12.588 -11.391 -16.789
 1036   2HB   LYS 139          HB3       LYS 139  14.192 -12.082 -16.670
 1037   1HG   LYS 139          HG2       LYS 139  11.760 -13.025 -15.063
 1038   2HG   LYS 139          HG3       LYS 139  12.314 -13.770 -16.560
 1039   1HD   LYS 139          HD2       LYS 139  13.794 -13.682 -13.895
 1040   2HD   LYS 139          HD3       LYS 139  12.987 -15.077 -14.631
 1041   1HE   LYS 139          HE2       LYS 139  14.499 -14.883 -16.606
 1042   2HE   LYS 139          HE3       LYS 139  15.346 -13.554 -15.799
 1043   1HZ   LYS 139          HZ1       LYS 139  16.504 -15.660 -15.483
 1044   2HZ   LYS 139          HZ2       LYS 139  15.980 -15.115 -14.040
 1045   3HZ   LYS 139          HZ3       LYS 139  15.201 -16.343 -14.789
  Start of MODEL    9
    1   1H    MET   1           H1       MET   1  10.230   5.440   1.549
    2   2H    MET   1           H2       MET   1   9.532   3.974   1.769
    3   3H    MET   1           H3       MET   1  10.559   4.203   0.520
    4    HA   MET   1           HA       MET   1   7.940   5.478   0.856
    5   1HB   MET   1          HB2       MET   1   9.612   6.934  -0.297
    6   2HB   MET   1          HB3       MET   1   9.851   5.681  -1.519
    7   1HG   MET   1          HG2       MET   1   8.334   7.448  -2.284
    8   2HG   MET   1          HG3       MET   1   7.521   5.891  -2.233
    9   1HE   MET   1          HE1       MET   1   5.176   7.142  -2.524
   10   2HE   MET   1          HE2       MET   1   4.659   8.489  -1.489
   11   3HE   MET   1          HE3       MET   1   6.053   8.689  -2.571
   12    H    GLU   2           H        GLU   2   6.212   4.286   0.105
   13    HA   GLU   2           HA       GLU   2   6.632   1.554  -0.642
   14   1HB   GLU   2          HB2       GLU   2   4.680   2.421   0.623
   15   2HB   GLU   2          HB3       GLU   2   4.119   3.270  -0.825
   16   1HG   GLU   2          HG2       GLU   2   3.852   1.114  -2.004
   17   2HG   GLU   2          HG3       GLU   2   4.532   0.251  -0.624
   18    H    ASN   3           H        ASN   3   5.914   4.496  -2.507
   19    HA   ASN   3           HA       ASN   3   5.725   3.175  -5.090
   20   1HB   ASN   3          HB2       ASN   3   4.885   5.553  -4.469
   21   2HB   ASN   3          HB3       ASN   3   6.586   6.057  -4.618
   22   1HD2  ASN   3          HD22      ASN   3   7.675   5.494  -6.786
   23   2HD2  ASN   3          HD21      ASN   3   6.614   5.609  -8.186
   24    H    LYS   4           H        LYS   4   7.445   2.452  -6.268
   25    HA   LYS   4           HA       LYS   4  10.070   2.390  -4.996
   26   1HB   LYS   4          HB2       LYS   4   9.306   1.478  -7.786
   27   2HB   LYS   4          HB3       LYS   4  10.653   0.894  -6.826
   28   1HG   LYS   4          HG2       LYS   4   7.696   0.354  -6.311
   29   2HG   LYS   4          HG3       LYS   4   8.851  -0.765  -6.998
   30   1HD   LYS   4          HD2       LYS   4   8.957   0.378  -4.185
   31   2HD   LYS   4          HD3       LYS   4   8.401  -1.237  -4.613
   32   1HE   LYS   4          HE2       LYS   4  11.225  -0.140  -4.982
   33   2HE   LYS   4          HE3       LYS   4  10.712  -1.254  -3.720
   34   1HZ   LYS   4          HZ1       LYS   4  10.364  -2.945  -5.341
   35   2HZ   LYS   4          HZ2       LYS   4  10.586  -1.918  -6.606
   36   3HZ   LYS   4          HZ3       LYS   4  11.846  -2.284  -5.634
   37    H    ILE   5           H        ILE   5  11.986   2.678  -6.723
   38    HA   ILE   5           HA       ILE   5  11.651   5.052  -8.411
   39    HB   ILE   5           HB       ILE   5  13.901   4.758  -6.391
   40   1HG1  ILE   5          HG12      ILE   5  12.864   7.122  -5.609
   41   2HG1  ILE   5          HG13      ILE   5  11.372   6.331  -6.087
   42   1HG2  ILE   5          HG21      ILE   5  13.222   7.024  -8.301
   43   2HG2  ILE   5          HG22      ILE   5  14.547   7.059  -7.117
   44   3HG2  ILE   5          HG23      ILE   5  14.596   5.921  -8.458
   45   1HD1  ILE   5          HD11      ILE   5  11.876   5.990  -3.698
   46   2HD1  ILE   5          HD12      ILE   5  11.970   4.425  -4.529
   47   3HD1  ILE   5          HD13      ILE   5  13.456   5.295  -4.112
   48    H    ILE   6           H        ILE   6  13.061   4.822 -10.265
   49    HA   ILE   6           HA       ILE   6  15.052   2.668 -10.235
   50    HB   ILE   6           HB       ILE   6  13.040   1.472 -10.847
   51   1HG1  ILE   6          HG12      ILE   6  14.758   1.852 -13.335
   52   2HG1  ILE   6          HG13      ILE   6  15.245   0.925 -11.911
   53   1HG2  ILE   6          HG21      ILE   6  12.732   3.355 -13.220
   54   2HG2  ILE   6          HG22      ILE   6  11.693   1.977 -12.821
   55   3HG2  ILE   6          HG23      ILE   6  11.701   3.383 -11.769
   56   1HD1  ILE   6          HD11      ILE   6  14.421  -0.584 -13.595
   57   2HD1  ILE   6          HD12      ILE   6  13.272  -0.559 -12.237
   58   3HD1  ILE   6          HD13      ILE   6  12.905   0.314 -13.749
   59    H    TYR   7           H        TYR   7  16.644   2.924 -11.895
   60    HA   TYR   7           HA       TYR   7  16.584   5.548 -13.302
   61   1HB   TYR   7          HB2       TYR   7  17.626   5.416 -10.959
   62   2HB   TYR   7          HB3       TYR   7  18.829   4.344 -11.644
   63    HD1  TYR   7           HD1      TYR   7  17.733   7.312 -13.654
   64    HD2  TYR   7           HD2      TYR   7  20.449   5.827 -10.640
   65    HE1  TYR   7           HE1      TYR   7  19.001   9.427 -13.749
   66    HE2  TYR   7           HE2      TYR   7  21.704   7.944 -10.741
   67    HH   TYR   7           HH       TYR   7  21.843   9.983 -11.606
   68    H    PHE   8           H        PHE   8  17.512   5.486 -15.328
   69    HA   PHE   8           HA       PHE   8  18.950   3.005 -16.195
   70   1HB   PHE   8          HB2       PHE   8  17.128   4.815 -17.834
   71   2HB   PHE   8          HB3       PHE   8  17.993   3.410 -18.426
   72    HD1  PHE   8           HD1      PHE   8  14.977   4.596 -16.787
   73    HD2  PHE   8           HD2      PHE   8  17.336   1.083 -17.601
   74    HE1  PHE   8           HE1      PHE   8  13.060   3.138 -16.200
   75    HE2  PHE   8           HE2      PHE   8  15.429  -0.354 -16.967
   76    HZ   PHE   8           HZ       PHE   8  13.300   0.674 -16.210
   77    H    LEU   9           H        LEU   9  20.964   3.364 -17.062
   78    HA   LEU   9           HA       LEU   9  21.792   6.200 -17.493
   79   1HB   LEU   9          HB2       LEU   9  23.266   3.866 -16.208
   80   2HB   LEU   9          HB3       LEU   9  24.056   5.324 -16.753
   81    HG   LEU   9           HG       LEU   9  23.832   5.534 -14.452
   82   1HD1  LEU   9          HD11      LEU   9  21.571   7.242 -15.556
   83   2HD1  LEU   9          HD12      LEU   9  22.563   7.550 -14.129
   84   3HD1  LEU   9          HD13      LEU   9  23.303   7.607 -15.746
   85   1HD2  LEU   9          HD21      LEU   9  20.819   5.207 -14.514
   86   2HD2  LEU   9          HD22      LEU   9  21.944   3.867 -14.193
   87   3HD2  LEU   9          HD23      LEU   9  21.911   5.297 -13.132
   88    H    CYS  10           H        CYS  10  23.045   6.704 -19.165
   89    HA   CYS  10           HA       CYS  10  23.985   4.577 -21.033
   90   1HB   CYS  10          HB2       CYS  10  21.745   5.490 -21.723
   91   2HB   CYS  10          HB3       CYS  10  22.455   7.117 -21.746
   92    HG   CYS  10           HG       CYS  10  22.518   6.884 -24.088
   93    H    THR  11           H        THR  11  25.491   5.659 -22.715
   94    HA   THR  11           HA       THR  11  27.630   7.115 -21.537
   95    HB   THR  11           HB       THR  11  28.181   7.409 -24.061
   96    HG1  THR  11           HG1      THR  11  26.824   6.561 -25.455
   97   1HG2  THR  11          HG21      THR  11  29.137   5.608 -22.657
   98   2HG2  THR  11          HG22      THR  11  27.722   4.583 -22.977
   99   3HG2  THR  11          HG23      THR  11  28.813   5.039 -24.304
  100    H    GLY  12           H        GLY  12  24.697   8.080 -23.357
  101   1HA   GLY  12          HA1       GLY  12  24.932  10.745 -22.163
  102   2HA   GLY  12          HA2       GLY  12  24.798  10.682 -23.933
  103    H    ASN  13           H        ASN  13  22.895  11.552 -21.713
  104    HA   ASN  13           HA       ASN  13  20.793   9.573 -21.597
  105   1HB   ASN  13          HB2       ASN  13  21.347  11.205 -19.755
  106   2HB   ASN  13          HB3       ASN  13  20.736  12.500 -20.785
  107   1HD2  ASN  13          HD22      ASN  13  19.242   9.141 -20.298
  108   2HD2  ASN  13          HD21      ASN  13  17.781   9.808 -19.604
  109    H    SER  14           H        SER  14  21.074   9.815 -24.225
  110    HA   SER  14           HA       SER  14  18.914  11.673 -25.130
  111   1HB   SER  14          HB2       SER  14  21.545  10.978 -26.478
  112   2HB   SER  14          HB3       SER  14  20.275  12.005 -27.171
  113    HG   SER  14           HG       SER  14  20.601  13.508 -25.680
  114    H    CYS  15           H        CYS  15  19.937   8.390 -25.064
  115    HA   CYS  15           HA       CYS  15  18.037   7.700 -27.254
  116   1HB   CYS  15          HB2       CYS  15  20.896   6.666 -26.997
  117   2HB   CYS  15          HB3       CYS  15  19.705   6.161 -28.207
  118    HG   CYS  15           HG       CYS  15  21.638   7.625 -29.160
  119    H    ARG  16           H        ARG  16  20.244   5.393 -25.793
  120    HA   ARG  16           HA       ARG  16  18.254   3.520 -25.357
  121   1HB   ARG  16          HB2       ARG  16  20.978   3.882 -24.032
  122   2HB   ARG  16          HB3       ARG  16  19.994   2.449 -23.797
  123   1HG   ARG  16          HG2       ARG  16  20.067   1.838 -26.100
  124   2HG   ARG  16          HG3       ARG  16  20.852   3.352 -26.563
  125   1HD   ARG  16          HD2       ARG  16  22.093   1.308 -24.665
  126   2HD   ARG  16          HD3       ARG  16  22.398   1.361 -26.406
  127    HE   ARG  16           HE       ARG  16  22.888   3.957 -25.473
  128   1HH1  ARG  16          HH21      ARG  16  24.384   0.705 -25.353
  129   2HH1  ARG  16          HH22      ARG  16  25.979   1.424 -25.089
  130   1HH2  ARG  16          HH11      ARG  16  25.051   4.710 -24.925
  131   2HH2  ARG  16          HH12      ARG  16  26.327   3.532 -24.818
  132    H    SER  17           H        SER  17  19.621   5.713 -22.814
  133    HA   SER  17           HA       SER  17  18.022   4.470 -20.770
  134   1HB   SER  17          HB2       SER  17  18.876   6.404 -19.410
  135   2HB   SER  17          HB3       SER  17  20.098   5.432 -20.201
  136    HG   SER  17           HG       SER  17  20.686   7.465 -20.672
  137    H    GLN  18           H        GLN  18  17.547   7.317 -22.833
  138    HA   GLN  18           HA       GLN  18  15.199   8.360 -21.578
  139   1HB   GLN  18          HB2       GLN  18  16.405   8.511 -24.369
  140   2HB   GLN  18          HB3       GLN  18  14.844   9.213 -24.049
  141   1HG   GLN  18          HG2       GLN  18  17.308   9.901 -22.394
  142   2HG   GLN  18          HG3       GLN  18  16.890  10.754 -23.880
  143   1HE2  GLN  18          HE22      GLN  18  16.924  11.795 -20.965
  144   2HE2  GLN  18          HE21      GLN  18  15.291  12.445 -20.812
  145    H    MET  19           H        MET  19  15.569   6.236 -24.412
  146    HA   MET  19           HA       MET  19  12.900   5.518 -24.868
  147   1HB   MET  19          HB2       MET  19  15.423   3.832 -25.183
  148   2HB   MET  19          HB3       MET  19  13.869   3.441 -25.913
  149   1HG   MET  19          HG2       MET  19  14.000   5.215 -27.460
  150   2HG   MET  19          HG3       MET  19  15.116   6.138 -26.469
  151   1HE   MET  19          HE1       MET  19  16.314   2.666 -29.260
  152   2HE   MET  19          HE2       MET  19  15.193   2.431 -27.901
  153   3HE   MET  19          HE3       MET  19  14.745   3.490 -29.265
  154    H    ALA  20           H        ALA  20  15.261   3.880 -22.658
  155    HA   ALA  20           HA       ALA  20  13.477   1.843 -21.812
  156   1HB   ALA  20          HB1       ALA  20  15.914   1.741 -21.507
  157   2HB   ALA  20          HB2       ALA  20  15.847   3.086 -20.344
  158   3HB   ALA  20          HB3       ALA  20  15.072   1.532 -19.958
  159    H    GLU  21           H        GLU  21  14.163   5.027 -20.278
  160    HA   GLU  21           HA       GLU  21  12.374   4.753 -18.132
  161   1HB   GLU  21          HB2       GLU  21  13.989   6.598 -18.429
  162   2HB   GLU  21          HB3       GLU  21  12.979   7.276 -19.710
  163   1HG   GLU  21          HG2       GLU  21  11.107   7.449 -17.964
  164   2HG   GLU  21          HG3       GLU  21  12.310   6.998 -16.760
  165    H    GLY  22           H        GLY  22  11.635   5.728 -21.530
  166   1HA   GLY  22          HA1       GLY  22   8.891   6.363 -21.138
  167   2HA   GLY  22          HA2       GLY  22   9.653   5.828 -22.661
  168    H    TRP  23           H        TRP  23  10.428   3.240 -22.119
  169    HA   TRP  23           HA       TRP  23   7.937   1.801 -22.256
  170   1HB   TRP  23          HB2       TRP  23  10.831   0.947 -21.869
  171   2HB   TRP  23          HB3       TRP  23   9.504  -0.205 -21.854
  172    HD1  TRP  23           HD1      TRP  23  11.749   1.538 -24.226
  173    HE1  TRP  23           HE1      TRP  23  11.107   1.010 -26.626
  174    HE3  TRP  23           HE3      TRP  23   7.129  -0.487 -23.381
  175    HZ2  TRP  23           HZ2      TRP  23   8.809  -0.136 -28.048
  176    HZ3  TRP  23           HZ3      TRP  23   5.788  -1.389 -25.256
  177    HH2  TRP  23           HH2      TRP  23   6.643  -1.256 -27.585
  178    H    ALA  24           H        ALA  24  10.314   2.294 -19.618
  179    HA   ALA  24           HA       ALA  24   9.127   0.480 -17.821
  180   1HB   ALA  24          HB1       ALA  24  10.803   2.960 -17.315
  181   2HB   ALA  24          HB2       ALA  24  10.498   1.673 -16.117
  182   3HB   ALA  24          HB3       ALA  24  11.414   1.335 -17.592
  183    H    LYS  25           H        LYS  25   8.528   4.024 -18.225
  184    HA   LYS  25           HA       LYS  25   6.657   4.336 -16.151
  185   1HB   LYS  25          HB2       LYS  25   6.842   5.554 -18.928
  186   2HB   LYS  25          HB3       LYS  25   5.555   6.015 -17.804
  187   1HG   LYS  25          HG2       LYS  25   7.114   6.814 -16.164
  188   2HG   LYS  25          HG3       LYS  25   8.496   6.156 -17.055
  189   1HD   LYS  25          HD2       LYS  25   8.090   7.683 -18.919
  190   2HD   LYS  25          HD3       LYS  25   6.672   8.376 -18.088
  191   1HE   LYS  25          HE2       LYS  25   8.029   9.273 -16.314
  192   2HE   LYS  25          HE3       LYS  25   9.402   8.256 -16.770
  193   1HZ   LYS  25          HZ1       LYS  25   9.505   9.513 -18.863
  194   2HZ   LYS  25          HZ2       LYS  25   8.453  10.630 -18.258
  195   3HZ   LYS  25          HZ3       LYS  25   9.944  10.306 -17.543
  196    H    GLN  26           H        GLN  26   6.152   2.821 -19.320
  197    HA   GLN  26           HA       GLN  26   3.304   2.628 -18.943
  198   1HB   GLN  26          HB2       GLN  26   4.848   0.772 -20.775
  199   2HB   GLN  26          HB3       GLN  26   3.170   1.281 -20.864
  200   1HG   GLN  26          HG2       GLN  26   5.665   2.768 -21.613
  201   2HG   GLN  26          HG3       GLN  26   4.252   2.411 -22.588
  202   1HE2  GLN  26          HE22      GLN  26   5.853   4.910 -21.149
  203   2HE2  GLN  26          HE21      GLN  26   4.513   6.021 -20.896
  204    H    TYR  27           H        TYR  27   5.820   0.069 -18.896
  205    HA   TYR  27           HA       TYR  27   3.975  -1.915 -18.028
  206   1HB   TYR  27          HB2       TYR  27   7.012  -1.898 -17.848
  207   2HB   TYR  27          HB3       TYR  27   5.989  -3.300 -17.580
  208    HD1  TYR  27           HD1      TYR  27   4.272  -3.899 -19.528
  209    HD2  TYR  27           HD2      TYR  27   7.886  -1.606 -20.005
  210    HE1  TYR  27           HE1      TYR  27   4.356  -4.537 -21.920
  211    HE2  TYR  27           HE2      TYR  27   8.079  -2.375 -22.348
  212    HH   TYR  27           HH       TYR  27   7.034  -3.538 -24.090
  213    H    LEU  28           H        LEU  28   6.258   0.107 -16.175
  214    HA   LEU  28           HA       LEU  28   5.703  -1.237 -13.656
  215   1HB   LEU  28          HB2       LEU  28   7.038   1.447 -14.179
  216   2HB   LEU  28          HB3       LEU  28   7.074   0.545 -12.698
  217    HG   LEU  28           HG       LEU  28   8.352  -0.353 -15.302
  218   1HD1  LEU  28          HD11      LEU  28  10.453   0.060 -14.185
  219   2HD1  LEU  28          HD12      LEU  28   9.462   1.531 -14.079
  220   3HD1  LEU  28          HD13      LEU  28   9.628   0.472 -12.667
  221   1HD2  LEU  28          HD21      LEU  28   9.329  -2.203 -14.045
  222   2HD2  LEU  28          HD22      LEU  28   8.437  -1.723 -12.585
  223   3HD2  LEU  28          HD23      LEU  28   7.578  -2.326 -14.017
  224    H    GLY  29           H        GLY  29   3.707   0.752 -15.449
  225   1HA   GLY  29          HA1       GLY  29   1.756   1.780 -14.987
  226   2HA   GLY  29          HA2       GLY  29   1.725   0.795 -13.512
  227    H    ASP  30           H        ASP  30   4.229   3.171 -14.072
  228    HA   ASP  30           HA       ASP  30   5.011   4.891 -12.902
  229   1HB   ASP  30          HB2       ASP  30   3.149   5.941 -14.130
  230   2HB   ASP  30          HB3       ASP  30   2.114   5.755 -12.714
  231    H    GLU  31           H        GLU  31   3.926   2.420 -11.320
  232    HA   GLU  31           HA       GLU  31   3.644   3.488  -8.625
  233   1HB   GLU  31          HB2       GLU  31   4.351   0.635  -9.391
  234   2HB   GLU  31          HB3       GLU  31   3.678   1.227  -7.875
  235   1HG   GLU  31          HG2       GLU  31   1.616   1.934  -9.233
  236   2HG   GLU  31          HG3       GLU  31   2.312   1.005 -10.573
  237    H    TRP  32           H        TRP  32   6.133   3.617 -10.654
  238    HA   TRP  32           HA       TRP  32   8.265   3.349  -8.631
  239   1HB   TRP  32          HB2       TRP  32   8.423   2.469 -11.549
  240   2HB   TRP  32          HB3       TRP  32   9.731   2.436 -10.386
  241    HD1  TRP  32           HD1      TRP  32   6.188   0.831 -10.526
  242    HE1  TRP  32           HE1      TRP  32   6.337  -1.635  -9.979
  243    HE3  TRP  32           HE3      TRP  32  11.239   0.510  -9.729
  244    HZ2  TRP  32           HZ2      TRP  32   8.391  -3.566  -9.464
  245    HZ3  TRP  32           HZ3      TRP  32  12.275  -1.691  -9.269
  246    HH2  TRP  32           HH2      TRP  32  10.868  -3.754  -9.192
  247    H    LYS  33           H        LYS  33   9.222   5.359  -8.533
  248    HA   LYS  33           HA       LYS  33   8.739   7.464 -10.437
  249   1HB   LYS  33          HB2       LYS  33  10.787   7.132  -8.189
  250   2HB   LYS  33          HB3       LYS  33  10.589   8.603  -9.140
  251   1HG   LYS  33          HG2       LYS  33   8.626   7.389  -7.182
  252   2HG   LYS  33          HG3       LYS  33   9.541   8.865  -6.992
  253   1HD   LYS  33          HD2       LYS  33   7.251   8.376  -8.938
  254   2HD   LYS  33          HD3       LYS  33   7.209   9.371  -7.496
  255   1HE   LYS  33          HE2       LYS  33   8.871   9.942 -10.000
  256   2HE   LYS  33          HE3       LYS  33   7.340  10.701  -9.573
  257   1HZ   LYS  33          HZ1       LYS  33   8.453  11.577  -7.557
  258   2HZ   LYS  33          HZ2       LYS  33   9.896  11.009  -8.111
  259   3HZ   LYS  33          HZ3       LYS  33   9.086  12.143  -8.944
  260    H    VAL  34           H        VAL  34   9.332   6.775 -12.465
  261    HA   VAL  34           HA       VAL  34  11.832   5.468 -12.948
  262    HB   VAL  34           HB       VAL  34  10.146   6.723 -15.121
  263   1HG1  VAL  34          HG11      VAL  34  11.252   3.908 -14.972
  264   2HG1  VAL  34          HG12      VAL  34  10.836   4.901 -16.390
  265   3HG1  VAL  34          HG13      VAL  34  12.287   5.268 -15.437
  266   1HG2  VAL  34          HG21      VAL  34   8.699   4.649 -15.162
  267   2HG2  VAL  34          HG22      VAL  34   9.277   4.272 -13.531
  268   3HG2  VAL  34          HG23      VAL  34   8.344   5.758 -13.838
  269    H    TYR  35           H        TYR  35  13.735   6.399 -13.651
  270    HA   TYR  35           HA       TYR  35  13.785   9.210 -14.627
  271   1HB   TYR  35          HB2       TYR  35  15.548   8.005 -12.443
  272   2HB   TYR  35          HB3       TYR  35  15.866   9.535 -13.235
  273    HD1  TYR  35           HD1      TYR  35  14.074   7.898 -10.557
  274    HD2  TYR  35           HD2      TYR  35  14.229  11.467 -12.976
  275    HE1  TYR  35           HE1      TYR  35  12.794   9.129  -8.829
  276    HE2  TYR  35           HE2      TYR  35  12.907  12.688 -11.278
  277    HH   TYR  35           HH       TYR  35  11.878  12.579  -9.192
  278    H    SER  36           H        SER  36  15.873   9.674 -15.755
  279    HA   SER  36           HA       SER  36  17.642   7.420 -16.222
  280   1HB   SER  36          HB2       SER  36  17.657   7.762 -18.653
  281   2HB   SER  36          HB3       SER  36  16.096   7.166 -18.087
  282    HG   SER  36           HG       SER  36  15.243   9.198 -18.332
  283    H    ALA  37           H        ALA  37  19.726   8.120 -17.060
  284    HA   ALA  37           HA       ALA  37  20.255  10.926 -17.498
  285   1HB   ALA  37          HB1       ALA  37  20.254  10.938 -15.024
  286   2HB   ALA  37          HB2       ALA  37  21.473   9.645 -15.014
  287   3HB   ALA  37          HB3       ALA  37  21.852  11.249 -15.674
  288    H    GLY  38           H        GLY  38  23.023  10.901 -17.235
  289   1HA   GLY  38          HA1       GLY  38  24.306   8.516 -18.032
  290   2HA   GLY  38          HA2       GLY  38  23.992   9.520 -19.464
  291    H    ILE  39           H        ILE  39  26.506   9.188 -19.120
  292    HA   ILE  39           HA       ILE  39  27.972  10.923 -17.403
  293    HB   ILE  39           HB       ILE  39  28.407   9.258 -19.826
  294   1HG1  ILE  39          HG12      ILE  39  30.234   9.742 -17.448
  295   2HG1  ILE  39          HG13      ILE  39  28.820   8.704 -17.351
  296   1HG2  ILE  39          HG21      ILE  39  30.387  11.473 -19.239
  297   2HG2  ILE  39          HG22      ILE  39  30.635  10.113 -20.362
  298   3HG2  ILE  39          HG23      ILE  39  29.396  11.305 -20.712
  299   1HD1  ILE  39          HD11      ILE  39  31.171   8.279 -19.246
  300   2HD1  ILE  39          HD12      ILE  39  30.802   7.352 -17.787
  301   3HD1  ILE  39          HD13      ILE  39  29.701   7.279 -19.177
  302    H    GLU  40           H        GLU  40  25.999  11.669 -20.204
  303    HA   GLU  40           HA       GLU  40  26.462  14.467 -19.747
  304   1HB   GLU  40          HB2       GLU  40  26.871  15.062 -22.063
  305   2HB   GLU  40          HB3       GLU  40  28.185  14.090 -21.407
  306   1HG   GLU  40          HG2       GLU  40  27.312  12.082 -22.564
  307   2HG   GLU  40          HG3       GLU  40  25.938  13.003 -23.174
  308    H    ALA  41           H        ALA  41  24.825  15.734 -21.116
  309    HA   ALA  41           HA       ALA  41  22.620  14.207 -22.267
  310   1HB   ALA  41          HB1       ALA  41  21.834  14.454 -19.967
  311   2HB   ALA  41          HB2       ALA  41  22.291  16.175 -19.943
  312   3HB   ALA  41          HB3       ALA  41  20.966  15.630 -20.980
  313    H    HIS  42           H        HIS  42  22.021  15.290 -24.086
  314    HA   HIS  42           HA       HIS  42  22.507  18.227 -24.305
  315   1HB   HIS  42          HB2       HIS  42  23.052  16.058 -26.377
  316   2HB   HIS  42          HB3       HIS  42  22.945  17.768 -26.765
  317    HD1  HIS  42           HD1      HIS  42  24.794  17.815 -23.633
  318    HD2  HIS  42           HD2      HIS  42  25.561  16.854 -27.659
  319    HE1  HIS  42           HE1      HIS  42  27.314  18.048 -23.959
  320    H    GLY  43           H        GLY  43  20.166  16.095 -23.785
  321   1HA   GLY  43          HA1       GLY  43  17.833  16.571 -24.101
  322   2HA   GLY  43          HA2       GLY  43  18.188  17.346 -25.649
  323    H    LEU  44           H        LEU  44  16.310  15.313 -25.492
  324    HA   LEU  44           HA       LEU  44  17.561  12.771 -26.085
  325   1HB   LEU  44          HB2       LEU  44  15.446  11.813 -26.076
  326   2HB   LEU  44          HB3       LEU  44  15.524  12.937 -24.726
  327    HG   LEU  44           HG       LEU  44  14.044  13.323 -27.368
  328   1HD1  LEU  44          HD11      LEU  44  12.056  13.124 -25.903
  329   2HD1  LEU  44          HD12      LEU  44  13.109  11.702 -25.745
  330   3HD1  LEU  44          HD13      LEU  44  13.106  12.940 -24.485
  331   1HD2  LEU  44          HD21      LEU  44  14.177  15.209 -24.963
  332   2HD2  LEU  44          HD22      LEU  44  14.681  15.572 -26.641
  333   3HD2  LEU  44          HD23      LEU  44  12.982  15.318 -26.270
  334    H    ASN  45           H        ASN  45  17.406  11.569 -27.972
  335    HA   ASN  45           HA       ASN  45  17.989  13.140 -30.308
  336   1HB   ASN  45          HB2       ASN  45  19.075  10.991 -29.609
  337   2HB   ASN  45          HB3       ASN  45  17.587  10.131 -29.982
  338   1HD2  ASN  45          HD22      ASN  45  20.538  10.503 -31.170
  339   2HD2  ASN  45          HD21      ASN  45  20.216  10.530 -32.889
  340    HA   PRO  46           HA       PRO  46  13.737  13.377 -31.858
  341   1HB   PRO  46          HB2       PRO  46  15.153  13.255 -34.530
  342   2HB   PRO  46          HB3       PRO  46  13.795  14.309 -34.025
  343   1HG   PRO  46          HG2       PRO  46  16.324  15.280 -34.066
  344   2HG   PRO  46          HG3       PRO  46  15.246  15.655 -32.681
  345   1HD   PRO  46          HD2       PRO  46  17.452  13.598 -32.844
  346   2HD   PRO  46          HD3       PRO  46  17.029  14.710 -31.506
  347    H    ASN  47           H        ASN  47  16.034  10.897 -33.087
  348    HA   ASN  47           HA       ASN  47  13.914   9.264 -34.273
  349   1HB   ASN  47          HB2       ASN  47  16.833   8.737 -33.629
  350   2HB   ASN  47          HB3       ASN  47  15.756   7.496 -34.256
  351   1HD2  ASN  47          HD22      ASN  47  18.223   8.840 -35.455
  352   2HD2  ASN  47          HD21      ASN  47  17.672   9.318 -37.040
  353    H    ALA  48           H        ALA  48  15.396   9.622 -31.082
  354    HA   ALA  48           HA       ALA  48  14.440   7.141 -29.997
  355   1HB   ALA  48          HB1       ALA  48  16.218   8.657 -28.918
  356   2HB   ALA  48          HB2       ALA  48  14.904   9.741 -28.456
  357   3HB   ALA  48          HB3       ALA  48  14.930   8.087 -27.843
  358    H    VAL  49           H        VAL  49  13.201  10.536 -30.058
  359    HA   VAL  49           HA       VAL  49  10.714   9.994 -28.850
  360    HB   VAL  49           HB       VAL  49  11.204  12.091 -31.012
  361   1HG1  VAL  49          HG11      VAL  49   9.446  13.351 -29.799
  362   2HG1  VAL  49          HG12      VAL  49   8.820  11.809 -30.391
  363   3HG1  VAL  49          HG13      VAL  49   9.236  11.997 -28.674
  364   1HG2  VAL  49          HG21      VAL  49  12.932  12.379 -29.303
  365   2HG2  VAL  49          HG22      VAL  49  11.713  13.635 -29.110
  366   3HG2  VAL  49          HG23      VAL  49  11.713  12.237 -28.017
  367    H    LYS  50           H        LYS  50  11.587   9.941 -32.380
  368    HA   LYS  50           HA       LYS  50   9.023   9.200 -33.255
  369   1HB   LYS  50          HB2       LYS  50  11.086   9.938 -34.663
  370   2HB   LYS  50          HB3       LYS  50  11.605   8.254 -34.577
  371   1HG   LYS  50          HG2       LYS  50  10.483   8.507 -36.643
  372   2HG   LYS  50          HG3       LYS  50   9.380   7.598 -35.608
  373   1HD   LYS  50          HD2       LYS  50   8.081   9.684 -35.168
  374   2HD   LYS  50          HD3       LYS  50   9.200  10.578 -36.223
  375   1HE   LYS  50          HE2       LYS  50   8.598   9.055 -38.106
  376   2HE   LYS  50          HE3       LYS  50   7.480   8.189 -37.044
  377   1HZ   LYS  50          HZ1       LYS  50   7.235  11.043 -37.815
  378   2HZ   LYS  50          HZ2       LYS  50   6.332   9.823 -38.402
  379   3HZ   LYS  50          HZ3       LYS  50   6.197  10.244 -36.835
  380    H    ALA  51           H        ALA  51  11.727   7.106 -32.153
  381    HA   ALA  51           HA       ALA  51  10.554   4.637 -32.845
  382   1HB   ALA  51          HB1       ALA  51  12.157   3.681 -31.242
  383   2HB   ALA  51          HB2       ALA  51  12.936   4.968 -32.170
  384   3HB   ALA  51          HB3       ALA  51  12.418   5.270 -30.502
  385    H    MET  52           H        MET  52  10.315   6.568 -29.818
  386    HA   MET  52           HA       MET  52   8.603   4.655 -28.520
  387   1HB   MET  52          HB2       MET  52   9.011   7.627 -27.965
  388   2HB   MET  52          HB3       MET  52   8.194   6.487 -26.902
  389   1HG   MET  52          HG2       MET  52  11.121   6.617 -27.616
  390   2HG   MET  52          HG3       MET  52  10.364   6.702 -26.040
  391   1HE   MET  52          HE1       MET  52   9.334   3.022 -25.355
  392   2HE   MET  52          HE2       MET  52   9.156   4.726 -24.934
  393   3HE   MET  52          HE3       MET  52   8.351   4.059 -26.392
  394    H    LYS  53           H        LYS  53   7.903   7.601 -30.475
  395    HA   LYS  53           HA       LYS  53   5.090   7.433 -30.115
  396   1HB   LYS  53          HB2       LYS  53   6.805   8.516 -32.361
  397   2HB   LYS  53          HB3       LYS  53   5.059   8.725 -32.327
  398   1HG   LYS  53          HG2       LYS  53   6.583   9.576 -29.860
  399   2HG   LYS  53          HG3       LYS  53   6.797  10.541 -31.321
  400   1HD   LYS  53          HD2       LYS  53   5.087  11.542 -29.984
  401   2HD   LYS  53          HD3       LYS  53   4.355  10.907 -31.463
  402   1HE   LYS  53          HE2       LYS  53   3.551   8.916 -30.199
  403   2HE   LYS  53          HE3       LYS  53   4.318   9.540 -28.731
  404   1HZ   LYS  53          HZ1       LYS  53   2.109  10.868 -30.201
  405   2HZ   LYS  53          HZ2       LYS  53   1.961  10.068 -28.791
  406   3HZ   LYS  53          HZ3       LYS  53   2.818  11.452 -28.849
  407    H    GLU  54           H        GLU  54   7.263   5.487 -32.100
  408    HA   GLU  54           HA       GLU  54   5.266   4.552 -33.905
  409   1HB   GLU  54          HB2       GLU  54   7.915   4.542 -33.962
  410   2HB   GLU  54          HB3       GLU  54   7.730   2.960 -33.246
  411   1HG   GLU  54          HG2       GLU  54   6.471   3.919 -35.862
  412   2HG   GLU  54          HG3       GLU  54   8.014   3.092 -35.756
  413    H    VAL  55           H        VAL  55   5.898   3.879 -30.545
  414    HA   VAL  55           HA       VAL  55   4.084   1.502 -30.687
  415    HB   VAL  55           HB       VAL  55   5.124   0.831 -28.524
  416   1HG1  VAL  55          HG11      VAL  55   7.165  -0.068 -29.590
  417   2HG1  VAL  55          HG12      VAL  55   5.776  -0.167 -30.675
  418   3HG1  VAL  55          HG13      VAL  55   6.993   1.097 -30.912
  419   1HG2  VAL  55          HG21      VAL  55   6.023   3.110 -27.899
  420   2HG2  VAL  55          HG22      VAL  55   7.208   1.817 -27.781
  421   3HG2  VAL  55          HG23      VAL  55   7.264   2.911 -29.164
  422    H    GLY  56           H        GLY  56   4.005   4.758 -30.008
  423   1HA   GLY  56          HA1       GLY  56   2.076   5.880 -29.370
  424   2HA   GLY  56          HA2       GLY  56   1.409   4.395 -28.669
  425    H    ILE  57           H        ILE  57   4.687   5.706 -28.025
  426    HA   ILE  57           HA       ILE  57   3.903   6.384 -25.236
  427    HB   ILE  57           HB       ILE  57   6.406   5.047 -26.339
  428   1HG1  ILE  57          HG12      ILE  57   4.418   4.112 -24.231
  429   2HG1  ILE  57          HG13      ILE  57   4.436   3.563 -25.901
  430   1HG2  ILE  57          HG21      ILE  57   5.919   6.217 -23.566
  431   2HG2  ILE  57          HG22      ILE  57   7.242   5.103 -23.932
  432   3HG2  ILE  57          HG23      ILE  57   7.195   6.667 -24.718
  433   1HD1  ILE  57          HD11      ILE  57   6.726   2.624 -25.576
  434   2HD1  ILE  57          HD12      ILE  57   6.604   3.013 -23.848
  435   3HD1  ILE  57          HD13      ILE  57   5.474   1.872 -24.586
  436    H    ASP  58           H        ASP  58   5.310   8.125 -24.426
  437    HA   ASP  58           HA       ASP  58   6.531   9.849 -26.504
  438   1HB   ASP  58          HB2       ASP  58   4.436  10.971 -26.031
  439   2HB   ASP  58          HB3       ASP  58   4.653  10.751 -24.281
  440    H    ILE  59           H        ILE  59   8.393  10.786 -25.814
  441    HA   ILE  59           HA       ILE  59   9.208  10.530 -22.990
  442    HB   ILE  59           HB       ILE  59  11.578  10.082 -23.770
  443   1HG1  ILE  59          HG12      ILE  59  10.270   9.132 -26.357
  444   2HG1  ILE  59          HG13      ILE  59  11.112  10.668 -26.212
  445   1HG2  ILE  59          HG21      ILE  59  10.068   8.406 -22.713
  446   2HG2  ILE  59          HG22      ILE  59   9.518   7.897 -24.313
  447   3HG2  ILE  59          HG23      ILE  59  11.216   7.671 -23.828
  448   1HD1  ILE  59          HD11      ILE  59  12.625   9.014 -27.127
  449   2HD1  ILE  59          HD12      ILE  59  13.185   9.449 -25.512
  450   3HD1  ILE  59          HD13      ILE  59  12.350   7.909 -25.776
  451    H    SER  60           H        SER  60   8.307  12.637 -25.346
  452    HA   SER  60           HA       SER  60  10.308  14.672 -25.142
  453   1HB   SER  60          HB2       SER  60   7.349  15.217 -25.439
  454   2HB   SER  60          HB3       SER  60   8.724  16.107 -26.120
  455    HG   SER  60           HG       SER  60   7.587  13.633 -26.825
  456    H    ASN  61           H        ASN  61   7.709  13.595 -23.041
  457    HA   ASN  61           HA       ASN  61   7.600  15.719 -21.188
  458   1HB   ASN  61          HB2       ASN  61   6.505  14.120 -19.713
  459   2HB   ASN  61          HB3       ASN  61   5.928  13.896 -21.354
  460   1HD2  ASN  61          HD21      ASN  61   6.508  11.989 -22.504
  461   2HD2  ASN  61          HD22      ASN  61   7.161  10.575 -21.710
  462    H    GLN  62           H        GLN  62  10.420  13.850 -21.698
  463    HA   GLN  62           HA       GLN  62  11.296  14.245 -18.887
  464   1HB   GLN  62          HB2       GLN  62  12.300  11.912 -18.998
  465   2HB   GLN  62          HB3       GLN  62  10.541  11.990 -18.880
  466   1HG   GLN  62          HG2       GLN  62  10.245  11.487 -21.197
  467   2HG   GLN  62          HG3       GLN  62  11.963  11.761 -21.537
  468   1HE2  GLN  62          HE22      GLN  62  13.240  10.095 -21.689
  469   2HE2  GLN  62          HE21      GLN  62  12.790   8.427 -21.298
  470    H    THR  63           H        THR  63  11.989  16.076 -20.632
  471    HA   THR  63           HA       THR  63  14.143  15.707 -22.318
  472    HB   THR  63           HB       THR  63  14.627  18.183 -21.635
  473    HG1  THR  63           HG1      THR  63  13.614  18.131 -19.593
  474   1HG2  THR  63          HG21      THR  63  13.254  17.511 -23.596
  475   2HG2  THR  63          HG22      THR  63  11.826  17.382 -22.546
  476   3HG2  THR  63          HG23      THR  63  12.603  18.959 -22.810
  477    H    SER  64           H        SER  64  16.293  15.450 -22.164
  478    HA   SER  64           HA       SER  64  17.249  13.997 -20.166
  479   1HB   SER  64          HB2       SER  64  18.897  15.689 -22.070
  480   2HB   SER  64          HB3       SER  64  19.309  14.089 -21.427
  481    HG   SER  64           HG       SER  64  18.238  13.247 -22.966
  482    H    ASP  65           H        ASP  65  19.016  14.103 -18.773
  483    HA   ASP  65           HA       ASP  65  20.280  16.622 -18.089
  484   1HB   ASP  65          HB2       ASP  65  18.188  16.647 -16.669
  485   2HB   ASP  65          HB3       ASP  65  18.713  15.129 -15.938
  486    H    ILE  66           H        ILE  66  22.097  16.243 -16.630
  487    HA   ILE  66           HA       ILE  66  23.408  13.647 -17.044
  488    HB   ILE  66           HB       ILE  66  25.128  14.941 -15.451
  489   1HG1  ILE  66          HG12      ILE  66  23.568  17.001 -15.282
  490   2HG1  ILE  66          HG13      ILE  66  25.289  17.201 -15.534
  491   1HG2  ILE  66          HG21      ILE  66  25.617  14.020 -17.591
  492   2HG2  ILE  66          HG22      ILE  66  24.791  15.362 -18.416
  493   3HG2  ILE  66          HG23      ILE  66  26.290  15.652 -17.489
  494   1HD1  ILE  66          HD11      ILE  66  24.993  17.717 -17.903
  495   2HD1  ILE  66          HD12      ILE  66  23.251  17.419 -17.794
  496   3HD1  ILE  66          HD13      ILE  66  23.976  18.771 -16.910
  497    H    ILE  67           H        ILE  67  24.501  12.710 -15.100
  498    HA   ILE  67           HA       ILE  67  22.629  11.644 -13.349
  499    HB   ILE  67           HB       ILE  67  25.653  11.758 -13.490
  500   1HG1  ILE  67          HG12      ILE  67  23.635   9.479 -13.685
  501   2HG1  ILE  67          HG13      ILE  67  24.219  10.388 -15.071
  502   1HG2  ILE  67          HG21      ILE  67  24.142  10.222 -11.342
  503   2HG2  ILE  67          HG22      ILE  67  25.882  10.111 -11.697
  504   3HG2  ILE  67          HG23      ILE  67  25.225  11.603 -11.060
  505   1HD1  ILE  67          HD11      ILE  67  25.407   8.335 -14.984
  506   2HD1  ILE  67          HD12      ILE  67  26.550   9.626 -14.563
  507   3HD1  ILE  67          HD13      ILE  67  25.877   8.562 -13.299
  508    H    ASP  68           H        ASP  68  22.105  11.925 -11.245
  509    HA   ASP  68           HA       ASP  68  23.358  14.079  -9.654
  510   1HB   ASP  68          HB2       ASP  68  21.156  14.859 -10.713
  511   2HB   ASP  68          HB3       ASP  68  20.353  13.635  -9.719
  512    H    SER  69           H        SER  69  23.655  13.500  -7.536
  513    HA   SER  69           HA       SER  69  23.687  10.863  -6.688
  514   1HB   SER  69          HB2       SER  69  23.504  13.326  -4.933
  515   2HB   SER  69          HB3       SER  69  24.286  11.779  -4.554
  516    HG   SER  69           HG       SER  69  25.788  13.388  -5.222
  517    H    ASP  70           H        ASP  70  21.012  13.144  -6.588
  518    HA   ASP  70           HA       ASP  70  19.604  11.997  -4.378
  519   1HB   ASP  70          HB2       ASP  70  19.365  14.338  -5.181
  520   2HB   ASP  70          HB3       ASP  70  18.588  13.738  -6.652
  521    H    ILE  71           H        ILE  71  20.097  10.775  -7.486
  522    HA   ILE  71           HA       ILE  71  17.697   9.020  -7.284
  523    HB   ILE  71           HB       ILE  71  19.235   9.742  -9.791
  524   1HG1  ILE  71          HG12      ILE  71  16.402  10.727  -9.372
  525   2HG1  ILE  71          HG13      ILE  71  17.706  11.674  -8.672
  526   1HG2  ILE  71          HG21      ILE  71  16.573   8.310  -9.312
  527   2HG2  ILE  71          HG22      ILE  71  17.291   8.658 -10.902
  528   3HG2  ILE  71          HG23      ILE  71  18.108   7.559  -9.782
  529   1HD1  ILE  71          HD11      ILE  71  18.836  11.891 -10.801
  530   2HD1  ILE  71          HD12      ILE  71  17.571  10.922 -11.606
  531   3HD1  ILE  71          HD13      ILE  71  17.173  12.501 -10.892
  532    H    LEU  72           H        LEU  72  21.166   9.280  -8.204
  533    HA   LEU  72           HA       LEU  72  21.902   6.655  -8.584
  534   1HB   LEU  72          HB2       LEU  72  23.322   8.800  -6.957
  535   2HB   LEU  72          HB3       LEU  72  24.044   7.235  -7.220
  536    HG   LEU  72           HG       LEU  72  23.321   9.134  -9.454
  537   1HD1  LEU  72          HD11      LEU  72  25.911   8.570  -7.937
  538   2HD1  LEU  72          HD12      LEU  72  25.882   9.383  -9.508
  539   3HD1  LEU  72          HD13      LEU  72  25.071  10.120  -8.124
  540   1HD2  LEU  72          HD21      LEU  72  25.045   6.611  -9.427
  541   2HD2  LEU  72          HD22      LEU  72  23.435   6.696 -10.136
  542   3HD2  LEU  72          HD23      LEU  72  24.751   7.649 -10.832
  543    H    ASN  73           H        ASN  73  21.897   8.189  -5.384
  544    HA   ASN  73           HA       ASN  73  22.284   5.606  -4.114
  545   1HB   ASN  73          HB2       ASN  73  23.116   6.707  -2.328
  546   2HB   ASN  73          HB3       ASN  73  23.367   7.978  -3.509
  547   1HD2  ASN  73          HD22      ASN  73  21.317   9.616  -3.644
  548   2HD2  ASN  73          HD21      ASN  73  20.618  10.005  -2.093
  549    H    ASN  74           H        ASN  74  19.542   6.830  -5.240
  550    HA   ASN  74           HA       ASN  74  17.843   6.302  -2.827
  551   1HB   ASN  74          HB2       ASN  74  18.056   8.667  -3.526
  552   2HB   ASN  74          HB3       ASN  74  17.595   8.215  -5.163
  553   1HD2  ASN  74          HD22      ASN  74  15.971   9.840  -4.996
  554   2HD2  ASN  74          HD21      ASN  74  14.441   9.490  -4.202
  555    H    ALA  75           H        ALA  75  18.303   5.742  -6.291
  556    HA   ALA  75           HA       ALA  75  15.805   4.587  -6.919
  557   1HB   ALA  75          HB1       ALA  75  18.516   4.130  -8.149
  558   2HB   ALA  75          HB2       ALA  75  16.927   3.759  -8.876
  559   3HB   ALA  75          HB3       ALA  75  17.385   5.441  -8.561
  560    H    ASP  76           H        ASP  76  14.941   2.650  -6.537
  561    HA   ASP  76           HA       ASP  76  16.199   0.800  -4.726
  562   1HB   ASP  76          HB2       ASP  76  13.751   1.125  -4.795
  563   2HB   ASP  76          HB3       ASP  76  13.710   0.490  -6.444
  564    H    LEU  77           H        LEU  77  16.144   1.240  -8.173
  565    HA   LEU  77           HA       LEU  77  18.125  -0.894  -8.438
  566   1HB   LEU  77          HB2       LEU  77  16.054  -2.104  -9.036
  567   2HB   LEU  77          HB3       LEU  77  15.611  -0.820 -10.164
  568    HG   LEU  77           HG       LEU  77  17.605  -1.351 -11.565
  569   1HD1  LEU  77          HD11      LEU  77  17.999  -3.701  -9.653
  570   2HD1  LEU  77          HD12      LEU  77  18.866  -3.434 -11.182
  571   3HD1  LEU  77          HD13      LEU  77  19.114  -2.330  -9.841
  572   1HD2  LEU  77          HD21      LEU  77  15.836  -3.743 -10.982
  573   2HD2  LEU  77          HD22      LEU  77  15.446  -2.384 -12.061
  574   3HD2  LEU  77          HD23      LEU  77  16.780  -3.469 -12.464
  575    H    VAL  78           H        VAL  78  19.658  -0.354  -9.912
  576    HA   VAL  78           HA       VAL  78  19.224   2.012 -11.664
  577    HB   VAL  78           HB       VAL  78  21.749   1.063 -10.214
  578   1HG1  VAL  78          HG11      VAL  78  21.233   3.454 -12.006
  579   2HG1  VAL  78          HG12      VAL  78  22.722   3.199 -11.071
  580   3HG1  VAL  78          HG13      VAL  78  22.310   2.084 -12.384
  581   1HG2  VAL  78          HG21      VAL  78  19.995   3.529  -9.800
  582   2HG2  VAL  78          HG22      VAL  78  20.177   2.183  -8.667
  583   3HG2  VAL  78          HG23      VAL  78  21.549   3.238  -8.984
  584    H    VAL  79           H        VAL  79  19.923   1.679 -13.846
  585    HA   VAL  79           HA       VAL  79  20.833  -1.077 -14.526
  586    HB   VAL  79           HB       VAL  79  18.709   0.521 -15.991
  587   1HG1  VAL  79          HG11      VAL  79  18.211  -1.623 -17.096
  588   2HG1  VAL  79          HG12      VAL  79  19.907  -1.206 -17.339
  589   3HG1  VAL  79          HG13      VAL  79  19.466  -2.430 -16.136
  590   1HG2  VAL  79          HG21      VAL  79  17.680  -0.023 -13.859
  591   2HG2  VAL  79          HG22      VAL  79  17.027  -1.100 -15.087
  592   3HG2  VAL  79          HG23      VAL  79  18.259  -1.702 -13.959
  593    H    THR  80           H        THR  80  22.414  -1.116 -16.023
  594    HA   THR  80           HA       THR  80  23.375   1.488 -17.115
  595    HB   THR  80           HB       THR  80  25.323  -0.726 -16.804
  596    HG1  THR  80           HG1      THR  80  24.032  -1.040 -14.896
  597   1HG2  THR  80          HG21      THR  80  25.916   1.655 -17.324
  598   2HG2  THR  80          HG22      THR  80  25.289   2.129 -15.730
  599   3HG2  THR  80          HG23      THR  80  26.698   1.053 -15.849
  600    H    LEU  81           H        LEU  81  22.876   1.595 -19.265
  601    HA   LEU  81           HA       LEU  81  22.362  -0.906 -20.703
  602   1HB   LEU  81          HB2       LEU  81  21.798   2.010 -21.354
  603   2HB   LEU  81          HB3       LEU  81  21.414   0.666 -22.419
  604    HG   LEU  81           HG       LEU  81  19.911  -0.321 -20.712
  605   1HD1  LEU  81          HD11      LEU  81  19.056   1.162 -18.878
  606   2HD1  LEU  81          HD12      LEU  81  20.676   0.593 -18.589
  607   3HD1  LEU  81          HD13      LEU  81  20.416   2.260 -19.163
  608   1HD2  LEU  81          HD21      LEU  81  19.281   2.556 -21.470
  609   2HD2  LEU  81          HD22      LEU  81  18.917   1.094 -22.426
  610   3HD2  LEU  81          HD23      LEU  81  18.092   1.375 -20.905
  611    H    CYS  82           H        CYS  82  25.167   0.432 -20.199
  612    HA   CYS  82           HA       CYS  82  26.258   1.283 -22.651
  613   1HB   CYS  82          HB2       CYS  82  28.394   1.138 -21.358
  614   2HB   CYS  82          HB3       CYS  82  27.123   2.091 -20.597
  615    H    GLY  83           H        GLY  83  25.535  -0.707 -24.038
  616   1HA   GLY  83          HA1       GLY  83  27.786  -2.712 -24.071
  617   2HA   GLY  83          HA2       GLY  83  26.159  -3.074 -24.597
  618    H    ASP  84           H        ASP  84  27.470   0.048 -25.342
  619    HA   ASP  84           HA       ASP  84  27.626  -0.419 -28.241
  620   1HB   ASP  84          HB2       ASP  84  28.002   2.022 -28.280
  621   2HB   ASP  84          HB3       ASP  84  26.569   1.649 -27.333
  622    H    ALA  85           H        ALA  85  29.609   0.798 -29.236
  623    HA   ALA  85           HA       ALA  85  31.844  -0.840 -28.610
  624   1HB   ALA  85          HB1       ALA  85  32.946   0.375 -30.436
  625   2HB   ALA  85          HB2       ALA  85  31.285  -0.045 -30.886
  626   3HB   ALA  85          HB3       ALA  85  31.688   1.624 -30.397
  627    H    ALA  86           H        ALA  86  30.967   2.244 -27.196
  628    HA   ALA  86           HA       ALA  86  33.798   2.849 -26.499
  629   1HB   ALA  86          HB1       ALA  86  31.290   4.546 -26.175
  630   2HB   ALA  86          HB2       ALA  86  32.964   5.042 -25.869
  631   3HB   ALA  86          HB3       ALA  86  32.438   4.662 -27.525
  632    H    ASP  87           H        ASP  87  30.632   2.059 -25.173
  633    HA   ASP  87           HA       ASP  87  29.877   1.669 -23.102
  634   1HB   ASP  87          HB2       ASP  87  30.436  -0.421 -22.252
  635   2HB   ASP  87          HB3       ASP  87  30.500  -0.510 -23.988
  636    H    LYS  88           H        LYS  88  30.932   3.932 -22.609
  637    HA   LYS  88           HA       LYS  88  33.037   4.066 -20.734
  638   1HB   LYS  88          HB2       LYS  88  30.647   5.942 -20.911
  639   2HB   LYS  88          HB3       LYS  88  32.194   6.291 -20.161
  640   1HG   LYS  88          HG2       LYS  88  31.663   5.891 -23.129
  641   2HG   LYS  88          HG3       LYS  88  32.021   7.402 -22.303
  642   1HD   LYS  88          HD2       LYS  88  33.943   5.055 -22.638
  643   2HD   LYS  88          HD3       LYS  88  33.954   6.561 -23.559
  644   1HE   LYS  88          HE2       LYS  88  34.364   7.844 -21.461
  645   2HE   LYS  88          HE3       LYS  88  34.401   6.332 -20.547
  646   1HZ   LYS  88          HZ1       LYS  88  36.622   7.077 -21.107
  647   2HZ   LYS  88          HZ2       LYS  88  36.332   5.664 -21.863
  648   3HZ   LYS  88          HZ3       LYS  88  36.299   7.068 -22.701
  649    H    CYS  89           H        CYS  89  29.736   3.111 -20.241
  650    HA   CYS  89           HA       CYS  89  28.429   2.670 -18.459
  651   1HB   CYS  89          HB2       CYS  89  30.991   1.372 -17.547
  652   2HB   CYS  89          HB3       CYS  89  29.402   1.076 -16.855
  653    HA   PRO  90           HA       PRO  90  29.371   6.519 -16.172
  654   1HB   PRO  90          HB2       PRO  90  26.459   6.055 -15.561
  655   2HB   PRO  90          HB3       PRO  90  27.312   7.580 -15.962
  656   1HG   PRO  90          HG2       PRO  90  25.837   6.253 -17.828
  657   2HG   PRO  90          HG3       PRO  90  27.386   7.037 -18.268
  658   1HD   PRO  90          HD2       PRO  90  26.800   4.144 -17.788
  659   2HD   PRO  90          HD3       PRO  90  27.903   4.911 -18.974
  660    H    MET  91           H        MET  91  29.979   6.778 -14.066
  661    HA   MET  91           HA       MET  91  30.222   4.503 -12.420
  662   1HB   MET  91          HB2       MET  91  31.814   6.404 -12.496
  663   2HB   MET  91          HB3       MET  91  30.603   7.455 -11.740
  664   1HG   MET  91          HG2       MET  91  30.615   6.028  -9.726
  665   2HG   MET  91          HG3       MET  91  31.766   4.929 -10.496
  666   1HE   MET  91          HE1       MET  91  33.271   5.063  -8.328
  667   2HE   MET  91          HE2       MET  91  33.833   6.586  -7.605
  668   3HE   MET  91          HE3       MET  91  32.103   6.181  -7.586
  669    H    THR  92           H        THR  92  29.008   3.729 -10.802
  670    HA   THR  92           HA       THR  92  26.773   5.282  -9.650
  671    HB   THR  92           HB       THR  92  25.900   2.888  -9.265
  672    HG1  THR  92           HG1      THR  92  27.777   1.715  -9.620
  673   1HG2  THR  92          HG21      THR  92  25.061   4.346 -11.120
  674   2HG2  THR  92          HG22      THR  92  26.346   3.700 -12.167
  675   3HG2  THR  92          HG23      THR  92  25.069   2.625 -11.556
  676    HA   PRO  93           HA       PRO  93  28.748   4.470  -5.672
  677   1HB   PRO  93          HB2       PRO  93  26.614   4.172  -3.965
  678   2HB   PRO  93          HB3       PRO  93  27.121   5.752  -4.637
  679   1HG   PRO  93          HG2       PRO  93  24.924   3.922  -5.631
  680   2HG   PRO  93          HG3       PRO  93  24.850   5.689  -5.356
  681   1HD   PRO  93          HD2       PRO  93  25.283   4.613  -7.830
  682   2HD   PRO  93          HD3       PRO  93  26.079   6.134  -7.321
  683    HA   PRO  94           HA       PRO  94  28.745   0.035  -5.673
  684   1HB   PRO  94          HB2       PRO  94  29.930  -0.627  -3.305
  685   2HB   PRO  94          HB3       PRO  94  30.801   0.209  -4.626
  686   1HG   PRO  94          HG2       PRO  94  29.523   1.438  -2.169
  687   2HG   PRO  94          HG3       PRO  94  31.161   1.738  -2.833
  688   1HD   PRO  94          HD2       PRO  94  29.012   3.375  -3.357
  689   2HD   PRO  94          HD3       PRO  94  30.311   3.093  -4.560
  690    H    HIS  95           H        HIS  95  27.085   1.710  -3.046
  691    HA   HIS  95           HA       HIS  95  26.013  -0.594  -1.760
  692   1HB   HIS  95          HB2       HIS  95  26.363   1.623  -0.695
  693   2HB   HIS  95          HB3       HIS  95  25.100   2.314  -1.718
  694    HD1  HIS  95           HD1      HIS  95  22.706   2.254  -0.633
  695    HD2  HIS  95           HD2      HIS  95  25.449  -0.500   0.994
  696    HE1  HIS  95           HE1      HIS  95  21.525   1.142   1.326
  697    H    VAL  96           H        VAL  96  24.842   1.337  -4.510
  698    HA   VAL  96           HA       VAL  96  22.105   0.544  -4.110
  699    HB   VAL  96           HB       VAL  96  22.916   2.693  -5.217
  700   1HG1  VAL  96          HG11      VAL  96  23.011   1.067  -7.774
  701   2HG1  VAL  96          HG12      VAL  96  23.314   2.805  -7.545
  702   3HG1  VAL  96          HG13      VAL  96  24.456   1.618  -6.903
  703   1HG2  VAL  96          HG21      VAL  96  20.747   1.123  -6.627
  704   2HG2  VAL  96          HG22      VAL  96  20.584   1.982  -5.077
  705   3HG2  VAL  96          HG23      VAL  96  20.929   2.886  -6.544
  706    H    LYS  97           H        LYS  97  20.879  -0.902  -5.289
  707    HA   LYS  97           HA       LYS  97  22.167  -3.286  -6.346
  708   1HB   LYS  97          HB2       LYS  97  19.929  -3.279  -5.179
  709   2HB   LYS  97          HB3       LYS  97  19.258  -2.364  -6.541
  710   1HG   LYS  97          HG2       LYS  97  19.842  -4.252  -8.070
  711   2HG   LYS  97          HG3       LYS  97  20.506  -5.147  -6.691
  712   1HD   LYS  97          HD2       LYS  97  18.273  -5.123  -5.602
  713   2HD   LYS  97          HD3       LYS  97  17.607  -4.230  -6.989
  714   1HE   LYS  97          HE2       LYS  97  18.212  -6.111  -8.493
  715   2HE   LYS  97          HE3       LYS  97  18.914  -6.988  -7.130
  716   1HZ   LYS  97          HZ1       LYS  97  16.051  -6.264  -7.384
  717   2HZ   LYS  97          HZ2       LYS  97  16.679  -7.749  -7.610
  718   3HZ   LYS  97          HZ3       LYS  97  16.709  -7.078  -6.128
  719    H    ARG  98           H        ARG  98  22.718  -3.607  -8.482
  720    HA   ARG  98           HA       ARG  98  21.824  -1.605 -10.469
  721   1HB   ARG  98          HB2       ARG  98  24.050  -0.987  -9.500
  722   2HB   ARG  98          HB3       ARG  98  24.705  -2.501 -10.142
  723   1HG   ARG  98          HG2       ARG  98  24.205  -1.744 -12.452
  724   2HG   ARG  98          HG3       ARG  98  23.412  -0.289 -11.816
  725   1HD   ARG  98          HD2       ARG  98  25.610   0.337 -12.546
  726   2HD   ARG  98          HD3       ARG  98  25.549   0.403 -10.788
  727    HE   ARG  98           HE       ARG  98  27.043  -1.336 -10.612
  728   1HH1  ARG  98          HH11      ARG  98  26.166  -0.938 -14.040
  729   2HH1  ARG  98          HH12      ARG  98  27.475  -1.914 -14.618
  730   1HH2  ARG  98          HH21      ARG  98  28.742  -2.663 -11.390
  731   2HH2  ARG  98          HH22      ARG  98  28.960  -2.916 -13.077
  732    H    GLU  99           H        GLU  99  21.756  -2.321 -12.583
  733    HA   GLU  99           HA       GLU  99  22.221  -5.198 -13.197
  734   1HB   GLU  99          HB2       GLU  99  19.851  -3.365 -13.588
  735   2HB   GLU  99          HB3       GLU  99  20.245  -4.431 -14.919
  736   1HG   GLU  99          HG2       GLU  99  19.905  -5.505 -12.104
  737   2HG   GLU  99          HG3       GLU  99  18.535  -5.238 -13.183
  738    H    HIS 100           H        HIS 100  22.680  -5.503 -15.517
  739    HA   HIS 100           HA       HIS 100  23.669  -3.099 -16.933
  740   1HB   HIS 100          HB2       HIS 100  25.616  -4.108 -15.893
  741   2HB   HIS 100          HB3       HIS 100  25.163  -5.705 -16.494
  742    HD1  HIS 100           HD1      HIS 100  25.173  -2.544 -18.763
  743    HD2  HIS 100           HD2      HIS 100  27.253  -6.139 -18.023
  744    HE1  HIS 100           HE1      HIS 100  26.858  -2.815 -20.649
  745    H    TRP 101           H        TRP 101  22.557  -2.990 -18.753
  746    HA   TRP 101           HA       TRP 101  21.451  -5.450 -20.050
  747   1HB   TRP 101          HB2       TRP 101  20.203  -2.687 -19.740
  748   2HB   TRP 101          HB3       TRP 101  19.595  -3.948 -20.793
  749    HD1  TRP 101           HD1      TRP 101  20.503  -5.295 -17.386
  750    HE1  TRP 101           HE1      TRP 101  18.446  -5.735 -16.024
  751    HE3  TRP 101           HE3      TRP 101  17.077  -3.104 -20.489
  752    HZ2  TRP 101           HZ2      TRP 101  15.596  -5.072 -16.158
  753    HZ3  TRP 101           HZ3      TRP 101  14.671  -3.150 -19.907
  754    HH2  TRP 101           HH2      TRP 101  13.926  -4.083 -17.715
  755    H    GLY 102           H        GLY 102  23.861  -5.069 -20.872
  756   1HA   GLY 102          HA1       GLY 102  24.402  -2.737 -22.412
  757   2HA   GLY 102          HA2       GLY 102  25.349  -4.225 -22.388
  758    H    PHE 103           H        PHE 103  23.685  -2.228 -24.380
  759    HA   PHE 103           HA       PHE 103  23.925  -4.087 -26.583
  760   1HB   PHE 103          HB2       PHE 103  21.618  -3.195 -27.479
  761   2HB   PHE 103          HB3       PHE 103  21.708  -4.618 -26.468
  762    HD1  PHE 103           HD1      PHE 103  21.306  -0.881 -26.050
  763    HD2  PHE 103           HD2      PHE 103  20.158  -4.833 -24.751
  764    HE1  PHE 103           HE1      PHE 103  19.814   0.102 -24.331
  765    HE2  PHE 103           HE2      PHE 103  18.640  -3.839 -23.064
  766    HZ   PHE 103           HZ       PHE 103  18.535  -1.373 -22.792
  767    H    ASP 104           H        ASP 104  23.843  -2.771 -28.654
  768    HA   ASP 104           HA       ASP 104  25.568  -0.546 -28.229
  769   1HB   ASP 104          HB2       ASP 104  25.754  -2.174 -30.109
  770   2HB   ASP 104          HB3       ASP 104  24.275  -1.502 -30.804
  771    H    ASP 105           H        ASP 105  25.292   1.587 -29.022
  772    HA   ASP 105           HA       ASP 105  22.658   2.649 -28.248
  773   1HB   ASP 105          HB2       ASP 105  24.845   3.756 -27.565
  774   2HB   ASP 105          HB3       ASP 105  25.012   4.284 -29.234
  775    HA   PRO 106           HA       PRO 106  21.537   2.454 -32.513
  776   1HB   PRO 106          HB2       PRO 106  19.177   3.845 -32.549
  777   2HB   PRO 106          HB3       PRO 106  19.352   2.208 -31.864
  778   1HG   PRO 106          HG2       PRO 106  19.369   4.830 -30.361
  779   2HG   PRO 106          HG3       PRO 106  18.479   3.323 -29.963
  780   1HD   PRO 106          HD2       PRO 106  20.863   3.974 -28.811
  781   2HD   PRO 106          HD3       PRO 106  20.465   2.276 -29.203
  782    H    ALA 107           H        ALA 107  22.047   5.609 -30.969
  783    HA   ALA 107           HA       ALA 107  22.047   7.029 -33.503
  784   1HB   ALA 107          HB1       ALA 107  22.987   8.889 -32.221
  785   2HB   ALA 107          HB2       ALA 107  21.569   8.211 -31.401
  786   3HB   ALA 107          HB3       ALA 107  23.210   7.839 -30.810
  787    H    ARG 108           H        ARG 108  24.153   4.776 -32.022
  788    HA   ARG 108           HA       ARG 108  26.578   5.854 -33.365
  789   1HB   ARG 108          HB2       ARG 108  26.431   5.186 -30.838
  790   2HB   ARG 108          HB3       ARG 108  26.416   3.528 -31.431
  791   1HG   ARG 108          HG2       ARG 108  28.614   4.468 -32.757
  792   2HG   ARG 108          HG3       ARG 108  28.598   5.605 -31.417
  793   1HD   ARG 108          HD2       ARG 108  30.025   3.724 -30.810
  794   2HD   ARG 108          HD3       ARG 108  28.571   3.655 -29.822
  795    HE   ARG 108           HE       ARG 108  27.847   1.730 -30.923
  796   1HH1  ARG 108          HH11      ARG 108  30.746   2.952 -32.605
  797   2HH1  ARG 108          HH12      ARG 108  30.754   1.688 -33.774
  798   1HH2  ARG 108          HH21      ARG 108  27.765   0.189 -32.541
  799   2HH2  ARG 108          HH22      ARG 108  29.064   0.012 -33.686
  800    H    ALA 109           H        ALA 109  24.029   3.883 -34.153
  801    HA   ALA 109           HA       ALA 109  25.376   1.677 -35.402
  802   1HB   ALA 109          HB1       ALA 109  23.155   1.222 -36.389
  803   2HB   ALA 109          HB2       ALA 109  23.040   1.528 -34.643
  804   3HB   ALA 109          HB3       ALA 109  22.560   2.783 -35.805
  805    H    GLN 110           H        GLN 110  27.053   3.216 -36.399
  806    HA   GLN 110           HA       GLN 110  26.424   5.175 -38.268
  807   1HB   GLN 110          HB2       GLN 110  28.917   3.453 -38.436
  808   2HB   GLN 110          HB3       GLN 110  28.717   5.116 -38.966
  809   1HG   GLN 110          HG2       GLN 110  28.889   4.086 -36.112
  810   2HG   GLN 110          HG3       GLN 110  30.086   5.017 -36.978
  811   1HE2  GLN 110          HE22      GLN 110  29.411   5.931 -34.532
  812   2HE2  GLN 110          HE21      GLN 110  28.463   7.390 -34.660
  813    H    GLY 111           H        GLY 111  26.032   5.261 -40.377
  814   1HA   GLY 111          HA1       GLY 111  26.773   3.602 -42.437
  815   2HA   GLY 111          HA2       GLY 111  25.210   2.940 -41.908
  816    H    THR 112           H        THR 112  23.515   4.769 -41.414
  817    HA   THR 112           HA       THR 112  23.747   7.310 -42.579
  818    HB   THR 112           HB       THR 112  23.486   6.212 -44.737
  819    HG1  THR 112           HG1      THR 112  21.841   7.393 -45.462
  820   1HG2  THR 112          HG21      THR 112  21.433   4.957 -45.342
  821   2HG2  THR 112          HG22      THR 112  22.430   4.108 -44.160
  822   3HG2  THR 112          HG23      THR 112  20.949   4.943 -43.635
  823    H    GLU 113           H        GLU 113  21.486   8.397 -42.435
  824    HA   GLU 113           HA       GLU 113  20.642   8.080 -39.729
  825   1HB   GLU 113          HB2       GLU 113  18.985   9.785 -40.231
  826   2HB   GLU 113          HB3       GLU 113  20.569  10.226 -40.870
  827   1HG   GLU 113          HG2       GLU 113  19.832   9.487 -43.150
  828   2HG   GLU 113          HG3       GLU 113  18.237   9.111 -42.495
  829    H    GLU 114           H        GLU 114  19.443   6.695 -42.756
  830    HA   GLU 114           HA       GLU 114  16.981   5.740 -41.648
  831   1HB   GLU 114          HB2       GLU 114  17.377   6.089 -44.057
  832   2HB   GLU 114          HB3       GLU 114  18.537   4.751 -44.066
  833   1HG   GLU 114          HG2       GLU 114  16.750   3.172 -43.445
  834   2HG   GLU 114          HG3       GLU 114  15.601   4.501 -43.274
  835    H    GLU 115           H        GLU 115  20.285   4.420 -41.821
  836    HA   GLU 115           HA       GLU 115  19.539   1.777 -40.896
  837   1HB   GLU 115          HB2       GLU 115  22.200   3.250 -41.033
  838   2HB   GLU 115          HB3       GLU 115  22.046   1.638 -40.350
  839   1HG   GLU 115          HG2       GLU 115  21.195   2.347 -43.186
  840   2HG   GLU 115          HG3       GLU 115  22.786   1.729 -42.758
  841    H    LYS 116           H        LYS 116  20.820   4.778 -39.393
  842    HA   LYS 116           HA       LYS 116  20.823   3.850 -36.714
  843   1HB   LYS 116          HB2       LYS 116  20.438   6.629 -37.905
  844   2HB   LYS 116          HB3       LYS 116  20.535   6.316 -36.157
  845   1HG   LYS 116          HG2       LYS 116  22.739   5.206 -36.506
  846   2HG   LYS 116          HG3       LYS 116  22.666   5.635 -38.227
  847   1HD   LYS 116          HD2       LYS 116  22.591   8.061 -37.571
  848   2HD   LYS 116          HD3       LYS 116  22.749   7.558 -35.868
  849   1HE   LYS 116          HE2       LYS 116  24.827   6.221 -36.646
  850   2HE   LYS 116          HE3       LYS 116  24.726   7.137 -38.155
  851   1HZ   LYS 116          HZ1       LYS 116  25.110   8.244 -35.438
  852   2HZ   LYS 116          HZ2       LYS 116  26.251   8.119 -36.610
  853   3HZ   LYS 116          HZ3       LYS 116  24.997   9.169 -36.808
  854    H    TRP 117           H        TRP 117  18.179   5.465 -38.570
  855    HA   TRP 117           HA       TRP 117  16.274   5.409 -36.518
  856   1HB   TRP 117          HB2       TRP 117  15.919   6.734 -38.464
  857   2HB   TRP 117          HB3       TRP 117  16.104   5.352 -39.536
  858    HD1  TRP 117           HD1      TRP 117  13.943   4.941 -40.699
  859    HE1  TRP 117           HE1      TRP 117  11.510   4.615 -40.051
  860    HE3  TRP 117           HE3      TRP 117  14.282   6.077 -35.718
  861    HZ2  TRP 117           HZ2      TRP 117   9.856   4.900 -37.669
  862    HZ3  TRP 117           HZ3      TRP 117  12.318   5.901 -34.274
  863    HH2  TRP 117           HH2      TRP 117  10.080   5.301 -35.222
  864    H    ALA 118           H        ALA 118  17.114   2.798 -38.872
  865    HA   ALA 118           HA       ALA 118  14.999   1.075 -38.008
  866   1HB   ALA 118          HB1       ALA 118  16.256  -0.680 -39.189
  867   2HB   ALA 118          HB2       ALA 118  16.127   0.795 -40.167
  868   3HB   ALA 118          HB3       ALA 118  17.655   0.405 -39.340
  869    H    PHE 119           H        PHE 119  18.407   1.460 -37.028
  870    HA   PHE 119           HA       PHE 119  18.398  -0.655 -35.136
  871   1HB   PHE 119          HB2       PHE 119  20.349   0.849 -36.201
  872   2HB   PHE 119          HB3       PHE 119  20.172   1.720 -34.689
  873    HD1  PHE 119           HD1      PHE 119  21.361  -1.310 -36.353
  874    HD2  PHE 119           HD2      PHE 119  20.534   0.425 -32.495
  875    HE1  PHE 119           HE1      PHE 119  22.756  -3.048 -35.263
  876    HE2  PHE 119           HE2      PHE 119  21.930  -1.303 -31.410
  877    HZ   PHE 119           HZ       PHE 119  23.048  -3.049 -32.791
  878    H    PHE 120           H        PHE 120  17.455   2.761 -34.855
  879    HA   PHE 120           HA       PHE 120  17.033   2.840 -32.043
  880   1HB   PHE 120          HB2       PHE 120  16.080   4.408 -34.416
  881   2HB   PHE 120          HB3       PHE 120  15.033   4.452 -33.024
  882    HD1  PHE 120           HD1      PHE 120  15.913   5.190 -30.779
  883    HD2  PHE 120           HD2      PHE 120  18.108   5.762 -34.445
  884    HE1  PHE 120           HE1      PHE 120  17.298   6.929 -29.691
  885    HE2  PHE 120           HE2      PHE 120  19.476   7.513 -33.355
  886    HZ   PHE 120           HZ       PHE 120  19.028   8.144 -30.999
  887    H    GLN 121           H        GLN 121  14.762   1.843 -34.657
  888    HA   GLN 121           HA       GLN 121  12.648   1.202 -32.822
  889   1HB   GLN 121          HB2       GLN 121  13.301   0.354 -35.666
  890   2HB   GLN 121          HB3       GLN 121  11.861  -0.228 -34.823
  891   1HG   GLN 121          HG2       GLN 121  10.889   1.909 -34.692
  892   2HG   GLN 121          HG3       GLN 121  12.423   2.746 -34.948
  893   1HE2  GLN 121          HE22      GLN 121  13.385   2.807 -37.037
  894   2HE2  GLN 121          HE21      GLN 121  12.428   2.541 -38.475
  895    H    ARG 122           H        ARG 122  15.380  -0.744 -34.102
  896    HA   ARG 122           HA       ARG 122  14.513  -3.219 -32.930
  897   1HB   ARG 122          HB2       ARG 122  17.265  -2.172 -33.732
  898   2HB   ARG 122          HB3       ARG 122  16.999  -3.802 -33.119
  899   1HG   ARG 122          HG2       ARG 122  15.631  -4.419 -34.984
  900   2HG   ARG 122          HG3       ARG 122  15.470  -2.750 -35.530
  901   1HD   ARG 122          HD2       ARG 122  17.021  -3.985 -36.957
  902   2HD   ARG 122          HD3       ARG 122  17.823  -2.639 -36.134
  903    HE   ARG 122           HE       ARG 122  18.103  -5.080 -34.635
  904   1HH1  ARG 122          HH21      ARG 122  19.352  -3.512 -37.566
  905   2HH1  ARG 122          HH22      ARG 122  20.885  -4.295 -37.505
  906   1HH2  ARG 122          HH11      ARG 122  20.160  -6.107 -34.536
  907   2HH2  ARG 122          HH12      ARG 122  21.346  -5.813 -35.747
  908    H    VAL 123           H        VAL 123  16.809  -0.687 -31.666
  909    HA   VAL 123           HA       VAL 123  17.221  -2.107 -29.211
  910    HB   VAL 123           HB       VAL 123  17.662   0.778 -30.067
  911   1HG1  VAL 123          HG11      VAL 123  17.413   0.883 -27.656
  912   2HG1  VAL 123          HG12      VAL 123  18.444  -0.550 -27.434
  913   3HG1  VAL 123          HG13      VAL 123  19.131   0.970 -28.039
  914   1HG2  VAL 123          HG21      VAL 123  20.021   0.092 -30.108
  915   2HG2  VAL 123          HG22      VAL 123  19.598  -1.521 -29.507
  916   3HG2  VAL 123          HG23      VAL 123  19.080  -1.011 -31.122
  917    H    ARG 124           H        ARG 124  14.839   0.397 -30.210
  918    HA   ARG 124           HA       ARG 124  13.560   0.795 -27.716
  919   1HB   ARG 124          HB2       ARG 124  13.010   2.201 -29.580
  920   2HB   ARG 124          HB3       ARG 124  12.716   0.835 -30.617
  921   1HG   ARG 124          HG2       ARG 124  10.719   0.502 -28.723
  922   2HG   ARG 124          HG3       ARG 124  10.882   2.250 -28.786
  923   1HD   ARG 124          HD2       ARG 124   9.198   1.484 -30.357
  924   2HD   ARG 124          HD3       ARG 124  10.563   2.166 -31.248
  925    HE   ARG 124           HE       ARG 124  11.110  -0.556 -31.136
  926   1HH1  ARG 124          HH21      ARG 124   8.579   1.504 -32.427
  927   2HH1  ARG 124          HH22      ARG 124   8.138   0.468 -33.740
  928   1HH2  ARG 124          HH11      ARG 124  10.639  -1.963 -32.896
  929   2HH2  ARG 124          HH12      ARG 124   9.353  -1.583 -33.988
  930    H    ASP 125           H        ASP 125  12.875  -1.701 -30.280
  931    HA   ASP 125           HA       ASP 125  10.725  -2.806 -28.785
  932   1HB   ASP 125          HB2       ASP 125  10.972  -3.174 -31.191
  933   2HB   ASP 125          HB3       ASP 125  12.484  -4.051 -30.940
  934    H    GLU 126           H        GLU 126  14.215  -3.743 -28.946
  935    HA   GLU 126           HA       GLU 126  13.947  -6.027 -27.273
  936   1HB   GLU 126          HB2       GLU 126  16.273  -4.198 -27.930
  937   2HB   GLU 126          HB3       GLU 126  16.447  -5.632 -26.912
  938   1HG   GLU 126          HG2       GLU 126  15.332  -5.765 -29.744
  939   2HG   GLU 126          HG3       GLU 126  17.046  -5.902 -29.374
  940    H    ILE 127           H        ILE 127  14.663  -2.588 -26.480
  941    HA   ILE 127           HA       ILE 127  15.030  -2.927 -23.673
  942    HB   ILE 127           HB       ILE 127  14.119  -0.630 -25.447
  943   1HG1  ILE 127          HG12      ILE 127  16.552  -1.020 -23.663
  944   2HG1  ILE 127          HG13      ILE 127  16.548  -1.366 -25.386
  945   1HG2  ILE 127          HG21      ILE 127  14.524  -0.410 -22.437
  946   2HG2  ILE 127          HG22      ILE 127  14.152   0.898 -23.594
  947   3HG2  ILE 127          HG23      ILE 127  12.949  -0.327 -23.251
  948   1HD1  ILE 127          HD11      ILE 127  17.569   0.775 -25.118
  949   2HD1  ILE 127          HD12      ILE 127  15.948   1.087 -25.776
  950   3HD1  ILE 127          HD13      ILE 127  16.293   1.354 -24.050
  951    H    GLY 128           H        GLY 128  12.074  -2.111 -25.581
  952   1HA   GLY 128          HA1       GLY 128  10.190  -2.149 -23.562
  953   2HA   GLY 128          HA2       GLY 128   9.888  -2.671 -25.233
  954    H    ASN 129           H        ASN 129  11.409  -5.004 -25.409
  955    HA   ASN 129           HA       ASN 129   9.729  -6.902 -24.143
  956   1HB   ASN 129          HB2       ASN 129  12.413  -7.155 -25.543
  957   2HB   ASN 129          HB3       ASN 129  11.724  -8.525 -24.692
  958   1HD2  ASN 129          HD22      ASN 129  11.211  -6.317 -27.426
  959   2HD2  ASN 129          HD21      ASN 129  10.068  -7.347 -28.251
  960    H    ARG 130           H        ARG 130  13.059  -5.857 -23.223
  961    HA   ARG 130           HA       ARG 130  13.024  -7.784 -21.048
  962   1HB   ARG 130          HB2       ARG 130  15.139  -7.079 -22.113
  963   2HB   ARG 130          HB3       ARG 130  14.892  -5.432 -21.519
  964   1HG   ARG 130          HG2       ARG 130  16.474  -6.545 -20.090
  965   2HG   ARG 130          HG3       ARG 130  14.992  -6.266 -19.195
  966   1HD   ARG 130          HD2       ARG 130  14.344  -8.678 -19.618
  967   2HD   ARG 130          HD3       ARG 130  15.990  -8.934 -20.221
  968    HE   ARG 130           HE       ARG 130  15.048  -8.651 -17.491
  969   1HH1  ARG 130          HH21      ARG 130  17.983  -8.071 -19.446
  970   2HH1  ARG 130          HH22      ARG 130  18.995  -7.866 -18.062
  971   1HH2  ARG 130          HH11      ARG 130  16.401  -8.492 -15.713
  972   2HH2  ARG 130          HH12      ARG 130  18.057  -7.975 -15.880
  973    H    LEU 131           H        LEU 131  12.092  -4.339 -21.352
  974    HA   LEU 131           HA       LEU 131  11.842  -3.889 -18.547
  975   1HB   LEU 131          HB2       LEU 131  11.423  -2.327 -20.863
  976   2HB   LEU 131          HB3       LEU 131   9.844  -2.478 -20.144
  977    HG   LEU 131           HG       LEU 131  10.799  -0.527 -19.285
  978   1HD1  LEU 131          HD11      LEU 131   9.602  -1.860 -17.570
  979   2HD1  LEU 131          HD12      LEU 131  11.142  -2.571 -17.066
  980   3HD1  LEU 131          HD13      LEU 131  10.877  -0.850 -16.859
  981   1HD2  LEU 131          HD21      LEU 131  12.936  -0.221 -18.379
  982   2HD2  LEU 131          HD22      LEU 131  13.247  -1.957 -18.268
  983   3HD2  LEU 131          HD23      LEU 131  13.176  -1.147 -19.853
  984    H    LYS 132           H        LYS 132   9.631  -5.221 -21.034
  985    HA   LYS 132           HA       LYS 132   7.350  -5.497 -19.405
  986   1HB   LYS 132          HB2       LYS 132   7.397  -5.840 -21.880
  987   2HB   LYS 132          HB3       LYS 132   8.264  -7.354 -21.645
  988   1HG   LYS 132          HG2       LYS 132   6.392  -8.301 -20.380
  989   2HG   LYS 132          HG3       LYS 132   5.505  -6.765 -20.506
  990   1HD   LYS 132          HD2       LYS 132   5.487  -6.977 -22.982
  991   2HD   LYS 132          HD3       LYS 132   6.381  -8.509 -22.859
  992   1HE   LYS 132          HE2       LYS 132   4.519  -9.478 -21.519
  993   2HE   LYS 132          HE3       LYS 132   3.630  -7.956 -21.647
  994   1HZ   LYS 132          HZ1       LYS 132   3.544  -8.285 -24.052
  995   2HZ   LYS 132          HZ2       LYS 132   4.367  -9.694 -23.933
  996   3HZ   LYS 132          HZ3       LYS 132   2.880  -9.558 -23.285
  997    H    GLU 133           H        GLU 133   9.982  -7.854 -20.024
  998    HA   GLU 133           HA       GLU 133   8.904  -9.763 -18.238
  999   1HB   GLU 133          HB2       GLU 133  11.828  -9.465 -19.002
 1000   2HB   GLU 133          HB3       GLU 133  11.060 -10.870 -18.229
 1001   1HG   GLU 133          HG2       GLU 133   9.567 -11.133 -20.187
 1002   2HG   GLU 133          HG3       GLU 133  10.371  -9.786 -20.987
 1003    H    PHE 134           H        PHE 134  11.182  -7.091 -17.626
 1004    HA   PHE 134           HA       PHE 134  11.805  -7.819 -14.974
 1005   1HB   PHE 134          HB2       PHE 134  13.115  -6.169 -16.110
 1006   2HB   PHE 134          HB3       PHE 134  11.701  -5.177 -16.451
 1007    HD1  PHE 134           HD1      PHE 134  13.689  -6.513 -13.539
 1008    HD2  PHE 134           HD2      PHE 134  11.144  -3.382 -15.057
 1009    HE1  PHE 134           HE1      PHE 134  14.014  -5.217 -11.446
 1010    HE2  PHE 134           HE2      PHE 134  11.526  -2.054 -13.012
 1011    HZ   PHE 134           HZ       PHE 134  12.954  -2.983 -11.183
 1012    H    ALA 135           H        ALA 135   8.998  -6.121 -16.303
 1013    HA   ALA 135           HA       ALA 135   8.017  -5.383 -13.666
 1014   1HB   ALA 135          HB1       ALA 135   7.630  -3.982 -15.702
 1015   2HB   ALA 135          HB2       ALA 135   6.654  -5.294 -16.398
 1016   3HB   ALA 135          HB3       ALA 135   6.107  -4.469 -14.923
 1017    H    GLU 136           H        GLU 136   7.360  -7.841 -16.124
 1018    HA   GLU 136           HA       GLU 136   4.944  -8.792 -14.845
 1019   1HB   GLU 136          HB2       GLU 136   5.060  -8.609 -17.250
 1020   2HB   GLU 136          HB3       GLU 136   6.499  -9.637 -17.321
 1021   1HG   GLU 136          HG2       GLU 136   5.258 -11.582 -16.612
 1022   2HG   GLU 136          HG3       GLU 136   3.815 -10.612 -16.292
 1023    H    THR 137           H        THR 137   8.228 -10.014 -15.382
 1024    HA   THR 137           HA       THR 137   7.560 -12.502 -13.911
 1025    HB   THR 137           HB       THR 137   9.174 -13.640 -15.205
 1026    HG1  THR 137           HG1      THR 137   9.894 -11.066 -16.122
 1027   1HG2  THR 137          HG21      THR 137   7.655 -11.861 -17.153
 1028   2HG2  THR 137          HG22      THR 137   8.291 -13.491 -17.441
 1029   3HG2  THR 137          HG23      THR 137   6.958 -13.262 -16.297
 1030    H    GLY 138           H        GLY 138   9.564  -9.651 -13.848
 1031   1HA   GLY 138          HA1       GLY 138  10.750  -8.855 -12.000
 1032   2HA   GLY 138          HA2       GLY 138  10.751 -10.464 -11.273
 1033    H    LYS 139           H        LYS 139  11.656 -10.472 -14.652
 1034    HA   LYS 139           HA       LYS 139  14.328 -11.292 -13.850
 1035   1HB   LYS 139          HB2       LYS 139  12.883 -11.428 -16.513
 1036   2HB   LYS 139          HB3       LYS 139  14.518 -12.025 -16.225
 1037   1HG   LYS 139          HG2       LYS 139  12.028 -12.996 -14.768
 1038   2HG   LYS 139          HG3       LYS 139  12.780 -13.808 -16.149
 1039   1HD   LYS 139          HD2       LYS 139  14.849 -14.122 -14.767
 1040   2HD   LYS 139          HD3       LYS 139  13.999 -13.373 -13.387
 1041   1HE   LYS 139          HE2       LYS 139  12.237 -15.089 -13.513
 1042   2HE   LYS 139          HE3       LYS 139  13.059 -15.856 -14.878
 1043   1HZ   LYS 139          HZ1       LYS 139  14.175 -15.612 -12.142
 1044   2HZ   LYS 139          HZ2       LYS 139  13.574 -16.973 -12.804
 1045   3HZ   LYS 139          HZ3       LYS 139  14.936 -16.316 -13.407
  Start of MODEL   10
    1   1H    MET   1           H1       MET   1   2.616   1.486   3.988
    2   2H    MET   1           H2       MET   1   4.088   0.912   3.543
    3   3H    MET   1           H3       MET   1   3.962   2.409   4.183
    4    HA   MET   1           HA       MET   1   2.898   1.530   1.591
    5   1HB   MET   1          HB2       MET   1   2.720   4.274   2.927
    6   2HB   MET   1          HB3       MET   1   2.453   3.979   1.214
    7   1HG   MET   1          HG2       MET   1   0.313   4.054   2.162
    8   2HG   MET   1          HG3       MET   1   0.630   2.372   1.777
    9   1HE   MET   1          HE1       MET   1   0.203   4.224   6.009
   10   2HE   MET   1          HE2       MET   1   1.525   4.724   4.936
   11   3HE   MET   1          HE3       MET   1  -0.163   5.037   4.473
   12    H    GLU   2           H        GLU   2   4.245   1.864  -0.163
   13    HA   GLU   2           HA       GLU   2   6.567   3.613   0.012
   14   1HB   GLU   2          HB2       GLU   2   7.342   1.435   1.011
   15   2HB   GLU   2          HB3       GLU   2   6.879   0.604  -0.476
   16   1HG   GLU   2          HG2       GLU   2   8.550   1.895  -1.745
   17   2HG   GLU   2          HG3       GLU   2   8.946   2.845  -0.310
   18    H    ASN   3           H        ASN   3   7.467   3.891  -2.173
   19    HA   ASN   3           HA       ASN   3   6.020   2.711  -4.454
   20   1HB   ASN   3          HB2       ASN   3   5.222   5.149  -3.944
   21   2HB   ASN   3          HB3       ASN   3   6.858   5.646  -4.406
   22   1HD2  ASN   3          HD22      ASN   3   7.572   5.071  -6.713
   23   2HD2  ASN   3          HD21      ASN   3   6.261   5.027  -7.904
   24    H    LYS   4           H        LYS   4   7.648   2.080  -5.986
   25    HA   LYS   4           HA       LYS   4  10.361   2.114  -4.884
   26   1HB   LYS   4          HB2       LYS   4   9.512   1.115  -7.625
   27   2HB   LYS   4          HB3       LYS   4  10.921   0.633  -6.702
   28   1HG   LYS   4          HG2       LYS   4   8.023  -0.099  -6.153
   29   2HG   LYS   4          HG3       LYS   4   9.293  -1.152  -6.760
   30   1HD   LYS   4          HD2       LYS   4   9.206   0.116  -4.003
   31   2HD   LYS   4          HD3       LYS   4   8.834  -1.574  -4.400
   32   1HE   LYS   4          HE2       LYS   4  11.176  -1.870  -5.227
   33   2HE   LYS   4          HE3       LYS   4  11.523  -0.194  -4.787
   34   1HZ   LYS   4          HZ1       LYS   4  10.932  -0.838  -2.453
   35   2HZ   LYS   4          HZ2       LYS   4  10.933  -2.404  -2.937
   36   3HZ   LYS   4          HZ3       LYS   4  12.312  -1.514  -3.070
   37    H    ILE   5           H        ILE   5  12.150   2.560  -6.613
   38    HA   ILE   5           HA       ILE   5  11.604   4.894  -8.295
   39    HB   ILE   5           HB       ILE   5  13.856   4.802  -6.258
   40   1HG1  ILE   5          HG12      ILE   5  12.637   7.078  -5.511
   41   2HG1  ILE   5          HG13      ILE   5  11.214   6.179  -6.011
   42   1HG2  ILE   5          HG21      ILE   5  14.354   7.122  -7.004
   43   2HG2  ILE   5          HG22      ILE   5  14.477   5.989  -8.344
   44   3HG2  ILE   5          HG23      ILE   5  13.037   7.007  -8.189
   45   1HD1  ILE   5          HD11      ILE   5  13.328   5.300  -3.999
   46   2HD1  ILE   5          HD12      ILE   5  11.700   5.890  -3.611
   47   3HD1  ILE   5          HD13      ILE   5  11.915   4.331  -4.429
   48    H    ILE   6           H        ILE   6  12.995   4.737 -10.151
   49    HA   ILE   6           HA       ILE   6  15.088   2.662 -10.129
   50    HB   ILE   6           HB       ILE   6  13.084   1.446 -10.768
   51   1HG1  ILE   6          HG12      ILE   6  14.876   1.863 -13.203
   52   2HG1  ILE   6          HG13      ILE   6  15.307   0.908 -11.777
   53   1HG2  ILE   6          HG21      ILE   6  11.778   1.939 -12.775
   54   2HG2  ILE   6          HG22      ILE   6  11.742   3.336 -11.710
   55   3HG2  ILE   6          HG23      ILE   6  12.809   3.334 -13.139
   56   1HD1  ILE   6          HD11      ILE   6  13.308  -0.534 -12.203
   57   2HD1  ILE   6          HD12      ILE   6  13.053   0.329 -13.738
   58   3HD1  ILE   6          HD13      ILE   6  14.541  -0.594 -13.483
   59    H    TYR   7           H        TYR   7  16.679   2.985 -11.746
   60    HA   TYR   7           HA       TYR   7  16.533   5.580 -13.179
   61   1HB   TYR   7          HB2       TYR   7  17.614   5.569 -10.827
   62   2HB   TYR   7          HB3       TYR   7  18.889   4.604 -11.528
   63    HD1  TYR   7           HD1      TYR   7  17.465   7.412 -13.551
   64    HD2  TYR   7           HD2      TYR   7  20.428   6.273 -10.624
   65    HE1  TYR   7           HE1      TYR   7  18.437   9.661 -13.671
   66    HE2  TYR   7           HE2      TYR   7  21.424   8.540 -10.773
   67    HH   TYR   7           HH       TYR   7  19.980  11.144 -12.745
   68    H    PHE   8           H        PHE   8  17.327   5.443 -15.206
   69    HA   PHE   8           HA       PHE   8  18.859   2.991 -16.034
   70   1HB   PHE   8          HB2       PHE   8  17.014   4.783 -17.676
   71   2HB   PHE   8          HB3       PHE   8  17.921   3.409 -18.286
   72    HD1  PHE   8           HD1      PHE   8  17.443   1.072 -17.187
   73    HD2  PHE   8           HD2      PHE   8  14.801   4.466 -16.907
   74    HE1  PHE   8           HE1      PHE   8  15.576  -0.445 -16.609
   75    HE2  PHE   8           HE2      PHE   8  12.932   2.935 -16.386
   76    HZ   PHE   8           HZ       PHE   8  13.310   0.489 -16.185
   77    H    LEU   9           H        LEU   9  20.859   3.342 -16.854
   78    HA   LEU   9           HA       LEU   9  21.705   6.167 -17.292
   79   1HB   LEU   9          HB2       LEU   9  23.197   3.848 -16.022
   80   2HB   LEU   9          HB3       LEU   9  23.853   5.456 -16.321
   81    HG   LEU   9           HG       LEU   9  21.638   4.734 -14.360
   82   1HD1  LEU   9          HD11      LEU   9  23.269   5.506 -12.687
   83   2HD1  LEU   9          HD12      LEU   9  23.942   4.179 -13.651
   84   3HD1  LEU   9          HD13      LEU   9  24.450   5.853 -13.959
   85   1HD2  LEU   9          HD21      LEU   9  21.858   7.174 -13.670
   86   2HD2  LEU   9          HD22      LEU   9  22.716   7.447 -15.209
   87   3HD2  LEU   9          HD23      LEU   9  21.028   6.902 -15.193
   88    H    CYS  10           H        CYS  10  22.984   6.619 -18.988
   89    HA   CYS  10           HA       CYS  10  23.966   4.405 -20.734
   90   1HB   CYS  10          HB2       CYS  10  21.757   5.305 -21.525
   91   2HB   CYS  10          HB3       CYS  10  22.483   6.922 -21.609
   92    HG   CYS  10           HG       CYS  10  22.525   6.489 -23.959
   93    H    THR  11           H        THR  11  25.518   5.375 -22.415
   94    HA   THR  11           HA       THR  11  27.622   6.877 -21.213
   95    HB   THR  11           HB       THR  11  28.435   6.860 -23.642
   96    HG1  THR  11           HG1      THR  11  26.753   6.597 -24.939
   97   1HG2  THR  11          HG21      THR  11  28.895   5.031 -21.923
   98   2HG2  THR  11          HG22      THR  11  27.527   4.130 -22.599
   99   3HG2  THR  11          HG23      THR  11  28.931   4.495 -23.619
  100    H    GLY  12           H        GLY  12  24.691   7.773 -22.988
  101   1HA   GLY  12          HA1       GLY  12  25.035  10.504 -22.076
  102   2HA   GLY  12          HA2       GLY  12  24.931  10.327 -23.842
  103    H    ASN  13           H        ASN  13  22.998  11.316 -21.609
  104    HA   ASN  13           HA       ASN  13  20.837   9.399 -21.559
  105   1HB   ASN  13          HB2       ASN  13  21.380  11.028 -19.708
  106   2HB   ASN  13          HB3       ASN  13  20.831  12.329 -20.760
  107   1HD2  ASN  13          HD22      ASN  13  19.226   9.013 -20.296
  108   2HD2  ASN  13          HD21      ASN  13  17.768   9.734 -19.649
  109    H    SER  14           H        SER  14  21.180   9.582 -24.163
  110    HA   SER  14           HA       SER  14  19.135  11.519 -25.156
  111   1HB   SER  14          HB2       SER  14  21.754  10.672 -26.435
  112   2HB   SER  14          HB3       SER  14  20.552  11.755 -27.163
  113    HG   SER  14           HG       SER  14  20.902  13.242 -25.630
  114    H    CYS  15           H        CYS  15  20.018   8.166 -25.059
  115    HA   CYS  15           HA       CYS  15  18.059   7.597 -27.237
  116   1HB   CYS  15          HB2       CYS  15  20.862   6.412 -27.062
  117   2HB   CYS  15          HB3       CYS  15  19.625   5.995 -28.252
  118    HG   CYS  15           HG       CYS  15  21.670   7.364 -29.152
  119    H    ARG  16           H        ARG  16  20.270   5.290 -25.692
  120    HA   ARG  16           HA       ARG  16  18.242   3.411 -25.312
  121   1HB   ARG  16          HB2       ARG  16  20.957   3.736 -23.956
  122   2HB   ARG  16          HB3       ARG  16  19.942   2.317 -23.737
  123   1HG   ARG  16          HG2       ARG  16  20.033   1.715 -26.037
  124   2HG   ARG  16          HG3       ARG  16  20.842   3.219 -26.492
  125   1HD   ARG  16          HD2       ARG  16  22.048   1.153 -24.598
  126   2HD   ARG  16          HD3       ARG  16  22.347   1.194 -26.340
  127    HE   ARG  16           HE       ARG  16  22.905   3.783 -25.386
  128   1HH1  ARG  16          HH11      ARG  16  24.322   0.494 -25.407
  129   2HH1  ARG  16          HH12      ARG  16  25.942   1.177 -25.192
  130   1HH2  ARG  16          HH21      ARG  16  25.109   4.458 -24.820
  131   2HH2  ARG  16          HH22      ARG  16  26.350   3.252 -24.807
  132    H    SER  17           H        SER  17  19.658   5.532 -22.728
  133    HA   SER  17           HA       SER  17  17.964   4.392 -20.712
  134   1HB   SER  17          HB2       SER  17  18.801   6.376 -19.383
  135   2HB   SER  17          HB3       SER  17  20.033   5.335 -20.079
  136    HG   SER  17           HG       SER  17  20.680   7.348 -20.599
  137    H    GLN  18           H        GLN  18  17.628   7.197 -22.850
  138    HA   GLN  18           HA       GLN  18  15.340   8.383 -21.654
  139   1HB   GLN  18          HB2       GLN  18  16.594   8.403 -24.418
  140   2HB   GLN  18          HB3       GLN  18  15.039   9.152 -24.180
  141   1HG   GLN  18          HG2       GLN  18  17.465   9.838 -22.473
  142   2HG   GLN  18          HG3       GLN  18  17.092  10.665 -23.985
  143   1HE2  GLN  18          HE22      GLN  18  17.055  11.721 -21.039
  144   2HE2  GLN  18          HE21      GLN  18  15.436  12.412 -20.954
  145    H    MET  19           H        MET  19  15.518   6.204 -24.486
  146    HA   MET  19           HA       MET  19  12.761   5.702 -24.723
  147   1HB   MET  19          HB2       MET  19  15.071   3.824 -25.404
  148   2HB   MET  19          HB3       MET  19  13.396   3.633 -25.933
  149   1HG   MET  19          HG2       MET  19  13.638   6.039 -26.898
  150   2HG   MET  19          HG3       MET  19  15.373   5.784 -26.733
  151   1HE   MET  19          HE1       MET  19  15.911   2.722 -29.229
  152   2HE   MET  19          HE2       MET  19  16.682   3.736 -27.982
  153   3HE   MET  19          HE3       MET  19  15.462   2.517 -27.527
  154    H    ALA  20           H        ALA  20  15.161   3.890 -22.703
  155    HA   ALA  20           HA       ALA  20  13.360   1.871 -21.872
  156   1HB   ALA  20          HB1       ALA  20  15.743   3.057 -20.374
  157   2HB   ALA  20          HB2       ALA  20  14.957   1.504 -20.024
  158   3HB   ALA  20          HB3       ALA  20  15.797   1.739 -21.571
  159    H    GLU  21           H        GLU  21  14.070   5.040 -20.307
  160    HA   GLU  21           HA       GLU  21  12.294   4.721 -18.140
  161   1HB   GLU  21          HB2       GLU  21  13.927   6.569 -18.423
  162   2HB   GLU  21          HB3       GLU  21  12.877   7.289 -19.650
  163   1HG   GLU  21          HG2       GLU  21  11.061   7.257 -17.746
  164   2HG   GLU  21          HG3       GLU  21  12.425   6.982 -16.672
  165    H    GLY  22           H        GLY  22  11.603   5.732 -21.510
  166   1HA   GLY  22          HA1       GLY  22   8.880   6.466 -21.215
  167   2HA   GLY  22          HA2       GLY  22   9.660   5.829 -22.692
  168    H    TRP  23           H        TRP  23  10.317   3.293 -22.152
  169    HA   TRP  23           HA       TRP  23   7.824   1.878 -22.231
  170   1HB   TRP  23          HB2       TRP  23  10.697   0.974 -21.769
  171   2HB   TRP  23          HB3       TRP  23   9.342  -0.141 -21.841
  172    HD1  TRP  23           HD1      TRP  23  11.703   1.686 -24.058
  173    HE1  TRP  23           HE1      TRP  23  11.161   1.272 -26.502
  174    HE3  TRP  23           HE3      TRP  23   7.111  -0.492 -23.483
  175    HZ2  TRP  23           HZ2      TRP  23   8.987   0.109 -28.049
  176    HZ3  TRP  23           HZ3      TRP  23   5.869  -1.335 -25.453
  177    HH2  TRP  23           HH2      TRP  23   6.803  -1.069 -27.733
  178    H    ALA  24           H        ALA  24  10.230   2.327 -19.624
  179    HA   ALA  24           HA       ALA  24   9.079   0.534 -17.795
  180   1HB   ALA  24          HB1       ALA  24  10.476   1.777 -16.134
  181   2HB   ALA  24          HB2       ALA  24  11.362   1.407 -17.620
  182   3HB   ALA  24          HB3       ALA  24  10.743   3.036 -17.373
  183    H    LYS  25           H        LYS  25   8.508   4.099 -18.135
  184    HA   LYS  25           HA       LYS  25   6.696   4.291 -15.975
  185   1HB   LYS  25          HB2       LYS  25   6.932   5.819 -18.585
  186   2HB   LYS  25          HB3       LYS  25   5.676   6.211 -17.395
  187   1HG   LYS  25          HG2       LYS  25   7.365   6.498 -15.627
  188   2HG   LYS  25          HG3       LYS  25   8.656   6.135 -16.774
  189   1HD   LYS  25          HD2       LYS  25   6.785   8.538 -16.934
  190   2HD   LYS  25          HD3       LYS  25   8.432   8.529 -16.279
  191   1HE   LYS  25          HE2       LYS  25   9.109   7.519 -18.591
  192   2HE   LYS  25          HE3       LYS  25   7.550   8.129 -19.158
  193   1HZ   LYS  25          HZ1       LYS  25   9.697   9.753 -17.890
  194   2HZ   LYS  25          HZ2       LYS  25   9.435   9.633 -19.466
  195   3HZ   LYS  25          HZ3       LYS  25   8.282  10.370 -18.560
  196    H    GLN  26           H        GLN  26   6.109   3.047 -19.235
  197    HA   GLN  26           HA       GLN  26   3.261   2.889 -18.862
  198   1HB   GLN  26          HB2       GLN  26   4.764   0.995 -20.685
  199   2HB   GLN  26          HB3       GLN  26   3.097   1.533 -20.771
  200   1HG   GLN  26          HG2       GLN  26   5.613   2.968 -21.547
  201   2HG   GLN  26          HG3       GLN  26   4.184   2.640 -22.507
  202   1HE2  GLN  26          HE22      GLN  26   5.850   5.097 -21.037
  203   2HE2  GLN  26          HE21      GLN  26   4.536   6.241 -20.792
  204    H    TYR  27           H        TYR  27   5.745   0.301 -18.761
  205    HA   TYR  27           HA       TYR  27   3.879  -1.673 -17.899
  206   1HB   TYR  27          HB2       TYR  27   6.917  -1.640 -17.678
  207   2HB   TYR  27          HB3       TYR  27   5.906  -3.041 -17.370
  208    HD1  TYR  27           HD1      TYR  27   4.210  -3.713 -19.321
  209    HD2  TYR  27           HD2      TYR  27   7.834  -1.439 -19.831
  210    HE1  TYR  27           HE1      TYR  27   4.315  -4.422 -21.692
  211    HE2  TYR  27           HE2      TYR  27   8.023  -2.243 -22.165
  212    HH   TYR  27           HH       TYR  27   7.001  -3.464 -23.873
  213    H    LEU  28           H        LEU  28   6.237   0.266 -16.047
  214    HA   LEU  28           HA       LEU  28   5.646  -1.063 -13.531
  215   1HB   LEU  28          HB2       LEU  28   7.187   1.508 -14.064
  216   2HB   LEU  28          HB3       LEU  28   7.212   0.568 -12.598
  217    HG   LEU  28           HG       LEU  28   8.273  -0.375 -15.291
  218   1HD1  LEU  28          HD11      LEU  28   9.807   0.288 -12.756
  219   2HD1  LEU  28          HD12      LEU  28  10.462  -0.107 -14.360
  220   3HD1  LEU  28          HD13      LEU  28   9.583   1.415 -14.111
  221   1HD2  LEU  28          HD21      LEU  28   8.424  -1.781 -12.594
  222   2HD2  LEU  28          HD22      LEU  28   7.440  -2.300 -13.977
  223   3HD2  LEU  28          HD23      LEU  28   9.194  -2.308 -14.106
  224    H    GLY  29           H        GLY  29   3.943   1.315 -15.247
  225   1HA   GLY  29          HA1       GLY  29   2.131   2.569 -14.742
  226   2HA   GLY  29          HA2       GLY  29   1.872   1.391 -13.446
  227    H    ASP  30           H        ASP  30   4.633   3.558 -13.499
  228    HA   ASP  30           HA       ASP  30   5.477   5.083 -12.135
  229   1HB   ASP  30          HB2       ASP  30   3.688   6.413 -13.093
  230   2HB   ASP  30          HB3       ASP  30   2.629   6.010 -11.740
  231    H    GLU  31           H        GLU  31   3.968   2.494 -10.937
  232    HA   GLU  31           HA       GLU  31   3.978   2.956  -8.107
  233   1HB   GLU  31          HB2       GLU  31   4.373   0.388  -9.677
  234   2HB   GLU  31          HB3       GLU  31   4.098   0.484  -7.945
  235   1HG   GLU  31          HG2       GLU  31   2.167   1.540 -10.041
  236   2HG   GLU  31          HG3       GLU  31   2.082  -0.074  -9.342
  237    H    TRP  32           H        TRP  32   6.361   3.007 -10.423
  238    HA   TRP  32           HA       TRP  32   8.565   2.862  -8.501
  239   1HB   TRP  32          HB2       TRP  32   8.712   1.979 -11.413
  240   2HB   TRP  32          HB3       TRP  32  10.006   1.928 -10.236
  241    HD1  TRP  32           HD1      TRP  32   6.452   0.329 -10.434
  242    HE1  TRP  32           HE1      TRP  32   6.579  -2.114  -9.794
  243    HE3  TRP  32           HE3      TRP  32  11.504  -0.025  -9.582
  244    HZ2  TRP  32           HZ2      TRP  32   8.614  -4.079  -9.374
  245    HZ3  TRP  32           HZ3      TRP  32  12.509  -2.243  -9.121
  246    HH2  TRP  32           HH2      TRP  32  11.084  -4.295  -9.103
  247    H    LYS  33           H        LYS  33   9.235   4.989  -8.418
  248    HA   LYS  33           HA       LYS  33   8.518   6.985 -10.351
  249   1HB   LYS  33          HB2       LYS  33  10.560   6.938  -8.075
  250   2HB   LYS  33          HB3       LYS  33  10.160   8.374  -9.020
  251   1HG   LYS  33          HG2       LYS  33   8.458   6.881  -7.021
  252   2HG   LYS  33          HG3       LYS  33   8.998   8.545  -6.961
  253   1HD   LYS  33          HD2       LYS  33   6.888   7.404  -8.845
  254   2HD   LYS  33          HD3       LYS  33   6.603   8.417  -7.433
  255   1HE   LYS  33          HE2       LYS  33   7.757  10.311  -8.462
  256   2HE   LYS  33          HE3       LYS  33   8.239   9.320  -9.845
  257   1HZ   LYS  33          HZ1       LYS  33   5.910   9.058 -10.421
  258   2HZ   LYS  33          HZ2       LYS  33   5.442   9.988  -9.151
  259   3HZ   LYS  33          HZ3       LYS  33   6.306  10.651 -10.368
  260    H    VAL  34           H        VAL  34   9.267   6.569 -12.390
  261    HA   VAL  34           HA       VAL  34  11.856   5.392 -12.790
  262    HB   VAL  34           HB       VAL  34  10.078   6.498 -14.967
  263   1HG1  VAL  34          HG11      VAL  34  11.472   3.821 -14.945
  264   2HG1  VAL  34          HG12      VAL  34  11.002   4.868 -16.307
  265   3HG1  VAL  34          HG13      VAL  34  12.397   5.284 -15.299
  266   1HG2  VAL  34          HG21      VAL  34   8.900   4.257 -15.062
  267   2HG2  VAL  34          HG22      VAL  34   9.530   3.918 -13.440
  268   3HG2  VAL  34          HG23      VAL  34   8.414   5.277 -13.715
  269    H    TYR  35           H        TYR  35  13.679   6.387 -13.579
  270    HA   TYR  35           HA       TYR  35  13.612   9.168 -14.602
  271   1HB   TYR  35          HB2       TYR  35  15.439   8.087 -12.408
  272   2HB   TYR  35          HB3       TYR  35  15.688   9.611 -13.239
  273    HD1  TYR  35           HD1      TYR  35  13.803   7.878 -10.620
  274    HD2  TYR  35           HD2      TYR  35  14.153  11.540 -12.879
  275    HE1  TYR  35           HE1      TYR  35  12.447   9.064  -8.915
  276    HE2  TYR  35           HE2      TYR  35  12.787  12.724 -11.192
  277    HH   TYR  35           HH       TYR  35  11.612  12.546  -9.183
  278    H    SER  36           H        SER  36  15.696   9.646 -15.781
  279    HA   SER  36           HA       SER  36  17.470   7.377 -16.232
  280   1HB   SER  36          HB2       SER  36  17.483   7.735 -18.667
  281   2HB   SER  36          HB3       SER  36  15.935   7.130 -18.090
  282    HG   SER  36           HG       SER  36  15.075   9.191 -18.299
  283    H    ALA  37           H        ALA  37  19.554   8.048 -17.071
  284    HA   ALA  37           HA       ALA  37  20.168  10.838 -17.469
  285   1HB   ALA  37          HB1       ALA  37  21.719  11.083 -15.586
  286   2HB   ALA  37          HB2       ALA  37  20.082  10.852 -15.013
  287   3HB   ALA  37          HB3       ALA  37  21.233   9.497 -14.945
  288    H    GLY  38           H        GLY  38  22.936  10.727 -17.118
  289   1HA   GLY  38          HA1       GLY  38  24.153   8.286 -17.851
  290   2HA   GLY  38          HA2       GLY  38  23.915   9.282 -19.305
  291    H    ILE  39           H        ILE  39  26.397   8.810 -18.875
  292    HA   ILE  39           HA       ILE  39  27.949  10.455 -17.192
  293    HB   ILE  39           HB       ILE  39  28.252   8.913 -19.742
  294   1HG1  ILE  39          HG12      ILE  39  30.046   8.943 -17.292
  295   2HG1  ILE  39          HG13      ILE  39  28.527   8.067 -17.325
  296   1HG2  ILE  39          HG21      ILE  39  30.417  10.856 -18.895
  297   2HG2  ILE  39          HG22      ILE  39  30.590   9.564 -20.107
  298   3HG2  ILE  39          HG23      ILE  39  29.477  10.887 -20.411
  299   1HD1  ILE  39          HD11      ILE  39  30.320   6.530 -17.873
  300   2HD1  ILE  39          HD12      ILE  39  29.336   6.765 -19.333
  301   3HD1  ILE  39          HD13      ILE  39  30.909   7.579 -19.161
  302    H    GLU  40           H        GLU  40  26.067  11.326 -20.036
  303    HA   GLU  40           HA       GLU  40  26.594  14.099 -19.501
  304   1HB   GLU  40          HB2       GLU  40  27.021  14.747 -21.797
  305   2HB   GLU  40          HB3       GLU  40  28.328  13.754 -21.165
  306   1HG   GLU  40          HG2       GLU  40  27.630  11.833 -22.438
  307   2HG   GLU  40          HG3       GLU  40  26.082  12.569 -22.856
  308    H    ALA  41           H        ALA  41  25.022  15.430 -20.905
  309    HA   ALA  41           HA       ALA  41  22.806  13.990 -22.120
  310   1HB   ALA  41          HB1       ALA  41  21.144  15.392 -20.826
  311   2HB   ALA  41          HB2       ALA  41  21.970  14.169 -19.833
  312   3HB   ALA  41          HB3       ALA  41  22.450  15.881 -19.738
  313    H    HIS  42           H        HIS  42  22.283  15.129 -23.914
  314    HA   HIS  42           HA       HIS  42  22.717  18.061 -24.004
  315   1HB   HIS  42          HB2       HIS  42  23.763  16.005 -25.994
  316   2HB   HIS  42          HB3       HIS  42  23.551  17.706 -26.399
  317    HD1  HIS  42           HD1      HIS  42  26.181  15.497 -24.877
  318    HD2  HIS  42           HD2      HIS  42  24.910  19.529 -24.733
  319    HE1  HIS  42           HE1      HIS  42  28.094  16.823 -23.891
  320    H    GLY  43           H        GLY  43  20.427  16.006 -23.695
  321   1HA   GLY  43          HA1       GLY  43  18.152  16.524 -24.190
  322   2HA   GLY  43          HA2       GLY  43  18.622  17.203 -25.753
  323    H    LEU  44           H        LEU  44  16.643  15.291 -25.612
  324    HA   LEU  44           HA       LEU  44  17.813  12.675 -26.082
  325   1HB   LEU  44          HB2       LEU  44  15.658  11.791 -26.079
  326   2HB   LEU  44          HB3       LEU  44  15.761  12.940 -24.754
  327    HG   LEU  44           HG       LEU  44  14.325  13.330 -27.416
  328   1HD1  LEU  44          HD11      LEU  44  12.307  13.225 -25.983
  329   2HD1  LEU  44          HD12      LEU  44  13.300  11.765 -25.795
  330   3HD1  LEU  44          HD13      LEU  44  13.324  13.017 -24.547
  331   1HD2  LEU  44          HD21      LEU  44  14.500  15.244 -25.038
  332   2HD2  LEU  44          HD22      LEU  44  15.029  15.562 -26.716
  333   3HD2  LEU  44          HD23      LEU  44  13.320  15.376 -26.357
  334    H    ASN  45           H        ASN  45  17.641  11.452 -27.963
  335    HA   ASN  45           HA       ASN  45  18.316  12.957 -30.310
  336   1HB   ASN  45          HB2       ASN  45  19.279  10.765 -29.569
  337   2HB   ASN  45          HB3       ASN  45  17.755   9.976 -29.954
  338   1HD2  ASN  45          HD22      ASN  45  20.731  10.128 -31.091
  339   2HD2  ASN  45          HD21      ASN  45  20.447  10.170 -32.817
  340    HA   PRO  46           HA       PRO  46  14.105  13.383 -31.937
  341   1HB   PRO  46          HB2       PRO  46  15.560  13.138 -34.580
  342   2HB   PRO  46          HB3       PRO  46  14.246  14.268 -34.121
  343   1HG   PRO  46          HG2       PRO  46  16.819  15.114 -34.133
  344   2HG   PRO  46          HG3       PRO  46  15.737  15.569 -32.777
  345   1HD   PRO  46          HD2       PRO  46  17.843  13.405 -32.856
  346   2HD   PRO  46          HD3       PRO  46  17.449  14.563 -31.549
  347    H    ASN  47           H        ASN  47  16.305  10.787 -33.109
  348    HA   ASN  47           HA       ASN  47  14.126   9.222 -34.258
  349   1HB   ASN  47          HB2       ASN  47  17.012   8.579 -33.598
  350   2HB   ASN  47          HB3       ASN  47  15.873   7.367 -34.171
  351   1HD2  ASN  47          HD22      ASN  47  18.384   8.828 -35.379
  352   2HD2  ASN  47          HD21      ASN  47  17.831   9.160 -37.002
  353    H    ALA  48           H        ALA  48  15.540   9.604 -31.043
  354    HA   ALA  48           HA       ALA  48  14.450   7.172 -29.952
  355   1HB   ALA  48          HB1       ALA  48  15.084   9.751 -28.439
  356   2HB   ALA  48          HB2       ALA  48  14.966   8.110 -27.795
  357   3HB   ALA  48          HB3       ALA  48  16.311   8.549 -28.863
  358    H    VAL  49           H        VAL  49  13.398  10.628 -30.140
  359    HA   VAL  49           HA       VAL  49  10.872  10.245 -28.930
  360    HB   VAL  49           HB       VAL  49  11.493  12.255 -31.141
  361   1HG1  VAL  49          HG11      VAL  49   9.083  12.086 -30.575
  362   2HG1  VAL  49          HG12      VAL  49   9.463  12.304 -28.854
  363   3HG1  VAL  49          HG13      VAL  49   9.756  13.617 -30.008
  364   1HG2  VAL  49          HG21      VAL  49  11.927  12.461 -28.136
  365   2HG2  VAL  49          HG22      VAL  49  13.188  12.510 -29.389
  366   3HG2  VAL  49          HG23      VAL  49  12.022  13.825 -29.268
  367    H    LYS  50           H        LYS  50  11.782  10.037 -32.455
  368    HA   LYS  50           HA       LYS  50   9.221   9.270 -33.380
  369   1HB   LYS  50          HB2       LYS  50  11.999   8.475 -34.368
  370   2HB   LYS  50          HB3       LYS  50  10.507   7.941 -35.129
  371   1HG   LYS  50          HG2       LYS  50   9.853  10.244 -35.631
  372   2HG   LYS  50          HG3       LYS  50  11.315  10.854 -34.841
  373   1HD   LYS  50          HD2       LYS  50  11.583  10.771 -37.291
  374   2HD   LYS  50          HD3       LYS  50  12.735   9.706 -36.475
  375   1HE   LYS  50          HE2       LYS  50  11.283   7.736 -36.985
  376   2HE   LYS  50          HE3       LYS  50  10.116   8.797 -37.771
  377   1HZ   LYS  50          HZ1       LYS  50  11.815   9.355 -39.413
  378   2HZ   LYS  50          HZ2       LYS  50  12.919   8.404 -38.667
  379   3HZ   LYS  50          HZ3       LYS  50  11.601   7.740 -39.369
  380    H    ALA  51           H        ALA  51  11.875   7.186 -32.117
  381    HA   ALA  51           HA       ALA  51  10.639   4.732 -32.679
  382   1HB   ALA  51          HB1       ALA  51  12.990   4.925 -32.030
  383   2HB   ALA  51          HB2       ALA  51  12.535   5.529 -30.426
  384   3HB   ALA  51          HB3       ALA  51  12.149   3.868 -30.884
  385    H    MET  52           H        MET  52  10.384   6.802 -29.723
  386    HA   MET  52           HA       MET  52   8.617   4.898 -28.459
  387   1HB   MET  52          HB2       MET  52   9.084   7.836 -27.831
  388   2HB   MET  52          HB3       MET  52   8.215   6.688 -26.811
  389   1HG   MET  52          HG2       MET  52  11.154   6.706 -27.522
  390   2HG   MET  52          HG3       MET  52  10.414   6.800 -25.940
  391   1HE   MET  52          HE1       MET  52   9.222   3.142 -25.308
  392   2HE   MET  52          HE2       MET  52   9.077   4.848 -24.874
  393   3HE   MET  52          HE3       MET  52   8.274   4.212 -26.343
  394    H    LYS  53           H        LYS  53   7.999   7.825 -30.461
  395    HA   LYS  53           HA       LYS  53   5.168   7.637 -30.205
  396   1HB   LYS  53          HB2       LYS  53   6.972   8.743 -32.372
  397   2HB   LYS  53          HB3       LYS  53   5.223   8.930 -32.419
  398   1HG   LYS  53          HG2       LYS  53   6.645   9.805 -29.893
  399   2HG   LYS  53          HG3       LYS  53   6.877  10.772 -31.348
  400   1HD   LYS  53          HD2       LYS  53   5.109  11.748 -30.094
  401   2HD   LYS  53          HD3       LYS  53   4.416  11.047 -31.563
  402   1HE   LYS  53          HE2       LYS  53   3.649   9.077 -30.251
  403   2HE   LYS  53          HE3       LYS  53   4.387   9.761 -28.794
  404   1HZ   LYS  53          HZ1       LYS  53   2.016  10.223 -28.888
  405   2HZ   LYS  53          HZ2       LYS  53   2.837  11.627 -28.976
  406   3HZ   LYS  53          HZ3       LYS  53   2.157  10.989 -30.317
  407    H    GLU  54           H        GLU  54   7.451   5.723 -32.094
  408    HA   GLU  54           HA       GLU  54   5.539   4.734 -33.959
  409   1HB   GLU  54          HB2       GLU  54   8.029   4.906 -34.249
  410   2HB   GLU  54          HB3       GLU  54   8.204   3.486 -33.220
  411   1HG   GLU  54          HG2       GLU  54   6.421   3.444 -35.685
  412   2HG   GLU  54          HG3       GLU  54   8.165   3.384 -35.867
  413    H    VAL  55           H        VAL  55   6.079   4.088 -30.612
  414    HA   VAL  55           HA       VAL  55   4.294   1.696 -30.818
  415    HB   VAL  55           HB       VAL  55   5.265   1.002 -28.658
  416   1HG1  VAL  55          HG11      VAL  55   7.359   0.185 -29.620
  417   2HG1  VAL  55          HG12      VAL  55   6.079   0.139 -30.832
  418   3HG1  VAL  55          HG13      VAL  55   7.297   1.428 -30.883
  419   1HG2  VAL  55          HG21      VAL  55   7.365   3.162 -29.099
  420   2HG2  VAL  55          HG22      VAL  55   6.044   3.302 -27.914
  421   3HG2  VAL  55          HG23      VAL  55   7.253   2.032 -27.748
  422    H    GLY  56           H        GLY  56   4.188   4.960 -30.048
  423   1HA   GLY  56          HA1       GLY  56   2.201   6.040 -29.488
  424   2HA   GLY  56          HA2       GLY  56   1.534   4.539 -28.827
  425    H    ILE  57           H        ILE  57   4.748   5.928 -28.060
  426    HA   ILE  57           HA       ILE  57   3.865   6.624 -25.307
  427    HB   ILE  57           HB       ILE  57   6.388   5.238 -26.293
  428   1HG1  ILE  57          HG12      ILE  57   4.361   4.364 -24.196
  429   2HG1  ILE  57          HG13      ILE  57   4.367   3.801 -25.862
  430   1HG2  ILE  57          HG21      ILE  57   5.854   6.462 -23.552
  431   2HG2  ILE  57          HG22      ILE  57   7.168   5.324 -23.868
  432   3HG2  ILE  57          HG23      ILE  57   7.166   6.875 -24.678
  433   1HD1  ILE  57          HD11      ILE  57   6.624   2.807 -25.541
  434   2HD1  ILE  57          HD12      ILE  57   6.539   3.230 -23.817
  435   3HD1  ILE  57          HD13      ILE  57   5.372   2.103 -24.519
  436    H    ASP  58           H        ASP  58   5.349   8.361 -24.477
  437    HA   ASP  58           HA       ASP  58   6.625  10.005 -26.585
  438   1HB   ASP  58          HB2       ASP  58   4.560  11.201 -26.160
  439   2HB   ASP  58          HB3       ASP  58   4.755  11.018 -24.405
  440    H    ILE  59           H        ILE  59   8.500  10.936 -25.887
  441    HA   ILE  59           HA       ILE  59   9.273  10.701 -23.053
  442    HB   ILE  59           HB       ILE  59  11.633  10.153 -23.761
  443   1HG1  ILE  59          HG12      ILE  59  10.386   9.251 -26.390
  444   2HG1  ILE  59          HG13      ILE  59  11.267  10.762 -26.213
  445   1HG2  ILE  59          HG21      ILE  59   9.528   8.034 -24.371
  446   2HG2  ILE  59          HG22      ILE  59  11.197   7.763 -23.805
  447   3HG2  ILE  59          HG23      ILE  59  10.015   8.537 -22.755
  448   1HD1  ILE  59          HD11      ILE  59  12.416   7.976 -25.715
  449   2HD1  ILE  59          HD12      ILE  59  12.760   9.057 -27.073
  450   3HD1  ILE  59          HD13      ILE  59  13.273   9.504 -25.445
  451    H    SER  60           H        SER  60   8.460  12.789 -25.434
  452    HA   SER  60           HA       SER  60  10.507  14.780 -25.240
  453   1HB   SER  60          HB2       SER  60   7.558  15.378 -25.540
  454   2HB   SER  60          HB3       SER  60   8.949  16.251 -26.210
  455    HG   SER  60           HG       SER  60   7.786  13.792 -26.935
  456    H    ASN  61           H        ASN  61   7.879  13.765 -23.145
  457    HA   ASN  61           HA       ASN  61   7.844  15.873 -21.270
  458   1HB   ASN  61          HB2       ASN  61   6.701  14.291 -19.804
  459   2HB   ASN  61          HB3       ASN  61   6.096  14.141 -21.443
  460   1HD2  ASN  61          HD22      ASN  61   6.560  12.244 -22.651
  461   2HD2  ASN  61          HD21      ASN  61   7.155  10.777 -21.910
  462    H    GLN  62           H        GLN  62  10.600  13.908 -21.800
  463    HA   GLN  62           HA       GLN  62  11.476  14.247 -18.978
  464   1HB   GLN  62          HB2       GLN  62  12.441  11.916 -19.097
  465   2HB   GLN  62          HB3       GLN  62  10.679  11.992 -19.023
  466   1HG   GLN  62          HG2       GLN  62  10.433  11.504 -21.332
  467   2HG   GLN  62          HG3       GLN  62  12.147  11.812 -21.660
  468   1HE2  GLN  62          HE22      GLN  62  13.535  10.185 -21.678
  469   2HE2  GLN  62          HE21      GLN  62  13.088   8.508 -21.313
  470    H    THR  63           H        THR  63  12.196  16.104 -20.660
  471    HA   THR  63           HA       THR  63  14.363  15.788 -22.349
  472    HB   THR  63           HB       THR  63  14.862  18.223 -21.545
  473    HG1  THR  63           HG1      THR  63  13.821  18.084 -19.519
  474   1HG2  THR  63          HG21      THR  63  13.506  17.657 -23.551
  475   2HG2  THR  63          HG22      THR  63  12.063  17.495 -22.527
  476   3HG2  THR  63          HG23      THR  63  12.861  19.074 -22.707
  477    H    SER  64           H        SER  64  16.505  15.441 -22.171
  478    HA   SER  64           HA       SER  64  17.380  13.932 -20.170
  479   1HB   SER  64          HB2       SER  64  19.110  15.574 -22.047
  480   2HB   SER  64          HB3       SER  64  19.462  13.963 -21.399
  481    HG   SER  64           HG       SER  64  18.427  13.172 -22.984
  482    H    ASP  65           H        ASP  65  19.117  13.976 -18.738
  483    HA   ASP  65           HA       ASP  65  20.432  16.457 -18.001
  484   1HB   ASP  65          HB2       ASP  65  18.309  16.521 -16.634
  485   2HB   ASP  65          HB3       ASP  65  18.778  14.983 -15.904
  486    H    ILE  66           H        ILE  66  22.217  16.017 -16.516
  487    HA   ILE  66           HA       ILE  66  23.480  13.407 -16.948
  488    HB   ILE  66           HB       ILE  66  25.162  14.626 -15.247
  489   1HG1  ILE  66          HG12      ILE  66  23.644  16.714 -15.100
  490   2HG1  ILE  66          HG13      ILE  66  25.376  16.884 -15.287
  491   1HG2  ILE  66          HG21      ILE  66  25.729  13.736 -17.379
  492   2HG2  ILE  66          HG22      ILE  66  24.968  15.111 -18.216
  493   3HG2  ILE  66          HG23      ILE  66  26.427  15.352 -17.217
  494   1HD1  ILE  66          HD11      ILE  66  24.140  18.504 -16.679
  495   2HD1  ILE  66          HD12      ILE  66  25.176  17.451 -17.654
  496   3HD1  ILE  66          HD13      ILE  66  23.426  17.181 -17.615
  497    H    ILE  67           H        ILE  67  24.459  12.347 -15.020
  498    HA   ILE  67           HA       ILE  67  22.478  11.374 -13.302
  499    HB   ILE  67           HB       ILE  67  25.508  11.236 -13.315
  500   1HG1  ILE  67          HG12      ILE  67  23.384   9.096 -13.764
  501   2HG1  ILE  67          HG13      ILE  67  23.991  10.093 -15.074
  502   1HG2  ILE  67          HG21      ILE  67  23.627   9.756 -11.424
  503   2HG2  ILE  67          HG22      ILE  67  25.358   9.404 -11.644
  504   3HG2  ILE  67          HG23      ILE  67  24.864  10.941 -10.950
  505   1HD1  ILE  67          HD11      ILE  67  26.299   9.255 -14.655
  506   2HD1  ILE  67          HD12      ILE  67  25.629   8.121 -13.452
  507   3HD1  ILE  67          HD13      ILE  67  25.130   8.014 -15.147
  508    H    ASP  68           H        ASP  68  22.005  11.679 -11.169
  509    HA   ASP  68           HA       ASP  68  23.336  13.864  -9.671
  510   1HB   ASP  68          HB2       ASP  68  21.249  14.732 -10.844
  511   2HB   ASP  68          HB3       ASP  68  20.310  13.626  -9.834
  512    H    SER  69           H        SER  69  23.630  13.376  -7.564
  513    HA   SER  69           HA       SER  69  23.476  10.819  -6.557
  514   1HB   SER  69          HB2       SER  69  23.463  13.384  -4.944
  515   2HB   SER  69          HB3       SER  69  24.146  11.815  -4.478
  516    HG   SER  69           HG       SER  69  25.743  13.284  -5.247
  517    H    ASP  70           H        ASP  70  20.933  13.243  -6.618
  518    HA   ASP  70           HA       ASP  70  19.453  12.330  -4.334
  519   1HB   ASP  70          HB2       ASP  70  19.308  14.615  -5.282
  520   2HB   ASP  70          HB3       ASP  70  18.554  13.954  -6.740
  521    H    ILE  71           H        ILE  71  19.871  10.989  -7.442
  522    HA   ILE  71           HA       ILE  71  17.427   9.314  -7.148
  523    HB   ILE  71           HB       ILE  71  18.964   9.961  -9.674
  524   1HG1  ILE  71          HG12      ILE  71  16.100  10.861  -9.256
  525   2HG1  ILE  71          HG13      ILE  71  17.372  11.852  -8.559
  526   1HG2  ILE  71          HG21      ILE  71  17.908   7.750  -9.661
  527   2HG2  ILE  71          HG22      ILE  71  16.355   8.445  -9.164
  528   3HG2  ILE  71          HG23      ILE  71  17.033   8.817 -10.765
  529   1HD1  ILE  71          HD11      ILE  71  17.257  11.084 -11.490
  530   2HD1  ILE  71          HD12      ILE  71  16.800  12.650 -10.783
  531   3HD1  ILE  71          HD13      ILE  71  18.487  12.105 -10.691
  532    H    LEU  72           H        LEU  72  20.944   9.389  -8.012
  533    HA   LEU  72           HA       LEU  72  21.471   6.666  -8.212
  534   1HB   LEU  72          HB2       LEU  72  23.101   8.763  -6.721
  535   2HB   LEU  72          HB3       LEU  72  23.669   7.136  -6.990
  536    HG   LEU  72           HG       LEU  72  23.059   9.109  -9.198
  537   1HD1  LEU  72          HD11      LEU  72  25.594   9.141  -9.357
  538   2HD1  LEU  72          HD12      LEU  72  24.956   9.832  -7.863
  539   3HD1  LEU  72          HD13      LEU  72  25.652   8.202  -7.861
  540   1HD2  LEU  72          HD21      LEU  72  22.816   6.756  -9.963
  541   2HD2  LEU  72          HD22      LEU  72  24.301   7.445 -10.618
  542   3HD2  LEU  72          HD23      LEU  72  24.376   6.343  -9.235
  543    H    ASN  73           H        ASN  73  21.634   8.486  -5.135
  544    HA   ASN  73           HA       ASN  73  21.934   6.061  -3.630
  545   1HB   ASN  73          HB2       ASN  73  22.554   7.367  -1.888
  546   2HB   ASN  73          HB3       ASN  73  22.777   8.572  -3.139
  547   1HD2  ASN  73          HD22      ASN  73  20.704  10.040  -3.514
  548   2HD2  ASN  73          HD21      ASN  73  19.800  10.454  -2.073
  549    H    ASN  74           H        ASN  74  19.199   7.169  -4.994
  550    HA   ASN  74           HA       ASN  74  17.369   6.643  -2.688
  551   1HB   ASN  74          HB2       ASN  74  17.551   8.959  -3.548
  552   2HB   ASN  74          HB3       ASN  74  17.197   8.381  -5.170
  553   1HD2  ASN  74          HD22      ASN  74  15.642  10.155  -4.974
  554   2HD2  ASN  74          HD21      ASN  74  14.040   9.784  -4.348
  555    H    ALA  75           H        ALA  75  18.086   5.952  -6.087
  556    HA   ALA  75           HA       ALA  75  15.722   4.601  -6.820
  557   1HB   ALA  75          HB1       ALA  75  17.315   5.512  -8.408
  558   2HB   ALA  75          HB2       ALA  75  18.525   4.314  -7.891
  559   3HB   ALA  75          HB3       ALA  75  17.010   3.793  -8.685
  560    H    ASP  76           H        ASP  76  14.952   2.671  -6.372
  561    HA   ASP  76           HA       ASP  76  16.132   0.910  -4.438
  562   1HB   ASP  76          HB2       ASP  76  13.698   1.082  -4.806
  563   2HB   ASP  76          HB3       ASP  76  13.889   0.462  -6.447
  564    H    LEU  77           H        LEU  77  16.233   1.238  -7.929
  565    HA   LEU  77           HA       LEU  77  18.415  -0.720  -8.096
  566   1HB   LEU  77          HB2       LEU  77  16.427  -2.099  -8.617
  567   2HB   LEU  77          HB3       LEU  77  15.872  -0.890  -9.779
  568    HG   LEU  77           HG       LEU  77  17.862  -1.329 -11.205
  569   1HD1  LEU  77          HD11      LEU  77  19.463  -2.143  -9.475
  570   2HD1  LEU  77          HD12      LEU  77  18.455  -3.585  -9.229
  571   3HD1  LEU  77          HD13      LEU  77  19.276  -3.297 -10.784
  572   1HD2  LEU  77          HD21      LEU  77  17.166  -3.534 -12.011
  573   2HD2  LEU  77          HD22      LEU  77  16.255  -3.806 -10.505
  574   3HD2  LEU  77          HD23      LEU  77  15.775  -2.511 -11.627
  575    H    VAL  78           H        VAL  78  19.909  -0.077  -9.596
  576    HA   VAL  78           HA       VAL  78  19.181   2.116 -11.477
  577    HB   VAL  78           HB       VAL  78  21.897   1.500 -10.242
  578   1HG1  VAL  78          HG11      VAL  78  22.190   2.488 -12.449
  579   2HG1  VAL  78          HG12      VAL  78  20.964   3.728 -12.112
  580   3HG1  VAL  78          HG13      VAL  78  22.507   3.735 -11.243
  581   1HG2  VAL  78          HG21      VAL  78  20.442   2.502  -8.532
  582   2HG2  VAL  78          HG22      VAL  78  21.656   3.663  -9.052
  583   3HG2  VAL  78          HG23      VAL  78  19.990   3.801  -9.653
  584    H    VAL  79           H        VAL  79  20.049   1.748 -13.684
  585    HA   VAL  79           HA       VAL  79  21.146  -0.969 -14.185
  586    HB   VAL  79           HB       VAL  79  18.931   0.294 -15.827
  587   1HG1  VAL  79          HG11      VAL  79  18.699  -1.957 -16.790
  588   2HG1  VAL  79          HG12      VAL  79  20.349  -1.371 -17.002
  589   3HG1  VAL  79          HG13      VAL  79  19.994  -2.561 -15.737
  590   1HG2  VAL  79          HG21      VAL  79  17.367  -1.414 -14.884
  591   2HG2  VAL  79          HG22      VAL  79  18.583  -1.799 -13.648
  592   3HG2  VAL  79          HG23      VAL  79  17.846  -0.183 -13.718
  593    H    THR  80           H        THR  80  22.788  -0.899 -15.729
  594    HA   THR  80           HA       THR  80  23.128   1.658 -17.241
  595    HB   THR  80           HB       THR  80  25.478   0.556 -17.669
  596    HG1  THR  80           HG1      THR  80  24.982  -1.352 -16.433
  597   1HG2  THR  80          HG21      THR  80  25.176   2.705 -16.614
  598   2HG2  THR  80          HG22      THR  80  24.714   1.954 -15.080
  599   3HG2  THR  80          HG23      THR  80  26.373   1.773 -15.705
  600    H    LEU  81           H        LEU  81  22.957   1.598 -19.393
  601    HA   LEU  81           HA       LEU  81  22.131  -0.993 -20.588
  602   1HB   LEU  81          HB2       LEU  81  21.590   1.901 -21.347
  603   2HB   LEU  81          HB3       LEU  81  21.190   0.529 -22.372
  604    HG   LEU  81           HG       LEU  81  19.733  -0.422 -20.601
  605   1HD1  LEU  81          HD11      LEU  81  20.485   0.561 -18.521
  606   2HD1  LEU  81          HD12      LEU  81  20.283   2.214 -19.161
  607   3HD1  LEU  81          HD13      LEU  81  18.880   1.179 -18.836
  608   1HD2  LEU  81          HD21      LEU  81  18.754   0.936 -22.400
  609   2HD2  LEU  81          HD22      LEU  81  17.885   1.179 -20.890
  610   3HD2  LEU  81          HD23      LEU  81  19.026   2.413 -21.439
  611    H    CYS  82           H        CYS  82  25.013   0.246 -20.221
  612    HA   CYS  82           HA       CYS  82  26.050   0.780 -22.805
  613   1HB   CYS  82          HB2       CYS  82  28.243   0.420 -21.724
  614   2HB   CYS  82          HB3       CYS  82  27.225   1.594 -20.898
  615    H    GLY  83           H        GLY  83  26.102  -0.675 -24.446
  616   1HA   GLY  83          HA1       GLY  83  27.690  -3.104 -24.083
  617   2HA   GLY  83          HA2       GLY  83  26.048  -3.376 -24.665
  618    H    ASP  84           H        ASP  84  27.547  -0.388 -25.459
  619    HA   ASP  84           HA       ASP  84  27.852  -0.868 -28.341
  620   1HB   ASP  84          HB2       ASP  84  28.331   1.570 -28.288
  621   2HB   ASP  84          HB3       ASP  84  26.785   1.221 -27.509
  622    H    ALA  85           H        ALA  85  30.031   0.268 -29.141
  623    HA   ALA  85           HA       ALA  85  32.145  -1.358 -28.042
  624   1HB   ALA  85          HB1       ALA  85  32.317   0.813 -30.163
  625   2HB   ALA  85          HB2       ALA  85  33.471  -0.498 -29.881
  626   3HB   ALA  85          HB3       ALA  85  31.848  -0.881 -30.480
  627    H    ALA  86           H        ALA  86  31.108   1.865 -27.171
  628    HA   ALA  86           HA       ALA  86  33.831   2.759 -26.441
  629   1HB   ALA  86          HB1       ALA  86  31.143   4.152 -26.050
  630   2HB   ALA  86          HB2       ALA  86  32.758   4.847 -25.843
  631   3HB   ALA  86          HB3       ALA  86  32.196   4.363 -27.458
  632    H    ASP  87           H        ASP  87  30.780   1.706 -25.037
  633    HA   ASP  87           HA       ASP  87  30.101   1.166 -22.993
  634   1HB   ASP  87          HB2       ASP  87  30.755  -0.890 -22.279
  635   2HB   ASP  87          HB3       ASP  87  31.081  -0.892 -23.989
  636    H    LYS  88           H        LYS  88  31.089   3.552 -22.586
  637    HA   LYS  88           HA       LYS  88  33.054   3.723 -20.551
  638   1HB   LYS  88          HB2       LYS  88  30.865   5.746 -21.160
  639   2HB   LYS  88          HB3       LYS  88  32.369   6.031 -20.280
  640   1HG   LYS  88          HG2       LYS  88  33.685   5.486 -22.314
  641   2HG   LYS  88          HG3       LYS  88  32.192   5.178 -23.207
  642   1HD   LYS  88          HD2       LYS  88  32.971   7.330 -23.820
  643   2HD   LYS  88          HD3       LYS  88  31.490   7.532 -22.874
  644   1HE   LYS  88          HE2       LYS  88  32.825   8.131 -20.875
  645   2HE   LYS  88          HE3       LYS  88  34.324   7.805 -21.754
  646   1HZ   LYS  88          HZ1       LYS  88  32.398   9.950 -22.453
  647   2HZ   LYS  88          HZ2       LYS  88  33.824  10.166 -21.689
  648   3HZ   LYS  88          HZ3       LYS  88  33.805   9.645 -23.229
  649    H    CYS  89           H        CYS  89  29.852   2.639 -20.314
  650    HA   CYS  89           HA       CYS  89  28.376   2.254 -18.614
  651   1HB   CYS  89          HB2       CYS  89  30.947   0.972 -17.717
  652   2HB   CYS  89          HB3       CYS  89  29.361   0.598 -17.061
  653    HA   PRO  90           HA       PRO  90  29.097   5.953 -16.018
  654   1HB   PRO  90          HB2       PRO  90  26.205   5.336 -15.501
  655   2HB   PRO  90          HB3       PRO  90  27.001   6.917 -15.802
  656   1HG   PRO  90          HG2       PRO  90  25.609   5.607 -17.768
  657   2HG   PRO  90          HG3       PRO  90  27.078   6.555 -18.123
  658   1HD   PRO  90          HD2       PRO  90  26.731   3.611 -17.994
  659   2HD   PRO  90          HD3       PRO  90  27.861   4.593 -18.968
  660    H    MET  91           H        MET  91  29.729   6.052 -13.942
  661    HA   MET  91           HA       MET  91  29.762   3.725 -12.319
  662   1HB   MET  91          HB2       MET  91  30.505   6.611 -11.632
  663   2HB   MET  91          HB3       MET  91  30.926   5.170 -10.708
  664   1HG   MET  91          HG2       MET  91  32.866   5.645 -11.897
  665   2HG   MET  91          HG3       MET  91  32.133   4.316 -12.789
  666   1HE   MET  91          HE1       MET  91  33.608   4.654 -14.905
  667   2HE   MET  91          HE2       MET  91  33.933   6.231 -15.657
  668   3HE   MET  91          HE3       MET  91  34.506   5.901 -14.007
  669    H    THR  92           H        THR  92  28.658   3.256 -10.481
  670    HA   THR  92           HA       THR  92  26.504   5.023  -9.478
  671    HB   THR  92           HB       THR  92  25.404   2.773  -9.010
  672    HG1  THR  92           HG1      THR  92  27.070   1.344  -9.136
  673   1HG2  THR  92          HG21      THR  92  26.073   3.211 -11.948
  674   2HG2  THR  92          HG22      THR  92  24.620   2.447 -11.272
  675   3HG2  THR  92          HG23      THR  92  24.891   4.184 -11.045
  676    HA   PRO  93           HA       PRO  93  28.396   4.446  -5.473
  677   1HB   PRO  93          HB2       PRO  93  26.291   4.275  -3.718
  678   2HB   PRO  93          HB3       PRO  93  26.768   5.796  -4.535
  679   1HG   PRO  93          HG2       PRO  93  24.611   3.834  -5.349
  680   2HG   PRO  93          HG3       PRO  93  24.475   5.613  -5.206
  681   1HD   PRO  93          HD2       PRO  93  24.914   4.397  -7.600
  682   2HD   PRO  93          HD3       PRO  93  25.723   5.942  -7.204
  683    HA   PRO  94           HA       PRO  94  28.503   0.030  -5.206
  684   1HB   PRO  94          HB2       PRO  94  29.972  -0.423  -2.947
  685   2HB   PRO  94          HB3       PRO  94  30.661   0.316  -4.425
  686   1HG   PRO  94          HG2       PRO  94  29.639   1.724  -1.942
  687   2HG   PRO  94          HG3       PRO  94  31.185   1.992  -2.810
  688   1HD   PRO  94          HD2       PRO  94  28.967   3.554  -3.224
  689   2HD   PRO  94          HD3       PRO  94  30.111   3.165  -4.549
  690    H    HIS  95           H        HIS  95  27.076   1.863  -2.554
  691    HA   HIS  95           HA       HIS  95  25.991  -0.494  -1.223
  692   1HB   HIS  95          HB2       HIS  95  25.161   1.043   0.418
  693   2HB   HIS  95          HB3       HIS  95  26.833   1.429   0.055
  694    HD1  HIS  95           HD1      HIS  95  23.284   2.824  -0.552
  695    HD2  HIS  95           HD2      HIS  95  27.347   3.906  -0.781
  696    HE1  HIS  95           HE1      HIS  95  23.335   5.337  -0.959
  697    H    VAL  96           H        VAL  96  25.095   0.776  -4.100
  698    HA   VAL  96           HA       VAL  96  22.222   0.155  -3.597
  699    HB   VAL  96           HB       VAL  96  23.269   2.134  -5.638
  700   1HG1  VAL  96          HG11      VAL  96  21.215   1.034  -6.398
  701   2HG1  VAL  96          HG12      VAL  96  20.426   1.374  -4.841
  702   3HG1  VAL  96          HG13      VAL  96  20.873   2.698  -5.936
  703   1HG2  VAL  96          HG21      VAL  96  23.444   3.120  -3.383
  704   2HG2  VAL  96          HG22      VAL  96  22.082   3.838  -4.237
  705   3HG2  VAL  96          HG23      VAL  96  21.786   2.601  -3.000
  706    H    LYS  97           H        LYS  97  21.383  -1.430  -4.952
  707    HA   LYS  97           HA       LYS  97  23.241  -3.064  -6.414
  708   1HB   LYS  97          HB2       LYS  97  21.331  -4.102  -5.329
  709   2HB   LYS  97          HB3       LYS  97  20.189  -3.087  -6.235
  710   1HG   LYS  97          HG2       LYS  97  20.768  -4.130  -8.316
  711   2HG   LYS  97          HG3       LYS  97  22.151  -4.969  -7.589
  712   1HD   LYS  97          HD2       LYS  97  20.717  -6.493  -6.424
  713   2HD   LYS  97          HD3       LYS  97  19.276  -5.525  -6.786
  714   1HE   LYS  97          HE2       LYS  97  19.475  -7.546  -8.248
  715   2HE   LYS  97          HE3       LYS  97  19.393  -6.025  -9.136
  716   1HZ   LYS  97          HZ1       LYS  97  21.876  -7.564  -8.643
  717   2HZ   LYS  97          HZ2       LYS  97  21.057  -7.457 -10.066
  718   3HZ   LYS  97          HZ3       LYS  97  21.791  -6.135  -9.474
  719    H    ARG  98           H        ARG  98  23.438  -3.336  -8.587
  720    HA   ARG  98           HA       ARG  98  21.964  -1.504 -10.358
  721   1HB   ARG  98          HB2       ARG  98  24.577  -1.018  -9.978
  722   2HB   ARG  98          HB3       ARG  98  24.747  -2.339 -11.138
  723   1HG   ARG  98          HG2       ARG  98  22.922  -0.880 -12.491
  724   2HG   ARG  98          HG3       ARG  98  23.533   0.412 -11.480
  725   1HD   ARG  98          HD2       ARG  98  25.120  -1.358 -13.383
  726   2HD   ARG  98          HD3       ARG  98  24.584   0.298 -13.687
  727    HE   ARG  98           HE       ARG  98  26.079   0.544 -11.391
  728   1HH1  ARG  98          HH21      ARG  98  26.689  -0.530 -14.718
  729   2HH1  ARG  98          HH22      ARG  98  28.412  -0.333 -14.601
  730   1HH2  ARG  98          HH11      ARG  98  28.222   0.947 -11.271
  731   2HH2  ARG  98          HH12      ARG  98  29.329   0.610 -12.579
  732    H    GLU  99           H        GLU  99  21.949  -2.374 -12.624
  733    HA   GLU  99           HA       GLU  99  22.423  -5.252 -13.004
  734   1HB   GLU  99          HB2       GLU  99  19.843  -3.699 -13.403
  735   2HB   GLU  99          HB3       GLU  99  20.242  -4.962 -14.552
  736   1HG   GLU  99          HG2       GLU  99  20.035  -5.339 -11.547
  737   2HG   GLU  99          HG3       GLU  99  18.777  -5.752 -12.713
  738    H    HIS 100           H        HIS 100  22.514  -5.661 -15.417
  739    HA   HIS 100           HA       HIS 100  23.647  -3.338 -16.901
  740   1HB   HIS 100          HB2       HIS 100  25.508  -4.474 -15.857
  741   2HB   HIS 100          HB3       HIS 100  24.889  -6.054 -16.331
  742    HD1  HIS 100           HD1      HIS 100  26.625  -2.987 -17.925
  743    HD2  HIS 100           HD2      HIS 100  25.461  -6.951 -18.745
  744    HE1  HIS 100           HE1      HIS 100  27.739  -3.623 -20.118
  745    H    TRP 101           H        TRP 101  22.450  -3.155 -18.666
  746    HA   TRP 101           HA       TRP 101  21.250  -5.571 -19.978
  747   1HB   TRP 101          HB2       TRP 101  20.094  -2.781 -19.591
  748   2HB   TRP 101          HB3       TRP 101  19.426  -3.999 -20.657
  749    HD1  TRP 101           HD1      TRP 101  20.341  -5.293 -17.187
  750    HE1  TRP 101           HE1      TRP 101  18.243  -5.616 -15.812
  751    HE3  TRP 101           HE3      TRP 101  16.959  -3.231 -20.424
  752    HZ2  TRP 101           HZ2      TRP 101  15.437  -4.903 -15.986
  753    HZ3  TRP 101           HZ3      TRP 101  14.556  -3.171 -19.842
  754    HH2  TRP 101           HH2      TRP 101  13.795  -3.939 -17.586
  755    H    GLY 102           H        GLY 102  23.627  -5.265 -20.939
  756   1HA   GLY 102          HA1       GLY 102  24.097  -2.884 -22.444
  757   2HA   GLY 102          HA2       GLY 102  25.091  -4.340 -22.425
  758    H    PHE 103           H        PHE 103  23.622  -2.384 -24.474
  759    HA   PHE 103           HA       PHE 103  23.821  -4.265 -26.650
  760   1HB   PHE 103          HB2       PHE 103  21.563  -3.208 -27.588
  761   2HB   PHE 103          HB3       PHE 103  21.587  -4.694 -26.665
  762    HD1  PHE 103           HD1      PHE 103  20.094  -4.965 -24.894
  763    HD2  PHE 103           HD2      PHE 103  21.226  -0.981 -26.098
  764    HE1  PHE 103           HE1      PHE 103  18.592  -4.019 -23.164
  765    HE2  PHE 103           HE2      PHE 103  19.742  -0.043 -24.340
  766    HZ   PHE 103           HZ       PHE 103  18.474  -1.560 -22.836
  767    H    ASP 104           H        ASP 104  23.882  -2.913 -28.732
  768    HA   ASP 104           HA       ASP 104  25.613  -0.696 -28.267
  769   1HB   ASP 104          HB2       ASP 104  25.793  -2.209 -30.217
  770   2HB   ASP 104          HB3       ASP 104  24.256  -1.585 -30.833
  771    H    ASP 105           H        ASP 105  25.306   1.466 -28.940
  772    HA   ASP 105           HA       ASP 105  22.661   2.516 -28.167
  773   1HB   ASP 105          HB2       ASP 105  24.867   3.650 -27.512
  774   2HB   ASP 105          HB3       ASP 105  24.986   4.174 -29.183
  775    HA   PRO 106           HA       PRO 106  21.552   2.218 -32.422
  776   1HB   PRO 106          HB2       PRO 106  19.205   3.657 -32.528
  777   2HB   PRO 106          HB3       PRO 106  19.343   2.030 -31.815
  778   1HG   PRO 106          HG2       PRO 106  19.386   4.682 -30.365
  779   2HG   PRO 106          HG3       PRO 106  18.479   3.197 -29.936
  780   1HD   PRO 106          HD2       PRO 106  20.859   3.854 -28.777
  781   2HD   PRO 106          HD3       PRO 106  20.455   2.151 -29.130
  782    H    ALA 107           H        ALA 107  22.188   5.383 -30.989
  783    HA   ALA 107           HA       ALA 107  22.147   6.809 -33.485
  784   1HB   ALA 107          HB1       ALA 107  23.684   7.413 -30.926
  785   2HB   ALA 107          HB2       ALA 107  23.388   8.535 -32.268
  786   3HB   ALA 107          HB3       ALA 107  22.025   7.946 -31.298
  787    H    ARG 108           H        ARG 108  24.344   4.401 -32.210
  788    HA   ARG 108           HA       ARG 108  26.669   5.454 -33.714
  789   1HB   ARG 108          HB2       ARG 108  26.307   2.931 -32.032
  790   2HB   ARG 108          HB3       ARG 108  27.780   3.380 -32.882
  791   1HG   ARG 108          HG2       ARG 108  27.926   5.480 -31.546
  792   2HG   ARG 108          HG3       ARG 108  26.489   4.985 -30.648
  793   1HD   ARG 108          HD2       ARG 108  28.457   4.396 -29.334
  794   2HD   ARG 108          HD3       ARG 108  27.698   2.913 -29.912
  795    HE   ARG 108           HE       ARG 108  30.208   4.193 -30.878
  796   1HH1  ARG 108          HH21      ARG 108  28.136   1.242 -30.916
  797   2HH1  ARG 108          HH22      ARG 108  29.275   0.356 -31.857
  798   1HH2  ARG 108          HH11      ARG 108  31.644   2.973 -32.145
  799   2HH2  ARG 108          HH12      ARG 108  31.300   1.337 -32.549
  800    H    ALA 109           H        ALA 109  23.932   3.597 -34.513
  801    HA   ALA 109           HA       ALA 109  25.147   1.581 -36.127
  802   1HB   ALA 109          HB1       ALA 109  22.997   1.305 -34.985
  803   2HB   ALA 109          HB2       ALA 109  22.280   2.584 -35.991
  804   3HB   ALA 109          HB3       ALA 109  22.822   1.066 -36.737
  805    H    GLN 110           H        GLN 110  26.451   3.575 -37.076
  806    HA   GLN 110           HA       GLN 110  25.375   5.295 -39.005
  807   1HB   GLN 110          HB2       GLN 110  27.739   5.753 -39.523
  808   2HB   GLN 110          HB3       GLN 110  27.424   5.701 -37.795
  809   1HG   GLN 110          HG2       GLN 110  28.233   3.127 -38.099
  810   2HG   GLN 110          HG3       GLN 110  29.035   3.814 -39.504
  811   1HE2  GLN 110          HE22      GLN 110  28.681   4.032 -35.936
  812   2HE2  GLN 110          HE21      GLN 110  30.234   4.795 -35.652
  813    H    GLY 111           H        GLY 111  25.608   5.382 -41.184
  814   1HA   GLY 111          HA1       GLY 111  26.520   3.782 -43.151
  815   2HA   GLY 111          HA2       GLY 111  25.042   2.919 -42.645
  816    H    THR 112           H        THR 112  23.251   4.747 -41.985
  817    HA   THR 112           HA       THR 112  23.232   7.218 -43.316
  818    HB   THR 112           HB       THR 112  22.790   6.020 -45.372
  819    HG1  THR 112           HG1      THR 112  20.961   6.994 -45.938
  820   1HG2  THR 112          HG21      THR 112  20.858   4.520 -45.698
  821   2HG2  THR 112          HG22      THR 112  22.022   3.838 -44.559
  822   3HG2  THR 112          HG23      THR 112  20.520   4.572 -43.959
  823    H    GLU 113           H        GLU 113  21.046   8.278 -42.916
  824    HA   GLU 113           HA       GLU 113  20.372   7.955 -40.164
  825   1HB   GLU 113          HB2       GLU 113  18.665   9.638 -40.575
  826   2HB   GLU 113          HB3       GLU 113  20.204  10.099 -41.303
  827   1HG   GLU 113          HG2       GLU 113  19.353   9.344 -43.537
  828   2HG   GLU 113          HG3       GLU 113  17.803   8.943 -42.793
  829    H    GLU 114           H        GLU 114  19.059   6.523 -43.119
  830    HA   GLU 114           HA       GLU 114  16.664   5.524 -41.905
  831   1HB   GLU 114          HB2       GLU 114  16.960   5.836 -44.333
  832   2HB   GLU 114          HB3       GLU 114  18.169   4.544 -44.364
  833   1HG   GLU 114          HG2       GLU 114  16.476   2.907 -43.645
  834   2HG   GLU 114          HG3       GLU 114  15.276   4.190 -43.465
  835    H    GLU 115           H        GLU 115  19.984   4.297 -42.179
  836    HA   GLU 115           HA       GLU 115  19.417   1.638 -41.233
  837   1HB   GLU 115          HB2       GLU 115  21.435   2.306 -42.606
  838   2HB   GLU 115          HB3       GLU 115  22.040   3.196 -41.213
  839   1HG   GLU 115          HG2       GLU 115  23.182   1.132 -41.246
  840   2HG   GLU 115          HG3       GLU 115  22.054   1.046 -39.900
  841    H    LYS 116           H        LYS 116  20.682   4.679 -39.778
  842    HA   LYS 116           HA       LYS 116  20.777   3.813 -37.091
  843   1HB   LYS 116          HB2       LYS 116  20.284   6.539 -38.363
  844   2HB   LYS 116          HB3       LYS 116  20.357   6.300 -36.602
  845   1HG   LYS 116          HG2       LYS 116  22.635   5.227 -36.948
  846   2HG   LYS 116          HG3       LYS 116  22.554   5.769 -38.642
  847   1HD   LYS 116          HD2       LYS 116  22.285   8.132 -37.801
  848   2HD   LYS 116          HD3       LYS 116  22.458   7.511 -36.141
  849   1HE   LYS 116          HE2       LYS 116  24.678   6.444 -37.013
  850   2HE   LYS 116          HE3       LYS 116  24.508   7.552 -38.388
  851   1HZ   LYS 116          HZ1       LYS 116  24.441   9.372 -36.678
  852   2HZ   LYS 116          HZ2       LYS 116  24.793   8.241 -35.525
  853   3HZ   LYS 116          HZ3       LYS 116  25.862   8.570 -36.713
  854    H    TRP 117           H        TRP 117  18.012   5.318 -38.869
  855    HA   TRP 117           HA       TRP 117  16.206   5.240 -36.725
  856   1HB   TRP 117          HB2       TRP 117  15.760   6.566 -38.657
  857   2HB   TRP 117          HB3       TRP 117  15.870   5.175 -39.730
  858    HD1  TRP 117           HD1      TRP 117  13.630   4.719 -40.720
  859    HE1  TRP 117           HE1      TRP 117  11.261   4.371 -39.883
  860    HE3  TRP 117           HE3      TRP 117  14.314   6.069 -35.826
  861    HZ2  TRP 117           HZ2      TRP 117   9.797   4.665 -37.376
  862    HZ3  TRP 117           HZ3      TRP 117  12.460   5.928 -34.228
  863    HH2  TRP 117           HH2      TRP 117  10.187   5.215 -34.979
  864    H    ALA 118           H        ALA 118  16.934   2.657 -39.153
  865    HA   ALA 118           HA       ALA 118  14.939   0.866 -38.180
  866   1HB   ALA 118          HB1       ALA 118  17.545   0.287 -39.630
  867   2HB   ALA 118          HB2       ALA 118  16.189  -0.843 -39.413
  868   3HB   ALA 118          HB3       ALA 118  15.963   0.631 -40.377
  869    H    PHE 119           H        PHE 119  18.370   1.340 -37.264
  870    HA   PHE 119           HA       PHE 119  18.341  -0.778 -35.364
  871   1HB   PHE 119          HB2       PHE 119  20.322   0.636 -36.450
  872   2HB   PHE 119          HB3       PHE 119  20.172   1.555 -34.959
  873    HD1  PHE 119           HD1      PHE 119  20.454   0.293 -32.728
  874    HD2  PHE 119           HD2      PHE 119  21.307  -1.539 -36.534
  875    HE1  PHE 119           HE1      PHE 119  21.792  -1.448 -31.583
  876    HE2  PHE 119           HE2      PHE 119  22.634  -3.292 -35.384
  877    HZ   PHE 119           HZ       PHE 119  22.882  -3.251 -32.908
  878    H    PHE 120           H        PHE 120  17.432   2.649 -35.086
  879    HA   PHE 120           HA       PHE 120  16.986   2.694 -32.263
  880   1HB   PHE 120          HB2       PHE 120  16.052   4.298 -34.607
  881   2HB   PHE 120          HB3       PHE 120  15.002   4.313 -33.212
  882    HD1  PHE 120           HD1      PHE 120  18.226   5.480 -34.534
  883    HD2  PHE 120           HD2      PHE 120  15.778   5.112 -31.005
  884    HE1  PHE 120           HE1      PHE 120  19.636   7.159 -33.384
  885    HE2  PHE 120           HE2      PHE 120  17.200   6.783 -29.857
  886    HZ   PHE 120           HZ       PHE 120  19.101   7.841 -31.058
  887    H    GLN 121           H        GLN 121  14.809   1.629 -34.947
  888    HA   GLN 121           HA       GLN 121  12.677   0.876 -33.189
  889   1HB   GLN 121          HB2       GLN 121  13.391  -0.042 -35.968
  890   2HB   GLN 121          HB3       GLN 121  11.962  -0.595 -35.077
  891   1HG   GLN 121          HG2       GLN 121  10.956   1.524 -35.065
  892   2HG   GLN 121          HG3       GLN 121  12.469   2.381 -35.336
  893   1HE2  GLN 121          HE22      GLN 121  13.387   2.510 -37.403
  894   2HE2  GLN 121          HE21      GLN 121  12.470   2.143 -38.852
  895    H    ARG 122           H        ARG 122  15.558  -0.964 -34.345
  896    HA   ARG 122           HA       ARG 122  14.757  -3.411 -33.097
  897   1HB   ARG 122          HB2       ARG 122  17.546  -2.309 -33.691
  898   2HB   ARG 122          HB3       ARG 122  17.237  -3.934 -33.085
  899   1HG   ARG 122          HG2       ARG 122  15.981  -4.537 -35.079
  900   2HG   ARG 122          HG3       ARG 122  16.036  -2.880 -35.683
  901   1HD   ARG 122          HD2       ARG 122  17.651  -4.257 -36.864
  902   2HD   ARG 122          HD3       ARG 122  18.473  -2.996 -35.931
  903    HE   ARG 122           HE       ARG 122  18.343  -5.323 -34.328
  904   1HH1  ARG 122          HH21      ARG 122  19.917  -4.299 -37.342
  905   2HH1  ARG 122          HH22      ARG 122  21.290  -5.319 -37.139
  906   1HH2  ARG 122          HH11      ARG 122  20.189  -6.666 -34.041
  907   2HH2  ARG 122          HH12      ARG 122  21.445  -6.693 -35.217
  908    H    VAL 123           H        VAL 123  16.840  -0.750 -31.798
  909    HA   VAL 123           HA       VAL 123  17.121  -2.080 -29.294
  910    HB   VAL 123           HB       VAL 123  17.585   0.808 -30.117
  911   1HG1  VAL 123          HG11      VAL 123  18.361  -0.621 -27.526
  912   2HG1  VAL 123          HG12      VAL 123  19.008   0.944 -28.050
  913   3HG1  VAL 123          HG13      VAL 123  17.292   0.788 -27.688
  914   1HG2  VAL 123          HG21      VAL 123  19.956   0.109 -30.128
  915   2HG2  VAL 123          HG22      VAL 123  19.504  -1.522 -29.606
  916   3HG2  VAL 123          HG23      VAL 123  19.031  -0.937 -31.208
  917    H    ARG 124           H        ARG 124  14.612   0.320 -30.419
  918    HA   ARG 124           HA       ARG 124  13.599   0.606 -27.730
  919   1HB   ARG 124          HB2       ARG 124  11.580   1.539 -28.603
  920   2HB   ARG 124          HB3       ARG 124  12.964   2.249 -29.406
  921   1HG   ARG 124          HG2       ARG 124  12.227   1.688 -31.415
  922   2HG   ARG 124          HG3       ARG 124  11.935   0.018 -30.963
  923   1HD   ARG 124          HD2       ARG 124   9.729   1.035 -29.872
  924   2HD   ARG 124          HD3       ARG 124  10.065   2.331 -31.010
  925    HE   ARG 124           HE       ARG 124   9.380   1.043 -32.748
  926   1HH1  ARG 124          HH11      ARG 124   9.798  -1.172 -29.988
  927   2HH1  ARG 124          HH12      ARG 124   9.114  -2.528 -30.832
  928   1HH2  ARG 124          HH21      ARG 124   8.430  -0.572 -33.735
  929   2HH2  ARG 124          HH22      ARG 124   8.279  -2.185 -33.050
  930    H    ASP 125           H        ASP 125  12.851  -1.717 -30.362
  931    HA   ASP 125           HA       ASP 125  10.727  -2.935 -28.920
  932   1HB   ASP 125          HB2       ASP 125  11.429  -3.210 -31.433
  933   2HB   ASP 125          HB3       ASP 125  12.492  -4.488 -30.847
  934    H    GLU 126           H        GLU 126  14.228  -3.793 -29.045
  935    HA   GLU 126           HA       GLU 126  13.961  -6.029 -27.308
  936   1HB   GLU 126          HB2       GLU 126  16.313  -4.223 -27.950
  937   2HB   GLU 126          HB3       GLU 126  16.420  -5.654 -26.906
  938   1HG   GLU 126          HG2       GLU 126  15.598  -7.088 -28.738
  939   2HG   GLU 126          HG3       GLU 126  15.502  -5.698 -29.812
  940    H    ILE 127           H        ILE 127  14.603  -2.547 -26.590
  941    HA   ILE 127           HA       ILE 127  14.926  -2.877 -23.776
  942    HB   ILE 127           HB       ILE 127  14.079  -0.556 -25.546
  943   1HG1  ILE 127          HG12      ILE 127  16.521  -1.089 -23.798
  944   2HG1  ILE 127          HG13      ILE 127  16.481  -1.332 -25.538
  945   1HG2  ILE 127          HG21      ILE 127  14.166   0.955 -23.668
  946   2HG2  ILE 127          HG22      ILE 127  12.934  -0.244 -23.337
  947   3HG2  ILE 127          HG23      ILE 127  14.511  -0.380 -22.534
  948   1HD1  ILE 127          HD11      ILE 127  17.580   0.747 -25.178
  949   2HD1  ILE 127          HD12      ILE 127  15.951   1.163 -25.756
  950   3HD1  ILE 127          HD13      ILE 127  16.362   1.302 -24.030
  951    H    GLY 128           H        GLY 128  11.966  -2.055 -25.711
  952   1HA   GLY 128          HA1       GLY 128  10.107  -2.053 -23.672
  953   2HA   GLY 128          HA2       GLY 128   9.788  -2.608 -25.331
  954    H    ASN 129           H        ASN 129  11.285  -4.948 -25.483
  955    HA   ASN 129           HA       ASN 129   9.668  -6.835 -24.098
  956   1HB   ASN 129          HB2       ASN 129  12.326  -7.109 -25.553
  957   2HB   ASN 129          HB3       ASN 129  11.619  -8.458 -24.685
  958   1HD2  ASN 129          HD22      ASN 129  11.215  -6.346 -27.489
  959   2HD2  ASN 129          HD21      ASN 129  10.047  -7.359 -28.296
  960    H    ARG 130           H        ARG 130  12.989  -5.649 -23.387
  961    HA   ARG 130           HA       ARG 130  13.283  -7.537 -21.254
  962   1HB   ARG 130          HB2       ARG 130  15.042  -6.100 -22.712
  963   2HB   ARG 130          HB3       ARG 130  14.932  -5.014 -21.347
  964   1HG   ARG 130          HG2       ARG 130  15.927  -7.887 -21.468
  965   2HG   ARG 130          HG3       ARG 130  16.807  -6.437 -20.955
  966   1HD   ARG 130          HD2       ARG 130  15.213  -6.281 -19.005
  967   2HD   ARG 130          HD3       ARG 130  14.541  -7.847 -19.493
  968    HE   ARG 130           HE       ARG 130  17.324  -8.176 -19.155
  969   1HH1  ARG 130          HH21      ARG 130  14.420  -7.363 -17.349
  970   2HH1  ARG 130          HH22      ARG 130  14.891  -8.148 -15.864
  971   1HH2  ARG 130          HH11      ARG 130  17.996  -9.282 -17.145
  972   2HH2  ARG 130          HH12      ARG 130  16.887  -9.347 -15.801
  973    H    LEU 131           H        LEU 131  12.084  -4.174 -21.416
  974    HA   LEU 131           HA       LEU 131  11.907  -3.777 -18.592
  975   1HB   LEU 131          HB2       LEU 131  11.299  -2.220 -20.893
  976   2HB   LEU 131          HB3       LEU 131   9.787  -2.428 -20.054
  977    HG   LEU 131           HG       LEU 131  10.700  -0.457 -19.252
  978   1HD1  LEU 131          HD11      LEU 131  11.370  -2.447 -17.062
  979   2HD1  LEU 131          HD12      LEU 131  10.964  -0.753 -16.858
  980   3HD1  LEU 131          HD13      LEU 131   9.735  -1.882 -17.459
  981   1HD2  LEU 131          HD21      LEU 131  12.896  -0.022 -18.549
  982   2HD2  LEU 131          HD22      LEU 131  13.307  -1.737 -18.441
  983   3HD2  LEU 131          HD23      LEU 131  13.064  -0.962 -20.025
  984    H    LYS 132           H        LYS 132   9.647  -5.105 -21.041
  985    HA   LYS 132           HA       LYS 132   7.450  -5.495 -19.341
  986   1HB   LYS 132          HB2       LYS 132   7.378  -5.765 -21.808
  987   2HB   LYS 132          HB3       LYS 132   8.345  -7.231 -21.686
  988   1HG   LYS 132          HG2       LYS 132   6.594  -8.349 -20.387
  989   2HG   LYS 132          HG3       LYS 132   5.610  -6.866 -20.405
  990   1HD   LYS 132          HD2       LYS 132   5.495  -6.972 -22.885
  991   2HD   LYS 132          HD3       LYS 132   6.485  -8.448 -22.870
  992   1HE   LYS 132          HE2       LYS 132   4.745  -9.591 -21.502
  993   2HE   LYS 132          HE3       LYS 132   3.761  -8.122 -21.523
  994   1HZ   LYS 132          HZ1       LYS 132   3.038  -9.694 -23.202
  995   2HZ   LYS 132          HZ2       LYS 132   3.594  -8.351 -23.936
  996   3HZ   LYS 132          HZ3       LYS 132   4.502  -9.711 -23.914
  997    H    GLU 133           H        GLU 133  10.140  -7.753 -20.055
  998    HA   GLU 133           HA       GLU 133   9.206  -9.766 -18.306
  999   1HB   GLU 133          HB2       GLU 133  12.083  -9.138 -19.081
 1000   2HB   GLU 133          HB3       GLU 133  11.533 -10.612 -18.266
 1001   1HG   GLU 133          HG2       GLU 133  10.042 -11.119 -20.186
 1002   2HG   GLU 133          HG3       GLU 133  10.651  -9.700 -21.034
 1003    H    PHE 134           H        PHE 134  11.418  -7.036 -17.660
 1004    HA   PHE 134           HA       PHE 134  12.020  -7.693 -14.980
 1005   1HB   PHE 134          HB2       PHE 134  13.268  -6.051 -16.147
 1006   2HB   PHE 134          HB3       PHE 134  11.832  -5.093 -16.503
 1007    HD1  PHE 134           HD1      PHE 134  14.031  -6.218 -13.679
 1008    HD2  PHE 134           HD2      PHE 134  11.100  -3.372 -15.061
 1009    HE1  PHE 134           HE1      PHE 134  14.382  -4.856 -11.639
 1010    HE2  PHE 134           HE2      PHE 134  11.494  -1.978 -13.055
 1011    HZ   PHE 134           HZ       PHE 134  13.138  -2.730 -11.331
 1012    H    ALA 135           H        ALA 135   9.145  -6.156 -16.339
 1013    HA   ALA 135           HA       ALA 135   8.141  -5.428 -13.706
 1014   1HB   ALA 135          HB1       ALA 135   6.846  -5.278 -16.476
 1015   2HB   ALA 135          HB2       ALA 135   6.240  -4.495 -15.000
 1016   3HB   ALA 135          HB3       ALA 135   7.783  -3.979 -15.717
 1017    H    GLU 136           H        GLU 136   7.622  -7.960 -16.109
 1018    HA   GLU 136           HA       GLU 136   5.167  -8.916 -14.863
 1019   1HB   GLU 136          HB2       GLU 136   5.301  -8.656 -17.296
 1020   2HB   GLU 136          HB3       GLU 136   6.721  -9.695 -17.358
 1021   1HG   GLU 136          HG2       GLU 136   4.856 -10.952 -18.136
 1022   2HG   GLU 136          HG3       GLU 136   5.376 -11.633 -16.608
 1023    H    THR 137           H        THR 137   8.373 -10.214 -15.749
 1024    HA   THR 137           HA       THR 137   7.840 -12.712 -14.299
 1025    HB   THR 137           HB       THR 137   9.578 -13.634 -15.679
 1026    HG1  THR 137           HG1      THR 137  10.627 -12.379 -17.192
 1027   1HG2  THR 137          HG21      THR 137   8.640 -13.439 -17.872
 1028   2HG2  THR 137          HG22      THR 137   7.287 -13.377 -16.719
 1029   3HG2  THR 137          HG23      THR 137   7.885 -11.879 -17.493
 1030    H    GLY 138           H        GLY 138   9.632  -9.752 -14.022
 1031   1HA   GLY 138          HA1       GLY 138  10.857  -8.947 -12.249
 1032   2HA   GLY 138          HA2       GLY 138  10.629 -10.476 -11.387
 1033    H    LYS 139           H        LYS 139  11.938 -10.466 -14.696
 1034    HA   LYS 139           HA       LYS 139  14.297 -11.860 -13.804
 1035   1HB   LYS 139          HB2       LYS 139  13.208 -10.881 -16.476
 1036   2HB   LYS 139          HB3       LYS 139  14.766 -11.682 -16.354
 1037   1HG   LYS 139          HG2       LYS 139  12.112 -12.877 -15.413
 1038   2HG   LYS 139          HG3       LYS 139  12.861 -13.213 -16.975
 1039   1HD   LYS 139          HD2       LYS 139  13.891 -13.963 -14.208
 1040   2HD   LYS 139          HD3       LYS 139  13.202 -15.040 -15.430
 1041   1HE   LYS 139          HE2       LYS 139  15.031 -14.410 -16.998
 1042   2HE   LYS 139          HE3       LYS 139  15.745 -13.399 -15.731
 1043   1HZ   LYS 139          HZ1       LYS 139  15.402 -16.344 -15.566
 1044   2HZ   LYS 139          HZ2       LYS 139  16.811 -15.573 -15.830
 1045   3HZ   LYS 139          HZ3       LYS 139  16.060 -15.411 -14.396
  Start of MODEL   11
    1   1H    MET   1           H1       MET   1   7.038   5.107   2.833
    2   2H    MET   1           H2       MET   1   7.311   3.492   2.816
    3   3H    MET   1           H3       MET   1   8.214   4.468   1.873
    4    HA   MET   1           HA       MET   1   5.348   3.927   1.612
    5   1HB   MET   1          HB2       MET   1   5.307   5.268  -0.402
    6   2HB   MET   1          HB3       MET   1   5.783   6.241   0.981
    7   1HG   MET   1          HG2       MET   1   8.152   6.163   0.229
    8   2HG   MET   1          HG3       MET   1   7.692   5.118  -1.115
    9   1HE   MET   1          HE1       MET   1   7.718   8.723   0.373
   10   2HE   MET   1          HE2       MET   1   6.727   9.644  -0.779
   11   3HE   MET   1          HE3       MET   1   5.955   8.482   0.316
   12    H    GLU   2           H        GLU   2   4.729   2.533  -0.127
   13    HA   GLU   2           HA       GLU   2   6.684   0.461  -0.628
   14   1HB   GLU   2          HB2       GLU   2   4.261   0.127  -0.098
   15   2HB   GLU   2          HB3       GLU   2   3.847   0.759  -1.696
   16   1HG   GLU   2          HG2       GLU   2   4.996  -1.119  -2.778
   17   2HG   GLU   2          HG3       GLU   2   5.665  -1.651  -1.236
   18    H    ASN   3           H        ASN   3   5.835   3.350  -2.363
   19    HA   ASN   3           HA       ASN   3   6.194   2.611  -5.043
   20   1HB   ASN   3          HB2       ASN   3   5.514   4.892  -4.754
   21   2HB   ASN   3          HB3       ASN   3   6.794   5.210  -3.555
   22   1HD2  ASN   3          HD22      ASN   3   6.294   4.263  -6.965
   23   2HD2  ASN   3          HD21      ASN   3   7.670   5.199  -7.505
   24    H    LYS   4           H        LYS   4   7.891   2.130  -6.257
   25    HA   LYS   4           HA       LYS   4  10.573   1.961  -4.980
   26   1HB   LYS   4          HB2       LYS   4   9.533   0.782  -7.588
   27   2HB   LYS   4          HB3       LYS   4  11.094   0.393  -6.885
   28   1HG   LYS   4          HG2       LYS   4   8.437  -0.340  -5.547
   29   2HG   LYS   4          HG3       LYS   4   9.208  -1.330  -6.764
   30   1HD   LYS   4          HD2       LYS   4   9.718  -2.228  -4.628
   31   2HD   LYS   4          HD3       LYS   4  11.200  -1.615  -5.372
   32   1HE   LYS   4          HE2       LYS   4  10.992   0.445  -3.925
   33   2HE   LYS   4          HE3       LYS   4   9.568  -0.280  -3.161
   34   1HZ   LYS   4          HZ1       LYS   4  11.042  -2.106  -2.437
   35   2HZ   LYS   4          HZ2       LYS   4  12.337  -1.367  -3.139
   36   3HZ   LYS   4          HZ3       LYS   4  11.571  -0.670  -1.870
   37    H    ILE   5           H        ILE   5  12.406   2.363  -6.672
   38    HA   ILE   5           HA       ILE   5  11.715   4.633  -8.419
   39    HB   ILE   5           HB       ILE   5  13.911   4.713  -6.330
   40   1HG1  ILE   5          HG12      ILE   5  12.477   6.924  -5.720
   41   2HG1  ILE   5          HG13      ILE   5  11.166   5.871  -6.217
   42   1HG2  ILE   5          HG21      ILE   5  13.043   6.794  -8.370
   43   2HG2  ILE   5          HG22      ILE   5  14.272   7.057  -7.111
   44   3HG2  ILE   5          HG23      ILE   5  14.568   5.894  -8.398
   45   1HD1  ILE   5          HD11      ILE   5  13.281   5.297  -4.097
   46   2HD1  ILE   5          HD12      ILE   5  11.578   5.705  -3.803
   47   3HD1  ILE   5          HD13      ILE   5  12.007   4.155  -4.552
   48    H    ILE   6           H        ILE   6  13.116   4.646 -10.268
   49    HA   ILE   6           HA       ILE   6  15.273   2.631 -10.312
   50    HB   ILE   6           HB       ILE   6  13.303   1.404 -11.003
   51   1HG1  ILE   6          HG12      ILE   6  15.070   1.936 -13.427
   52   2HG1  ILE   6          HG13      ILE   6  15.556   0.976 -12.024
   53   1HG2  ILE   6          HG21      ILE   6  11.915   3.286 -11.869
   54   2HG2  ILE   6          HG22      ILE   6  12.992   3.402 -13.282
   55   3HG2  ILE   6          HG23      ILE   6  12.002   1.956 -13.012
   56   1HD1  ILE   6          HD11      ILE   6  13.261   0.338 -13.916
   57   2HD1  ILE   6          HD12      ILE   6  14.813  -0.501 -13.783
   58   3HD1  ILE   6          HD13      ILE   6  13.655  -0.572 -12.438
   59    H    TYR   7           H        TYR   7  16.902   3.076 -11.827
   60    HA   TYR   7           HA       TYR   7  16.706   5.716 -13.158
   61   1HB   TYR   7          HB2       TYR   7  17.670   5.676 -10.773
   62   2HB   TYR   7          HB3       TYR   7  19.023   4.783 -11.433
   63    HD1  TYR   7           HD1      TYR   7  20.416   6.517 -10.400
   64    HD2  TYR   7           HD2      TYR   7  17.600   7.544 -13.504
   65    HE1  TYR   7           HE1      TYR   7  21.389   8.799 -10.552
   66    HE2  TYR   7           HE2      TYR   7  18.530   9.801 -13.621
   67    HH   TYR   7           HH       TYR   7  20.006  11.332 -12.655
   68    H    PHE   8           H        PHE   8  17.316   5.531 -15.205
   69    HA   PHE   8           HA       PHE   8  19.012   3.214 -16.073
   70   1HB   PHE   8          HB2       PHE   8  17.243   5.050 -17.737
   71   2HB   PHE   8          HB3       PHE   8  18.128   3.651 -18.317
   72    HD1  PHE   8           HD1      PHE   8  15.005   4.806 -16.955
   73    HD2  PHE   8           HD2      PHE   8  17.522   1.328 -17.308
   74    HE1  PHE   8           HE1      PHE   8  13.083   3.325 -16.440
   75    HE2  PHE   8           HE2      PHE   8  15.604  -0.131 -16.746
   76    HZ   PHE   8           HZ       PHE   8  13.385   0.880 -16.267
   77    H    LEU   9           H        LEU   9  21.062   3.595 -16.767
   78    HA   LEU   9           HA       LEU   9  21.974   6.431 -17.034
   79   1HB   LEU   9          HB2       LEU   9  23.035   4.006 -15.598
   80   2HB   LEU   9          HB3       LEU   9  24.187   5.141 -16.285
   81    HG   LEU   9           HG       LEU   9  23.389   6.958 -14.950
   82   1HD1  LEU   9          HD11      LEU   9  21.695   6.582 -13.129
   83   2HD1  LEU   9          HD12      LEU   9  21.028   6.666 -14.749
   84   3HD1  LEU   9          HD13      LEU   9  21.219   5.082 -13.957
   85   1HD2  LEU   9          HD21      LEU   9  23.948   6.080 -12.696
   86   2HD2  LEU   9          HD22      LEU   9  23.754   4.424 -13.311
   87   3HD2  LEU   9          HD23      LEU   9  25.041   5.461 -13.931
   88    H    CYS  10           H        CYS  10  23.289   6.942 -18.750
   89    HA   CYS  10           HA       CYS  10  24.324   4.774 -20.521
   90   1HB   CYS  10          HB2       CYS  10  22.520   7.130 -21.210
   91   2HB   CYS  10          HB3       CYS  10  23.569   6.404 -22.439
   92    HG   CYS  10           HG       CYS  10  21.789   4.506 -20.476
   93    H    THR  11           H        THR  11  25.848   5.682 -22.189
   94    HA   THR  11           HA       THR  11  27.853   7.369 -21.085
   95    HB   THR  11           HB       THR  11  28.597   7.275 -23.591
   96    HG1  THR  11           HG1      THR  11  27.600   5.706 -24.772
   97   1HG2  THR  11          HG21      THR  11  29.390   4.966 -23.299
   98   2HG2  THR  11          HG22      THR  11  29.504   5.844 -21.762
   99   3HG2  THR  11          HG23      THR  11  28.189   4.680 -22.019
  100    H    GLY  12           H        GLY  12  24.891   8.026 -22.898
  101   1HA   GLY  12          HA1       GLY  12  25.112  10.817 -22.146
  102   2HA   GLY  12          HA2       GLY  12  25.006  10.529 -23.898
  103    H    ASN  13           H        ASN  13  23.054  11.516 -21.649
  104    HA   ASN  13           HA       ASN  13  20.963   9.516 -21.575
  105   1HB   ASN  13          HB2       ASN  13  21.500  11.116 -19.717
  106   2HB   ASN  13          HB3       ASN  13  20.903  12.428 -20.725
  107   1HD2  ASN  13          HD22      ASN  13  19.251   9.170 -20.622
  108   2HD2  ASN  13          HD21      ASN  13  17.875   9.772 -19.717
  109    H    SER  14           H        SER  14  21.245   9.720 -24.190
  110    HA   SER  14           HA       SER  14  19.312  11.792 -25.160
  111   1HB   SER  14          HB2       SER  14  21.637  10.595 -26.671
  112   2HB   SER  14          HB3       SER  14  20.660  12.011 -27.103
  113    HG   SER  14           HG       SER  14  22.670  12.588 -26.150
  114    H    CYS  15           H        CYS  15  20.035   8.316 -25.306
  115    HA   CYS  15           HA       CYS  15  17.851   8.038 -27.336
  116   1HB   CYS  15          HB2       CYS  15  20.529   6.579 -27.358
  117   2HB   CYS  15          HB3       CYS  15  19.218   6.398 -28.531
  118    HG   CYS  15           HG       CYS  15  21.423   7.665 -29.328
  119    H    ARG  16           H        ARG  16  19.815   5.387 -26.126
  120    HA   ARG  16           HA       ARG  16  17.506   3.845 -25.703
  121   1HB   ARG  16          HB2       ARG  16  19.014   2.112 -25.003
  122   2HB   ARG  16          HB3       ARG  16  19.718   3.008 -26.345
  123   1HG   ARG  16          HG2       ARG  16  20.891   4.361 -24.352
  124   2HG   ARG  16          HG3       ARG  16  20.551   2.898 -23.454
  125   1HD   ARG  16          HD2       ARG  16  22.433   1.998 -24.279
  126   2HD   ARG  16          HD3       ARG  16  21.733   2.020 -25.897
  127    HE   ARG  16           HE       ARG  16  22.591   4.333 -26.168
  128   1HH1  ARG  16          HH11      ARG  16  24.249   2.384 -23.667
  129   2HH1  ARG  16          HH12      ARG  16  25.559   3.529 -23.558
  130   1HH2  ARG  16          HH21      ARG  16  24.122   5.742 -25.946
  131   2HH2  ARG  16          HH22      ARG  16  25.473   5.557 -24.835
  132    H    SER  17           H        SER  17  19.379   5.676 -23.293
  133    HA   SER  17           HA       SER  17  18.090   4.700 -20.939
  134   1HB   SER  17          HB2       SER  17  18.586   7.162 -20.183
  135   2HB   SER  17          HB3       SER  17  19.913   6.057 -20.444
  136    HG   SER  17           HG       SER  17  20.518   7.187 -22.181
  137    H    GLN  18           H        GLN  18  17.287   7.431 -23.088
  138    HA   GLN  18           HA       GLN  18  14.972   8.261 -21.659
  139   1HB   GLN  18          HB2       GLN  18  15.992   8.705 -24.500
  140   2HB   GLN  18          HB3       GLN  18  14.475   9.396 -23.951
  141   1HG   GLN  18          HG2       GLN  18  17.090   9.866 -22.459
  142   2HG   GLN  18          HG3       GLN  18  16.548  10.888 -23.778
  143   1HE2  GLN  18          HE22      GLN  18  16.706  12.503 -21.739
  144   2HE2  GLN  18          HE21      GLN  18  15.205  12.637 -20.828
  145    H    MET  19           H        MET  19  15.340   6.110 -24.486
  146    HA   MET  19           HA       MET  19  12.561   5.526 -24.793
  147   1HB   MET  19          HB2       MET  19  14.967   3.768 -25.458
  148   2HB   MET  19          HB3       MET  19  13.301   3.479 -25.966
  149   1HG   MET  19          HG2       MET  19  13.412   5.875 -26.984
  150   2HG   MET  19          HG3       MET  19  15.162   5.694 -26.852
  151   1HE   MET  19          HE1       MET  19  16.591   3.887 -28.201
  152   2HE   MET  19          HE2       MET  19  15.598   2.557 -27.552
  153   3HE   MET  19          HE3       MET  19  15.868   2.690 -29.301
  154    H    ALA  20           H        ALA  20  15.083   3.858 -22.789
  155    HA   ALA  20           HA       ALA  20  13.371   1.791 -21.857
  156   1HB   ALA  20          HB1       ALA  20  15.049   1.509 -20.066
  157   2HB   ALA  20          HB2       ALA  20  15.844   1.726 -21.639
  158   3HB   ALA  20          HB3       ALA  20  15.780   3.071 -20.476
  159    H    GLU  21           H        GLU  21  14.083   5.017 -20.451
  160    HA   GLU  21           HA       GLU  21  12.376   4.770 -18.218
  161   1HB   GLU  21          HB2       GLU  21  14.007   6.590 -18.609
  162   2HB   GLU  21          HB3       GLU  21  12.945   7.269 -19.850
  163   1HG   GLU  21          HG2       GLU  21  11.146   7.451 -18.041
  164   2HG   GLU  21          HG3       GLU  21  12.370   6.945 -16.881
  165    H    GLY  22           H        GLY  22  11.569   5.769 -21.608
  166   1HA   GLY  22          HA1       GLY  22   8.860   6.392 -21.268
  167   2HA   GLY  22          HA2       GLY  22   9.611   5.710 -22.740
  168    H    TRP  23           H        TRP  23  10.302   3.213 -22.177
  169    HA   TRP  23           HA       TRP  23   7.811   1.801 -22.169
  170   1HB   TRP  23          HB2       TRP  23  10.695   0.890 -21.811
  171   2HB   TRP  23          HB3       TRP  23   9.335  -0.220 -21.863
  172    HD1  TRP  23           HD1      TRP  23  11.703   1.494 -24.112
  173    HE1  TRP  23           HE1      TRP  23  11.101   1.110 -26.544
  174    HE3  TRP  23           HE3      TRP  23   6.973  -0.337 -23.467
  175    HZ2  TRP  23           HZ2      TRP  23   8.830   0.053 -28.068
  176    HZ3  TRP  23           HZ3      TRP  23   5.668  -1.152 -25.406
  177    HH2  TRP  23           HH2      TRP  23   6.603  -1.012 -27.695
  178    H    ALA  24           H        ALA  24  10.292   2.270 -19.611
  179    HA   ALA  24           HA       ALA  24   9.108   0.506 -17.758
  180   1HB   ALA  24          HB1       ALA  24  10.564   1.662 -16.108
  181   2HB   ALA  24          HB2       ALA  24  11.429   1.276 -17.599
  182   3HB   ALA  24          HB3       ALA  24  10.882   2.932 -17.316
  183    H    LYS  25           H        LYS  25   8.600   4.068 -18.199
  184    HA   LYS  25           HA       LYS  25   6.820   4.392 -16.030
  185   1HB   LYS  25          HB2       LYS  25   6.971   5.760 -18.741
  186   2HB   LYS  25          HB3       LYS  25   5.778   6.216 -17.516
  187   1HG   LYS  25          HG2       LYS  25   7.591   6.668 -15.881
  188   2HG   LYS  25          HG3       LYS  25   8.795   6.231 -17.087
  189   1HD   LYS  25          HD2       LYS  25   8.716   8.599 -16.997
  190   2HD   LYS  25          HD3       LYS  25   7.967   8.127 -18.531
  191   1HE   LYS  25          HE2       LYS  25   5.740   8.524 -17.656
  192   2HE   LYS  25          HE3       LYS  25   6.356   8.691 -16.007
  193   1HZ   LYS  25          HZ1       LYS  25   5.874  10.835 -16.986
  194   2HZ   LYS  25          HZ2       LYS  25   7.468  10.729 -16.675
  195   3HZ   LYS  25          HZ3       LYS  25   6.920  10.604 -18.215
  196    H    GLN  26           H        GLN  26   6.190   2.964 -19.213
  197    HA   GLN  26           HA       GLN  26   3.344   2.835 -18.746
  198   1HB   GLN  26          HB2       GLN  26   4.775   0.995 -20.676
  199   2HB   GLN  26          HB3       GLN  26   3.107   1.538 -20.683
  200   1HG   GLN  26          HG2       GLN  26   5.596   2.971 -21.534
  201   2HG   GLN  26          HG3       GLN  26   4.122   2.683 -22.433
  202   1HE2  GLN  26          HE22      GLN  26   5.888   5.079 -20.971
  203   2HE2  GLN  26          HE21      GLN  26   4.603   6.242 -20.670
  204    H    TYR  27           H        TYR  27   5.819   0.232 -18.850
  205    HA   TYR  27           HA       TYR  27   3.974  -1.741 -17.967
  206   1HB   TYR  27          HB2       TYR  27   7.014  -1.769 -17.904
  207   2HB   TYR  27          HB3       TYR  27   5.994  -3.167 -17.608
  208    HD1  TYR  27           HD1      TYR  27   7.857  -1.557 -20.076
  209    HD2  TYR  27           HD2      TYR  27   4.122  -3.624 -19.506
  210    HE1  TYR  27           HE1      TYR  27   7.892  -2.250 -22.448
  211    HE2  TYR  27           HE2      TYR  27   4.069  -4.202 -21.915
  212    HH   TYR  27           HH       TYR  27   6.713  -3.306 -24.171
  213    H    LEU  28           H        LEU  28   6.337   0.195 -16.112
  214    HA   LEU  28           HA       LEU  28   5.818  -1.222 -13.631
  215   1HB   LEU  28          HB2       LEU  28   7.133   1.484 -14.059
  216   2HB   LEU  28          HB3       LEU  28   7.190   0.508 -12.619
  217    HG   LEU  28           HG       LEU  28   8.419  -0.274 -15.290
  218   1HD1  LEU  28          HD11      LEU  28  10.552   0.082 -14.224
  219   2HD1  LEU  28          HD12      LEU  28   9.576   1.556 -14.052
  220   3HD1  LEU  28          HD13      LEU  28   9.777   0.454 -12.673
  221   1HD2  LEU  28          HD21      LEU  28   8.560  -1.751 -12.636
  222   2HD2  LEU  28          HD22      LEU  28   7.692  -2.297 -14.085
  223   3HD2  LEU  28          HD23      LEU  28   9.444  -2.160 -14.122
  224    H    GLY  29           H        GLY  29   3.806   0.805 -15.335
  225   1HA   GLY  29          HA1       GLY  29   1.830   1.767 -14.868
  226   2HA   GLY  29          HA2       GLY  29   1.780   0.646 -13.500
  227    H    ASP  30           H        ASP  30   4.140   3.243 -13.730
  228    HA   ASP  30           HA       ASP  30   4.717   4.938 -12.397
  229   1HB   ASP  30          HB2       ASP  30   2.812   5.952 -13.488
  230   2HB   ASP  30          HB3       ASP  30   1.731   5.399 -12.209
  231    H    GLU  31           H        GLU  31   3.787   2.182 -11.130
  232    HA   GLU  31           HA       GLU  31   3.532   2.845  -8.332
  233   1HB   GLU  31          HB2       GLU  31   4.313   0.254  -9.705
  234   2HB   GLU  31          HB3       GLU  31   4.007   0.430  -7.983
  235   1HG   GLU  31          HG2       GLU  31   1.977   1.069 -10.158
  236   2HG   GLU  31          HG3       GLU  31   2.118  -0.499  -9.372
  237    H    TRP  32           H        TRP  32   6.029   3.031 -10.607
  238    HA   TRP  32           HA       TRP  32   8.182   2.976  -8.582
  239   1HB   TRP  32          HB2       TRP  32   8.380   2.188 -11.506
  240   2HB   TRP  32          HB3       TRP  32   9.701   2.252 -10.361
  241    HD1  TRP  32           HD1      TRP  32   6.302   0.359 -10.398
  242    HE1  TRP  32           HE1      TRP  32   6.687  -2.088  -9.844
  243    HE3  TRP  32           HE3      TRP  32  11.402   0.446  -9.954
  244    HZ2  TRP  32           HZ2      TRP  32   8.920  -3.854  -9.546
  245    HZ3  TRP  32           HZ3      TRP  32  12.645  -1.674  -9.632
  246    HH2  TRP  32           HH2      TRP  32  11.419  -3.843  -9.481
  247    H    LYS  33           H        LYS  33   9.116   5.022  -8.459
  248    HA   LYS  33           HA       LYS  33   8.551   7.141 -10.382
  249   1HB   LYS  33          HB2       LYS  33  10.504   6.872  -8.077
  250   2HB   LYS  33          HB3       LYS  33  10.269   8.357  -9.012
  251   1HG   LYS  33          HG2       LYS  33   8.213   7.002  -7.245
  252   2HG   LYS  33          HG3       LYS  33   9.129   8.420  -6.851
  253   1HD   LYS  33          HD2       LYS  33   7.025   9.196  -7.339
  254   2HD   LYS  33          HD3       LYS  33   7.915   9.520  -8.850
  255   1HE   LYS  33          HE2       LYS  33   6.852   7.365  -9.759
  256   2HE   LYS  33          HE3       LYS  33   5.926   7.259  -8.268
  257   1HZ   LYS  33          HZ1       LYS  33   4.817   8.321 -10.222
  258   2HZ   LYS  33          HZ2       LYS  33   4.781   9.243  -8.854
  259   3HZ   LYS  33          HZ3       LYS  33   5.811   9.599 -10.077
  260    H    VAL  34           H        VAL  34   9.381   6.969 -12.405
  261    HA   VAL  34           HA       VAL  34  11.848   5.464 -12.795
  262    HB   VAL  34           HB       VAL  34  10.056   6.590 -14.962
  263   1HG1  VAL  34          HG11      VAL  34  12.339   5.375 -15.367
  264   2HG1  VAL  34          HG12      VAL  34  11.451   3.906 -14.934
  265   3HG1  VAL  34          HG13      VAL  34  10.915   4.899 -16.309
  266   1HG2  VAL  34          HG21      VAL  34   8.410   5.415 -13.665
  267   2HG2  VAL  34          HG22      VAL  34   8.863   4.346 -14.989
  268   3HG2  VAL  34          HG23      VAL  34   9.515   4.051 -13.365
  269    H    TYR  35           H        TYR  35  13.763   6.444 -13.478
  270    HA   TYR  35           HA       TYR  35  13.697   9.202 -14.595
  271   1HB   TYR  35          HB2       TYR  35  15.529   8.181 -12.378
  272   2HB   TYR  35          HB3       TYR  35  15.684   9.733 -13.182
  273    HD1  TYR  35           HD1      TYR  35  13.979   7.857 -10.562
  274    HD2  TYR  35           HD2      TYR  35  13.959  11.530 -12.830
  275    HE1  TYR  35           HE1      TYR  35  12.557   8.922  -8.830
  276    HE2  TYR  35           HE2      TYR  35  12.517  12.589 -11.121
  277    HH   TYR  35           HH       TYR  35  11.400  12.312  -9.090
  278    H    SER  36           H        SER  36  15.811   9.708 -15.712
  279    HA   SER  36           HA       SER  36  17.665   7.509 -16.016
  280   1HB   SER  36          HB2       SER  36  17.714   7.521 -18.410
  281   2HB   SER  36          HB3       SER  36  16.090   7.094 -17.875
  282    HG   SER  36           HG       SER  36  15.357   9.088 -18.411
  283    H    ALA  37           H        ALA  37  19.699   8.235 -17.034
  284    HA   ALA  37           HA       ALA  37  20.262  11.045 -17.346
  285   1HB   ALA  37          HB1       ALA  37  21.784  11.230 -15.420
  286   2HB   ALA  37          HB2       ALA  37  20.136  10.978 -14.891
  287   3HB   ALA  37          HB3       ALA  37  21.289   9.617 -14.850
  288    H    GLY  38           H        GLY  38  23.003  11.033 -17.029
  289   1HA   GLY  38          HA1       GLY  38  24.328   8.615 -17.687
  290   2HA   GLY  38          HA2       GLY  38  24.046   9.552 -19.170
  291    H    ILE  39           H        ILE  39  26.520   9.198 -18.804
  292    HA   ILE  39           HA       ILE  39  28.065  10.931 -17.189
  293    HB   ILE  39           HB       ILE  39  28.369   9.304 -19.674
  294   1HG1  ILE  39          HG12      ILE  39  30.196   9.593 -17.258
  295   2HG1  ILE  39          HG13      ILE  39  28.762   8.578 -17.257
  296   1HG2  ILE  39          HG21      ILE  39  30.458  11.396 -19.009
  297   2HG2  ILE  39          HG22      ILE  39  30.638  10.069 -20.182
  298   3HG2  ILE  39          HG23      ILE  39  29.452  11.325 -20.480
  299   1HD1  ILE  39          HD11      ILE  39  29.687   7.262 -19.172
  300   2HD1  ILE  39          HD12      ILE  39  31.182   8.225 -19.080
  301   3HD1  ILE  39          HD13      ILE  39  30.711   7.203 -17.723
  302    H    GLU  40           H        GLU  40  26.074  11.670 -19.996
  303    HA   GLU  40           HA       GLU  40  26.475  14.462 -19.482
  304   1HB   GLU  40          HB2       GLU  40  26.826  15.140 -21.780
  305   2HB   GLU  40          HB3       GLU  40  28.193  14.204 -21.188
  306   1HG   GLU  40          HG2       GLU  40  27.547  12.260 -22.458
  307   2HG   GLU  40          HG3       GLU  40  25.963  12.935 -22.838
  308    H    ALA  41           H        ALA  41  24.809  15.712 -20.842
  309    HA   ALA  41           HA       ALA  41  22.631  14.155 -21.996
  310   1HB   ALA  41          HB1       ALA  41  21.852  14.324 -19.689
  311   2HB   ALA  41          HB2       ALA  41  22.267  16.054 -19.620
  312   3HB   ALA  41          HB3       ALA  41  20.948  15.505 -20.665
  313    H    HIS  42           H        HIS  42  21.929  15.268 -23.764
  314    HA   HIS  42           HA       HIS  42  22.261  18.208 -23.905
  315   1HB   HIS  42          HB2       HIS  42  23.333  16.175 -25.905
  316   2HB   HIS  42          HB3       HIS  42  23.016  17.854 -26.334
  317    HD1  HIS  42           HD1      HIS  42  25.818  15.825 -24.865
  318    HD2  HIS  42           HD2      HIS  42  24.327  19.779 -24.747
  319    HE1  HIS  42           HE1      HIS  42  27.677  17.269 -23.954
  320    H    GLY  43           H        GLY  43  20.064  16.136 -23.453
  321   1HA   GLY  43          HA1       GLY  43  17.774  16.417 -23.844
  322   2HA   GLY  43          HA2       GLY  43  18.095  17.284 -25.349
  323    H    LEU  44           H        LEU  44  16.304  15.058 -24.976
  324    HA   LEU  44           HA       LEU  44  17.508  12.645 -25.878
  325   1HB   LEU  44          HB2       LEU  44  15.355  11.724 -25.982
  326   2HB   LEU  44          HB3       LEU  44  15.389  12.772 -24.572
  327    HG   LEU  44           HG       LEU  44  14.054  13.368 -27.255
  328   1HD1  LEU  44          HD11      LEU  44  11.993  13.086 -25.903
  329   2HD1  LEU  44          HD12      LEU  44  13.006  11.634 -25.881
  330   3HD1  LEU  44          HD13      LEU  44  12.982  12.711 -24.474
  331   1HD2  LEU  44          HD21      LEU  44  14.056  15.036 -24.688
  332   2HD2  LEU  44          HD22      LEU  44  14.686  15.533 -26.285
  333   3HD2  LEU  44          HD23      LEU  44  12.962  15.282 -26.063
  334    H    ASN  45           H        ASN  45  17.249  11.560 -27.867
  335    HA   ASN  45           HA       ASN  45  17.860  13.251 -30.127
  336   1HB   ASN  45          HB2       ASN  45  18.965  11.093 -29.516
  337   2HB   ASN  45          HB3       ASN  45  17.484  10.227 -29.902
  338   1HD2  ASN  45          HD22      ASN  45  20.390  10.491 -31.096
  339   2HD2  ASN  45          HD21      ASN  45  20.072  10.633 -32.811
  340    HA   PRO  46           HA       PRO  46  13.593  13.492 -31.667
  341   1HB   PRO  46          HB2       PRO  46  15.024  13.539 -34.331
  342   2HB   PRO  46          HB3       PRO  46  13.641  14.536 -33.781
  343   1HG   PRO  46          HG2       PRO  46  16.149  15.562 -33.758
  344   2HG   PRO  46          HG3       PRO  46  15.057  15.842 -32.362
  345   1HD   PRO  46          HD2       PRO  46  17.306  13.840 -32.618
  346   2HD   PRO  46          HD3       PRO  46  16.856  14.875 -31.228
  347    H    ASN  47           H        ASN  47  15.947  11.126 -33.020
  348    HA   ASN  47           HA       ASN  47  13.858   9.520 -34.277
  349   1HB   ASN  47          HB2       ASN  47  16.787   9.021 -33.674
  350   2HB   ASN  47          HB3       ASN  47  15.728   7.762 -34.297
  351   1HD2  ASN  47          HD22      ASN  47  18.083   8.808 -35.651
  352   2HD2  ASN  47          HD21      ASN  47  17.511   9.466 -37.159
  353    H    ALA  48           H        ALA  48  15.294   9.734 -31.053
  354    HA   ALA  48           HA       ALA  48  14.284   7.213 -30.104
  355   1HB   ALA  48          HB1       ALA  48  14.752   8.047 -27.899
  356   2HB   ALA  48          HB2       ALA  48  16.066   8.647 -28.928
  357   3HB   ALA  48          HB3       ALA  48  14.760   9.730 -28.435
  358    H    VAL  49           H        VAL  49  13.091  10.614 -30.142
  359    HA   VAL  49           HA       VAL  49  10.608  10.113 -28.897
  360    HB   VAL  49           HB       VAL  49  11.268  12.238 -30.990
  361   1HG1  VAL  49          HG11      VAL  49   9.454  13.535 -29.885
  362   2HG1  VAL  49          HG12      VAL  49   8.853  12.081 -30.680
  363   3HG1  VAL  49          HG13      VAL  49   9.045  12.107 -28.908
  364   1HG2  VAL  49          HG21      VAL  49  11.679  13.704 -29.036
  365   2HG2  VAL  49          HG22      VAL  49  11.427  12.318 -27.957
  366   3HG2  VAL  49          HG23      VAL  49  12.815  12.355 -29.066
  367    H    LYS  50           H        LYS  50  11.429  10.119 -32.435
  368    HA   LYS  50           HA       LYS  50   8.846   9.304 -33.298
  369   1HB   LYS  50          HB2       LYS  50  11.620   8.918 -34.502
  370   2HB   LYS  50          HB3       LYS  50  10.171   8.367 -35.317
  371   1HG   LYS  50          HG2       LYS  50  10.769  11.254 -34.547
  372   2HG   LYS  50          HG3       LYS  50  10.935  10.557 -36.151
  373   1HD   LYS  50          HD2       LYS  50   8.359  11.015 -34.595
  374   2HD   LYS  50          HD3       LYS  50   8.884  11.852 -36.038
  375   1HE   LYS  50          HE2       LYS  50   8.156   8.880 -35.907
  376   2HE   LYS  50          HE3       LYS  50   7.078  10.171 -36.433
  377   1HZ   LYS  50          HZ1       LYS  50   8.600  10.645 -38.256
  378   2HZ   LYS  50          HZ2       LYS  50   9.603   9.435 -37.801
  379   3HZ   LYS  50          HZ3       LYS  50   8.095   9.101 -38.319
  380    H    ALA  51           H        ALA  51  11.644   7.268 -32.279
  381    HA   ALA  51           HA       ALA  51  10.474   4.808 -33.002
  382   1HB   ALA  51          HB1       ALA  51  12.369   5.405 -30.682
  383   2HB   ALA  51          HB2       ALA  51  12.072   3.817 -31.415
  384   3HB   ALA  51          HB3       ALA  51  12.853   5.095 -32.361
  385    H    MET  52           H        MET  52  10.251   6.664 -29.912
  386    HA   MET  52           HA       MET  52   8.528   4.715 -28.684
  387   1HB   MET  52          HB2       MET  52   8.981   7.648 -28.017
  388   2HB   MET  52          HB3       MET  52   8.108   6.495 -27.008
  389   1HG   MET  52          HG2       MET  52  11.049   6.482 -27.725
  390   2HG   MET  52          HG3       MET  52  10.312   6.650 -26.146
  391   1HE   MET  52          HE1       MET  52   8.952   4.763 -24.997
  392   2HE   MET  52          HE2       MET  52   8.133   4.072 -26.431
  393   3HE   MET  52          HE3       MET  52   9.080   3.036 -25.356
  394    H    LYS  53           H        LYS  53   7.834   7.680 -30.617
  395    HA   LYS  53           HA       LYS  53   5.025   7.500 -30.277
  396   1HB   LYS  53          HB2       LYS  53   6.860   8.866 -32.178
  397   2HB   LYS  53          HB3       LYS  53   5.301   8.422 -32.860
  398   1HG   LYS  53          HG2       LYS  53   4.959  10.584 -32.000
  399   2HG   LYS  53          HG3       LYS  53   4.164   9.484 -30.876
  400   1HD   LYS  53          HD2       LYS  53   6.355   9.675 -29.447
  401   2HD   LYS  53          HD3       LYS  53   6.765  11.012 -30.534
  402   1HE   LYS  53          HE2       LYS  53   4.175  11.648 -29.927
  403   2HE   LYS  53          HE3       LYS  53   4.602  10.770 -28.452
  404   1HZ   LYS  53          HZ1       LYS  53   6.143  13.085 -29.519
  405   2HZ   LYS  53          HZ2       LYS  53   4.985  13.212 -28.387
  406   3HZ   LYS  53          HZ3       LYS  53   6.332  12.387 -28.033
  407    H    GLU  54           H        GLU  54   7.209   5.515 -32.251
  408    HA   GLU  54           HA       GLU  54   5.176   4.532 -33.970
  409   1HB   GLU  54          HB2       GLU  54   7.758   4.400 -34.242
  410   2HB   GLU  54          HB3       GLU  54   7.628   2.929 -33.267
  411   1HG   GLU  54          HG2       GLU  54   5.866   2.114 -34.947
  412   2HG   GLU  54          HG3       GLU  54   6.214   3.541 -35.909
  413    H    VAL  55           H        VAL  55   5.808   3.947 -30.617
  414    HA   VAL  55           HA       VAL  55   3.998   1.566 -30.660
  415    HB   VAL  55           HB       VAL  55   5.093   0.916 -28.548
  416   1HG1  VAL  55          HG11      VAL  55   7.157   0.099 -29.624
  417   2HG1  VAL  55          HG12      VAL  55   5.795  -0.001 -30.741
  418   3HG1  VAL  55          HG13      VAL  55   6.992   1.297 -30.913
  419   1HG2  VAL  55          HG21      VAL  55   5.913   3.238 -27.907
  420   2HG2  VAL  55          HG22      VAL  55   7.128   1.977 -27.779
  421   3HG2  VAL  55          HG23      VAL  55   7.164   3.063 -29.164
  422    H    GLY  56           H        GLY  56   3.917   4.840 -30.048
  423   1HA   GLY  56          HA1       GLY  56   1.985   5.962 -29.437
  424   2HA   GLY  56          HA2       GLY  56   1.323   4.489 -28.705
  425    H    ILE  57           H        ILE  57   4.587   5.826 -28.074
  426    HA   ILE  57           HA       ILE  57   3.786   6.574 -25.307
  427    HB   ILE  57           HB       ILE  57   6.248   5.116 -26.337
  428   1HG1  ILE  57          HG12      ILE  57   4.222   4.297 -24.215
  429   2HG1  ILE  57          HG13      ILE  57   4.206   3.725 -25.878
  430   1HG2  ILE  57          HG21      ILE  57   7.068   6.745 -24.738
  431   2HG2  ILE  57          HG22      ILE  57   5.780   6.338 -23.583
  432   3HG2  ILE  57          HG23      ILE  57   7.078   5.190 -23.934
  433   1HD1  ILE  57          HD11      ILE  57   6.376   3.120 -23.841
  434   2HD1  ILE  57          HD12      ILE  57   5.182   2.015 -24.529
  435   3HD1  ILE  57          HD13      ILE  57   6.446   2.687 -25.562
  436    H    ASP  58           H        ASP  58   5.092   8.324 -24.517
  437    HA   ASP  58           HA       ASP  58   6.549   9.927 -26.537
  438   1HB   ASP  58          HB2       ASP  58   4.494  11.187 -26.156
  439   2HB   ASP  58          HB3       ASP  58   4.661  11.002 -24.396
  440    H    ILE  59           H        ILE  59   8.393  10.809 -25.750
  441    HA   ILE  59           HA       ILE  59   9.152  10.345 -22.922
  442    HB   ILE  59           HB       ILE  59  11.479   9.844 -23.763
  443   1HG1  ILE  59          HG12      ILE  59  10.134   9.121 -26.401
  444   2HG1  ILE  59          HG13      ILE  59  11.000  10.630 -26.167
  445   1HG2  ILE  59          HG21      ILE  59   9.304   7.822 -24.495
  446   2HG2  ILE  59          HG22      ILE  59  10.976   7.459 -24.011
  447   3HG2  ILE  59          HG23      ILE  59   9.852   8.166 -22.854
  448   1HD1  ILE  59          HD11      ILE  59  12.224   7.844 -25.853
  449   2HD1  ILE  59          HD12      ILE  59  12.442   8.957 -27.210
  450   3HD1  ILE  59          HD13      ILE  59  13.070   9.381 -25.621
  451    H    SER  60           H        SER  60   8.480  12.616 -25.240
  452    HA   SER  60           HA       SER  60  10.561  14.537 -24.922
  453   1HB   SER  60          HB2       SER  60   7.622  15.183 -25.283
  454   2HB   SER  60          HB3       SER  60   9.033  16.086 -25.861
  455    HG   SER  60           HG       SER  60   7.894  13.667 -26.758
  456    H    ASN  61           H        ASN  61   7.765  13.654 -22.981
  457    HA   ASN  61           HA       ASN  61   7.856  15.695 -21.022
  458   1HB   ASN  61          HB2       ASN  61   6.434  14.230 -19.714
  459   2HB   ASN  61          HB3       ASN  61   5.944  14.162 -21.398
  460   1HD2  ASN  61          HD22      ASN  61   6.429  12.216 -22.642
  461   2HD2  ASN  61          HD21      ASN  61   6.809  10.703 -21.848
  462    H    GLN  62           H        GLN  62  10.533  13.862 -21.568
  463    HA   GLN  62           HA       GLN  62  11.193  13.497 -18.677
  464   1HB   GLN  62          HB2       GLN  62  12.078  11.828 -21.026
  465   2HB   GLN  62          HB3       GLN  62  12.317  11.433 -19.325
  466   1HG   GLN  62          HG2       GLN  62   9.895  11.005 -19.103
  467   2HG   GLN  62          HG3       GLN  62   9.679  11.399 -20.819
  468   1HE2  GLN  62          HE22      GLN  62  12.487  10.065 -21.356
  469   2HE2  GLN  62          HE21      GLN  62  12.040   8.374 -21.488
  470    H    THR  63           H        THR  63  11.898  15.794 -20.398
  471    HA   THR  63           HA       THR  63  14.117  15.643 -21.848
  472    HB   THR  63           HB       THR  63  14.525  18.098 -21.211
  473    HG1  THR  63           HG1      THR  63  13.796  17.923 -19.024
  474   1HG2  THR  63          HG21      THR  63  12.811  17.336 -22.925
  475   2HG2  THR  63          HG22      THR  63  11.592  17.378 -21.631
  476   3HG2  THR  63          HG23      THR  63  12.415  18.871 -22.130
  477    H    SER  64           H        SER  64  16.247  15.307 -21.753
  478    HA   SER  64           HA       SER  64  17.291  13.866 -19.781
  479   1HB   SER  64          HB2       SER  64  18.866  15.555 -21.750
  480   2HB   SER  64          HB3       SER  64  19.308  13.973 -21.090
  481    HG   SER  64           HG       SER  64  18.424  13.296 -22.848
  482    H    ASP  65           H        ASP  65  19.101  14.000 -18.452
  483    HA   ASP  65           HA       ASP  65  20.321  16.543 -17.757
  484   1HB   ASP  65          HB2       ASP  65  18.250  16.495 -16.309
  485   2HB   ASP  65          HB3       ASP  65  18.831  14.987 -15.597
  486    H    ILE  66           H        ILE  66  22.187  16.164 -16.312
  487    HA   ILE  66           HA       ILE  66  23.516  13.591 -16.788
  488    HB   ILE  66           HB       ILE  66  25.215  14.830 -15.147
  489   1HG1  ILE  66          HG12      ILE  66  23.636  16.876 -14.908
  490   2HG1  ILE  66          HG13      ILE  66  25.358  17.100 -15.139
  491   1HG2  ILE  66          HG21      ILE  66  25.736  14.013 -17.317
  492   2HG2  ILE  66          HG22      ILE  66  24.890  15.368 -18.097
  493   3HG2  ILE  66          HG23      ILE  66  26.378  15.650 -17.153
  494   1HD1  ILE  66          HD11      ILE  66  23.341  17.379 -17.412
  495   2HD1  ILE  66          HD12      ILE  66  24.034  18.709 -16.467
  496   3HD1  ILE  66          HD13      ILE  66  25.078  17.707 -17.487
  497    H    ILE  67           H        ILE  67  24.505  12.496 -14.913
  498    HA   ILE  67           HA       ILE  67  22.527  11.477 -13.219
  499    HB   ILE  67           HB       ILE  67  25.555  11.310 -13.199
  500   1HG1  ILE  67          HG12      ILE  67  23.467   9.180 -13.871
  501   2HG1  ILE  67          HG13      ILE  67  24.088  10.293 -15.077
  502   1HG2  ILE  67          HG21      ILE  67  25.342   9.363 -11.672
  503   2HG2  ILE  67          HG22      ILE  67  24.843  10.852 -10.885
  504   3HG2  ILE  67          HG23      ILE  67  23.609   9.716 -11.474
  505   1HD1  ILE  67          HD11      ILE  67  25.720   8.232 -13.567
  506   2HD1  ILE  67          HD12      ILE  67  25.304   8.274 -15.288
  507   3HD1  ILE  67          HD13      ILE  67  26.411   9.489 -14.627
  508    H    ASP  68           H        ASP  68  22.054  11.708 -11.085
  509    HA   ASP  68           HA       ASP  68  23.391  13.845  -9.512
  510   1HB   ASP  68          HB2       ASP  68  21.297  14.752 -10.538
  511   2HB   ASP  68          HB3       ASP  68  20.379  13.497  -9.695
  512    H    SER  69           H        SER  69  23.824  13.271  -7.489
  513    HA   SER  69           HA       SER  69  23.845  10.668  -6.628
  514   1HB   SER  69          HB2       SER  69  23.874  13.138  -4.869
  515   2HB   SER  69          HB3       SER  69  24.680  11.589  -4.567
  516    HG   SER  69           HG       SER  69  26.114  13.185  -5.395
  517    H    ASP  70           H        ASP  70  21.155  12.926  -6.300
  518    HA   ASP  70           HA       ASP  70  20.145  11.517  -3.970
  519   1HB   ASP  70          HB2       ASP  70  19.967  14.014  -4.268
  520   2HB   ASP  70          HB3       ASP  70  18.837  13.736  -5.600
  521    H    ILE  71           H        ILE  71  20.104  10.783  -7.203
  522    HA   ILE  71           HA       ILE  71  17.606   9.185  -6.929
  523    HB   ILE  71           HB       ILE  71  19.071   9.982  -9.454
  524   1HG1  ILE  71          HG12      ILE  71  16.285  10.984  -8.771
  525   2HG1  ILE  71          HG13      ILE  71  17.682  11.866  -8.164
  526   1HG2  ILE  71          HG21      ILE  71  16.379   8.594  -9.019
  527   2HG2  ILE  71          HG22      ILE  71  17.099   8.997 -10.591
  528   3HG2  ILE  71          HG23      ILE  71  17.882   7.813  -9.540
  529   1HD1  ILE  71          HD11      ILE  71  18.604  12.114 -10.393
  530   2HD1  ILE  71          HD12      ILE  71  17.200  11.266 -11.096
  531   3HD1  ILE  71          HD13      ILE  71  16.981  12.825 -10.269
  532    H    LEU  72           H        LEU  72  21.068   9.247  -7.943
  533    HA   LEU  72           HA       LEU  72  21.604   6.547  -8.314
  534   1HB   LEU  72          HB2       LEU  72  23.229   8.616  -6.775
  535   2HB   LEU  72          HB3       LEU  72  23.811   7.000  -7.064
  536    HG   LEU  72           HG       LEU  72  23.210   9.026  -9.217
  537   1HD1  LEU  72          HD11      LEU  72  25.171   9.628  -7.914
  538   2HD1  LEU  72          HD12      LEU  72  25.800   7.977  -7.980
  539   3HD1  LEU  72          HD13      LEU  72  25.736   8.961  -9.445
  540   1HD2  LEU  72          HD21      LEU  72  24.425   7.341 -10.683
  541   2HD2  LEU  72          HD22      LEU  72  24.332   6.180  -9.348
  542   3HD2  LEU  72          HD23      LEU  72  22.854   6.775 -10.121
  543    H    ASN  73           H        ASN  73  21.812   8.177  -5.154
  544    HA   ASN  73           HA       ASN  73  22.122   5.656  -3.769
  545   1HB   ASN  73          HB2       ASN  73  21.717   8.467  -2.642
  546   2HB   ASN  73          HB3       ASN  73  22.217   7.065  -1.711
  547   1HD2  ASN  73          HD22      ASN  73  23.280   9.586  -3.819
  548   2HD2  ASN  73          HD21      ASN  73  24.995   9.169  -3.766
  549    H    ASN  74           H        ASN  74  19.368   6.812  -5.027
  550    HA   ASN  74           HA       ASN  74  17.613   6.277  -2.650
  551   1HB   ASN  74          HB2       ASN  74  17.904   8.652  -3.314
  552   2HB   ASN  74          HB3       ASN  74  17.429   8.229  -4.955
  553   1HD2  ASN  74          HD22      ASN  74  15.958  10.002  -4.632
  554   2HD2  ASN  74          HD21      ASN  74  14.382   9.690  -3.915
  555    H    ALA  75           H        ALA  75  18.201   5.758  -6.089
  556    HA   ALA  75           HA       ALA  75  15.770   4.548  -6.860
  557   1HB   ALA  75          HB1       ALA  75  17.474   5.385  -8.408
  558   2HB   ALA  75          HB2       ALA  75  18.562   4.077  -7.894
  559   3HB   ALA  75          HB3       ALA  75  17.019   3.707  -8.716
  560    H    ASP  76           H        ASP  76  14.982   2.541  -6.576
  561    HA   ASP  76           HA       ASP  76  16.063   0.741  -4.594
  562   1HB   ASP  76          HB2       ASP  76  13.638   0.850  -5.165
  563   2HB   ASP  76          HB3       ASP  76  13.997   0.244  -6.783
  564    H    LEU  77           H        LEU  77  16.268   1.206  -8.079
  565    HA   LEU  77           HA       LEU  77  18.475  -0.754  -8.284
  566   1HB   LEU  77          HB2       LEU  77  16.466  -2.051  -8.888
  567   2HB   LEU  77          HB3       LEU  77  15.920  -0.756  -9.955
  568    HG   LEU  77           HG       LEU  77  17.897  -1.142 -11.434
  569   1HD1  LEU  77          HD11      LEU  77  19.438  -2.184  -9.751
  570   2HD1  LEU  77          HD12      LEU  77  18.387  -3.620  -9.724
  571   3HD1  LEU  77          HD13      LEU  77  19.246  -3.151 -11.203
  572   1HD2  LEU  77          HD21      LEU  77  16.161  -3.578 -10.922
  573   2HD2  LEU  77          HD22      LEU  77  15.755  -2.178 -11.942
  574   3HD2  LEU  77          HD23      LEU  77  17.081  -3.245 -12.407
  575    H    VAL  78           H        VAL  78  20.043  -0.028  -9.635
  576    HA   VAL  78           HA       VAL  78  19.405   2.216 -11.497
  577    HB   VAL  78           HB       VAL  78  22.069   1.486 -10.201
  578   1HG1  VAL  78          HG11      VAL  78  21.269   3.797 -12.026
  579   2HG1  VAL  78          HG12      VAL  78  22.814   3.672 -11.164
  580   3HG1  VAL  78          HG13      VAL  78  22.413   2.489 -12.413
  581   1HG2  VAL  78          HG21      VAL  78  21.811   3.693  -9.028
  582   2HG2  VAL  78          HG22      VAL  78  20.163   3.817  -9.671
  583   3HG2  VAL  78          HG23      VAL  78  20.592   2.520  -8.543
  584    H    VAL  79           H        VAL  79  20.100   1.871 -13.691
  585    HA   VAL  79           HA       VAL  79  21.108  -0.861 -14.333
  586    HB   VAL  79           HB       VAL  79  18.930   0.591 -15.859
  587   1HG1  VAL  79          HG11      VAL  79  20.271  -1.156 -17.068
  588   2HG1  VAL  79          HG12      VAL  79  19.751  -2.343 -15.869
  589   3HG1  VAL  79          HG13      VAL  79  18.559  -1.572 -16.930
  590   1HG2  VAL  79          HG21      VAL  79  18.501  -1.538 -13.739
  591   2HG2  VAL  79          HG22      VAL  79  17.873   0.124 -13.736
  592   3HG2  VAL  79          HG23      VAL  79  17.284  -1.035 -14.926
  593    H    THR  80           H        THR  80  23.003  -0.570 -15.455
  594    HA   THR  80           HA       THR  80  23.359   1.972 -16.978
  595    HB   THR  80           HB       THR  80  25.718   0.906 -17.301
  596    HG1  THR  80           HG1      THR  80  25.050  -1.111 -16.241
  597   1HG2  THR  80          HG21      THR  80  25.234   2.944 -16.053
  598   2HG2  THR  80          HG22      THR  80  24.801   1.991 -14.611
  599   3HG2  THR  80          HG23      THR  80  26.471   1.992 -15.231
  600    H    LEU  81           H        LEU  81  23.242   2.006 -19.115
  601    HA   LEU  81           HA       LEU  81  22.600  -0.551 -20.519
  602   1HB   LEU  81          HB2       LEU  81  21.862   2.325 -21.070
  603   2HB   LEU  81          HB3       LEU  81  21.579   1.030 -22.217
  604    HG   LEU  81           HG       LEU  81  20.002  -0.062 -20.721
  605   1HD1  LEU  81          HD11      LEU  81  19.119   1.162 -18.732
  606   2HD1  LEU  81          HD12      LEU  81  20.737   0.545 -18.498
  607   3HD1  LEU  81          HD13      LEU  81  20.499   2.279 -18.831
  608   1HD2  LEU  81          HD21      LEU  81  18.209   1.710 -20.760
  609   2HD2  LEU  81          HD22      LEU  81  19.453   2.905 -21.162
  610   3HD2  LEU  81          HD23      LEU  81  19.079   1.574 -22.278
  611    H    CYS  82           H        CYS  82  25.360   0.415 -19.899
  612    HA   CYS  82           HA       CYS  82  26.499   1.505 -22.293
  613   1HB   CYS  82          HB2       CYS  82  28.658   0.975 -21.161
  614   2HB   CYS  82          HB3       CYS  82  27.590   2.091 -20.321
  615    H    GLY  83           H        GLY  83  26.252   0.233 -24.118
  616   1HA   GLY  83          HA1       GLY  83  28.104  -2.019 -24.278
  617   2HA   GLY  83          HA2       GLY  83  26.427  -2.367 -24.718
  618    H    ASP  84           H        ASP  84  27.559   0.873 -25.160
  619    HA   ASP  84           HA       ASP  84  27.236   0.979 -28.033
  620   1HB   ASP  84          HB2       ASP  84  26.462   2.753 -26.522
  621   2HB   ASP  84          HB3       ASP  84  28.105   2.961 -25.893
  622    H    ALA  85           H        ALA  85  29.028   2.229 -29.249
  623    HA   ALA  85           HA       ALA  85  31.514   0.817 -29.248
  624   1HB   ALA  85          HB1       ALA  85  30.827   3.586 -30.325
  625   2HB   ALA  85          HB2       ALA  85  32.258   2.628 -30.753
  626   3HB   ALA  85          HB3       ALA  85  30.643   2.050 -31.208
  627    H    ALA  86           H        ALA  86  30.421   3.750 -27.530
  628    HA   ALA  86           HA       ALA  86  33.049   4.536 -26.646
  629   1HB   ALA  86          HB1       ALA  86  31.155   6.104 -26.854
  630   2HB   ALA  86          HB2       ALA  86  30.295   5.260 -25.551
  631   3HB   ALA  86          HB3       ALA  86  31.820   6.108 -25.211
  632    H    ASP  87           H        ASP  87  30.379   2.796 -25.081
  633    HA   ASP  87           HA       ASP  87  30.170   1.654 -23.116
  634   1HB   ASP  87          HB2       ASP  87  30.896   0.027 -24.666
  635   2HB   ASP  87          HB3       ASP  87  32.607   0.385 -24.375
  636    H    LYS  88           H        LYS  88  31.226   4.101 -22.422
  637    HA   LYS  88           HA       LYS  88  33.526   3.813 -20.745
  638   1HB   LYS  88          HB2       LYS  88  31.445   6.031 -20.710
  639   2HB   LYS  88          HB3       LYS  88  33.042   6.076 -19.968
  640   1HG   LYS  88          HG2       LYS  88  34.114   5.827 -22.193
  641   2HG   LYS  88          HG3       LYS  88  32.526   5.747 -22.958
  642   1HD   LYS  88          HD2       LYS  88  33.382   7.931 -23.295
  643   2HD   LYS  88          HD3       LYS  88  32.015   8.044 -22.178
  644   1HE   LYS  88          HE2       LYS  88  33.563   8.241 -20.261
  645   2HE   LYS  88          HE3       LYS  88  34.951   7.967 -21.320
  646   1HZ   LYS  88          HZ1       LYS  88  34.452  10.052 -22.434
  647   2HZ   LYS  88          HZ2       LYS  88  33.150  10.318 -21.482
  648   3HZ   LYS  88          HZ3       LYS  88  34.649  10.311 -20.841
  649    H    CYS  89           H        CYS  89  30.194   3.122 -20.203
  650    HA   CYS  89           HA       CYS  89  28.863   2.676 -18.479
  651   1HB   CYS  89          HB2       CYS  89  31.347   1.367 -17.419
  652   2HB   CYS  89          HB3       CYS  89  29.750   1.200 -16.707
  653    HA   PRO  90           HA       PRO  90  29.452   6.462 -15.985
  654   1HB   PRO  90          HB2       PRO  90  26.610   5.712 -15.441
  655   2HB   PRO  90          HB3       PRO  90  27.325   7.321 -15.785
  656   1HG   PRO  90          HG2       PRO  90  25.948   5.952 -17.693
  657   2HG   PRO  90          HG3       PRO  90  27.426   6.880 -18.103
  658   1HD   PRO  90          HD2       PRO  90  27.108   3.924 -17.716
  659   2HD   PRO  90          HD3       PRO  90  28.099   4.823 -18.909
  660    H    MET  91           H        MET  91  29.887   6.630 -13.778
  661    HA   MET  91           HA       MET  91  30.098   4.201 -12.269
  662   1HB   MET  91          HB2       MET  91  30.604   7.125 -11.561
  663   2HB   MET  91          HB3       MET  91  30.933   5.782 -10.473
  664   1HG   MET  91          HG2       MET  91  32.207   6.226 -13.197
  665   2HG   MET  91          HG3       MET  91  32.964   6.516 -11.638
  666   1HE   MET  91          HE1       MET  91  33.790   4.665  -9.979
  667   2HE   MET  91          HE2       MET  91  32.183   3.905  -9.885
  668   3HE   MET  91          HE3       MET  91  33.612   2.918 -10.245
  669    H    THR  92           H        THR  92  29.002   3.595 -10.462
  670    HA   THR  92           HA       THR  92  26.628   5.097  -9.533
  671    HB   THR  92           HB       THR  92  25.729   2.756  -9.181
  672    HG1  THR  92           HG1      THR  92  27.598   1.554  -9.184
  673   1HG2  THR  92          HG21      THR  92  25.237   4.137 -11.267
  674   2HG2  THR  92          HG22      THR  92  26.526   3.228 -12.082
  675   3HG2  THR  92          HG23      THR  92  25.082   2.385 -11.479
  676    HA   PRO  93           HA       PRO  93  28.529   4.501  -5.516
  677   1HB   PRO  93          HB2       PRO  93  26.427   4.462  -3.780
  678   2HB   PRO  93          HB3       PRO  93  26.869   5.928  -4.704
  679   1HG   PRO  93          HG2       PRO  93  24.729   3.883  -5.347
  680   2HG   PRO  93          HG3       PRO  93  24.581   5.663  -5.330
  681   1HD   PRO  93          HD2       PRO  93  25.050   4.247  -7.642
  682   2HD   PRO  93          HD3       PRO  93  25.738   5.874  -7.378
  683    HA   PRO  94           HA       PRO  94  28.169   0.063  -4.585
  684   1HB   PRO  94          HB2       PRO  94  29.248  -0.117  -2.104
  685   2HB   PRO  94          HB3       PRO  94  30.236   0.317  -3.533
  686   1HG   PRO  94          HG2       PRO  94  29.022   2.169  -1.471
  687   2HG   PRO  94          HG3       PRO  94  30.690   2.180  -2.125
  688   1HD   PRO  94          HD2       PRO  94  28.622   3.788  -3.060
  689   2HD   PRO  94          HD3       PRO  94  30.001   3.264  -4.086
  690    H    HIS  95           H        HIS  95  26.622   2.609  -2.798
  691    HA   HIS  95           HA       HIS  95  25.184   1.152  -0.856
  692   1HB   HIS  95          HB2       HIS  95  24.332   3.750  -2.192
  693   2HB   HIS  95          HB3       HIS  95  23.930   3.197  -0.571
  694    HD1  HIS  95           HD1      HIS  95  25.710   5.898  -1.706
  695    HD2  HIS  95           HD2      HIS  95  26.847   2.538   0.579
  696    HE1  HIS  95           HE1      HIS  95  27.826   6.562  -0.447
  697    H    VAL  96           H        VAL  96  24.708   1.138  -4.287
  698    HA   VAL  96           HA       VAL  96  21.815   0.525  -3.905
  699    HB   VAL  96           HB       VAL  96  22.443   2.781  -4.904
  700   1HG1  VAL  96          HG11      VAL  96  24.197   1.895  -6.508
  701   2HG1  VAL  96          HG12      VAL  96  22.871   1.233  -7.479
  702   3HG1  VAL  96          HG13      VAL  96  22.984   2.984  -7.192
  703   1HG2  VAL  96          HG21      VAL  96  20.523   2.805  -6.291
  704   2HG2  VAL  96          HG22      VAL  96  20.577   1.047  -6.545
  705   3HG2  VAL  96          HG23      VAL  96  20.212   1.719  -4.939
  706    H    LYS  97           H        LYS  97  20.810  -0.977  -5.207
  707    HA   LYS  97           HA       LYS  97  22.354  -3.217  -6.191
  708   1HB   LYS  97          HB2       LYS  97  20.084  -3.360  -5.125
  709   2HB   LYS  97          HB3       LYS  97  19.410  -2.442  -6.484
  710   1HG   LYS  97          HG2       LYS  97  19.926  -4.251  -8.032
  711   2HG   LYS  97          HG3       LYS  97  20.850  -5.098  -6.790
  712   1HD   LYS  97          HD2       LYS  97  18.758  -6.193  -7.052
  713   2HD   LYS  97          HD3       LYS  97  18.797  -5.451  -5.460
  714   1HE   LYS  97          HE2       LYS  97  17.417  -4.094  -7.820
  715   2HE   LYS  97          HE3       LYS  97  16.630  -5.386  -6.920
  716   1HZ   LYS  97          HZ1       LYS  97  15.955  -3.302  -6.010
  717   2HZ   LYS  97          HZ2       LYS  97  16.894  -4.045  -4.892
  718   3HZ   LYS  97          HZ3       LYS  97  17.457  -2.777  -5.797
  719    H    ARG  98           H        ARG  98  22.755  -3.659  -8.383
  720    HA   ARG  98           HA       ARG  98  22.001  -1.582 -10.345
  721   1HB   ARG  98          HB2       ARG  98  24.207  -0.995  -9.488
  722   2HB   ARG  98          HB3       ARG  98  24.821  -2.605  -9.895
  723   1HG   ARG  98          HG2       ARG  98  24.541  -2.177 -12.276
  724   2HG   ARG  98          HG3       ARG  98  23.714  -0.630 -11.953
  725   1HD   ARG  98          HD2       ARG  98  25.713   0.317 -11.034
  726   2HD   ARG  98          HD3       ARG  98  26.554  -1.242 -11.063
  727    HE   ARG  98           HE       ARG  98  25.686  -0.566 -13.711
  728   1HH1  ARG  98          HH21      ARG  98  28.023   0.742 -11.406
  729   2HH1  ARG  98          HH22      ARG  98  29.359   0.703 -12.510
  730   1HH2  ARG  98          HH11      ARG  98  27.313  -0.414 -15.204
  731   2HH2  ARG  98          HH12      ARG  98  28.941   0.048 -14.775
  732    H    GLU  99           H        GLU  99  21.899  -2.252 -12.472
  733    HA   GLU  99           HA       GLU  99  22.296  -5.122 -13.160
  734   1HB   GLU  99          HB2       GLU  99  19.948  -3.261 -13.568
  735   2HB   GLU  99          HB3       GLU  99  20.328  -4.387 -14.856
  736   1HG   GLU  99          HG2       GLU  99  19.973  -5.370 -12.010
  737   2HG   GLU  99          HG3       GLU  99  18.595  -5.076 -13.068
  738    H    HIS 100           H        HIS 100  22.729  -5.363 -15.501
  739    HA   HIS 100           HA       HIS 100  23.893  -2.967 -16.821
  740   1HB   HIS 100          HB2       HIS 100  25.749  -4.112 -15.780
  741   2HB   HIS 100          HB3       HIS 100  25.180  -5.680 -16.355
  742    HD1  HIS 100           HD1      HIS 100  26.886  -2.495 -17.730
  743    HD2  HIS 100           HD2      HIS 100  25.786  -6.409 -18.830
  744    HE1  HIS 100           HE1      HIS 100  28.011  -2.955 -19.962
  745    H    TRP 101           H        TRP 101  22.754  -2.717 -18.597
  746    HA   TRP 101           HA       TRP 101  21.685  -5.051 -20.137
  747   1HB   TRP 101          HB2       TRP 101  20.358  -2.397 -19.434
  748   2HB   TRP 101          HB3       TRP 101  19.791  -3.465 -20.699
  749    HD1  TRP 101           HD1      TRP 101  20.685  -5.061 -17.325
  750    HE1  TRP 101           HE1      TRP 101  18.602  -5.922 -16.213
  751    HE3  TRP 101           HE3      TRP 101  17.251  -3.093 -20.575
  752    HZ2  TRP 101           HZ2      TRP 101  15.714  -5.708 -16.624
  753    HZ3  TRP 101           HZ3      TRP 101  14.827  -3.484 -20.209
  754    HH2  TRP 101           HH2      TRP 101  14.055  -4.763 -18.222
  755    H    GLY 102           H        GLY 102  24.191  -4.281 -20.843
  756   1HA   GLY 102          HA1       GLY 102  24.383  -1.900 -22.388
  757   2HA   GLY 102          HA2       GLY 102  25.505  -3.265 -22.382
  758    H    PHE 103           H        PHE 103  23.943  -1.480 -24.472
  759    HA   PHE 103           HA       PHE 103  24.188  -3.470 -26.527
  760   1HB   PHE 103          HB2       PHE 103  21.847  -2.566 -27.484
  761   2HB   PHE 103          HB3       PHE 103  22.013  -4.035 -26.553
  762    HD1  PHE 103           HD1      PHE 103  21.622  -0.366 -25.701
  763    HD2  PHE 103           HD2      PHE 103  20.267  -4.415 -25.074
  764    HE1  PHE 103           HE1      PHE 103  20.049   0.414 -23.958
  765    HE2  PHE 103           HE2      PHE 103  18.660  -3.611 -23.365
  766    HZ   PHE 103           HZ       PHE 103  18.584  -1.195 -22.770
  767    H    ASP 104           H        ASP 104  24.211  -2.416 -28.607
  768    HA   ASP 104           HA       ASP 104  25.805  -0.151 -28.722
  769   1HB   ASP 104          HB2       ASP 104  25.732  -1.927 -30.412
  770   2HB   ASP 104          HB3       ASP 104  24.090  -1.452 -30.860
  771    H    ASP 105           H        ASP 105  25.379   2.054 -28.982
  772    HA   ASP 105           HA       ASP 105  22.700   2.954 -28.394
  773   1HB   ASP 105          HB2       ASP 105  24.785   4.230 -27.773
  774   2HB   ASP 105          HB3       ASP 105  24.941   4.700 -29.471
  775    HA   PRO 106           HA       PRO 106  21.467   2.506 -32.615
  776   1HB   PRO 106          HB2       PRO 106  19.042   3.806 -32.642
  777   2HB   PRO 106          HB3       PRO 106  19.320   2.188 -31.929
  778   1HG   PRO 106          HG2       PRO 106  19.238   4.850 -30.489
  779   2HG   PRO 106          HG3       PRO 106  18.434   3.317 -30.029
  780   1HD   PRO 106          HD2       PRO 106  20.805   4.096 -28.940
  781   2HD   PRO 106          HD3       PRO 106  20.490   2.376 -29.305
  782    H    ALA 107           H        ALA 107  21.885   5.727 -31.207
  783    HA   ALA 107           HA       ALA 107  21.721   7.066 -33.783
  784   1HB   ALA 107          HB1       ALA 107  21.084   8.209 -31.680
  785   2HB   ALA 107          HB2       ALA 107  22.770   8.092 -31.118
  786   3HB   ALA 107          HB3       ALA 107  22.376   9.060 -32.549
  787    H    ARG 108           H        ARG 108  24.003   4.956 -32.495
  788    HA   ARG 108           HA       ARG 108  26.253   6.273 -33.924
  789   1HB   ARG 108          HB2       ARG 108  26.357   6.394 -31.407
  790   2HB   ARG 108          HB3       ARG 108  26.418   4.632 -31.363
  791   1HG   ARG 108          HG2       ARG 108  28.570   4.576 -32.400
  792   2HG   ARG 108          HG3       ARG 108  28.466   6.265 -32.922
  793   1HD   ARG 108          HD2       ARG 108  28.537   5.379 -30.016
  794   2HD   ARG 108          HD3       ARG 108  29.979   5.814 -30.932
  795    HE   ARG 108           HE       ARG 108  28.710   8.035 -31.340
  796   1HH1  ARG 108          HH21      ARG 108  28.644   6.219 -28.241
  797   2HH1  ARG 108          HH22      ARG 108  28.426   7.650 -27.299
  798   1HH2  ARG 108          HH11      ARG 108  28.390   9.883 -30.048
  799   2HH2  ARG 108          HH12      ARG 108  28.269   9.757 -28.337
  800    H    ALA 109           H        ALA 109  24.006   3.936 -34.192
  801    HA   ALA 109           HA       ALA 109  25.423   1.611 -34.960
  802   1HB   ALA 109          HB1       ALA 109  22.991   1.608 -34.633
  803   2HB   ALA 109          HB2       ALA 109  22.778   2.753 -35.978
  804   3HB   ALA 109          HB3       ALA 109  23.404   1.131 -36.293
  805    H    GLN 110           H        GLN 110  27.209   2.044 -36.128
  806    HA   GLN 110           HA       GLN 110  27.587   3.908 -38.166
  807   1HB   GLN 110          HB2       GLN 110  28.875   1.148 -37.951
  808   2HB   GLN 110          HB3       GLN 110  29.489   2.504 -38.895
  809   1HG   GLN 110          HG2       GLN 110  29.246   2.393 -35.853
  810   2HG   GLN 110          HG3       GLN 110  30.721   2.239 -36.788
  811   1HE2  GLN 110          HE22      GLN 110  28.588   4.474 -35.251
  812   2HE2  GLN 110          HE21      GLN 110  29.365   5.944 -35.820
  813    H    GLY 111           H        GLY 111  26.720   4.142 -40.130
  814   1HA   GLY 111          HA1       GLY 111  26.339   2.296 -42.163
  815   2HA   GLY 111          HA2       GLY 111  24.850   2.234 -41.207
  816    H    THR 112           H        THR 112  23.353   3.862 -41.442
  817    HA   THR 112           HA       THR 112  23.982   6.352 -42.829
  818    HB   THR 112           HB       THR 112  22.319   6.031 -44.507
  819    HG1  THR 112           HG1      THR 112  20.967   4.193 -44.511
  820   1HG2  THR 112          HG21      THR 112  24.380   4.611 -44.980
  821   2HG2  THR 112          HG22      THR 112  23.465   3.218 -44.322
  822   3HG2  THR 112          HG23      THR 112  22.892   4.062 -45.772
  823    H    GLU 113           H        GLU 113  21.801   7.745 -42.725
  824    HA   GLU 113           HA       GLU 113  20.896   7.745 -39.980
  825   1HB   GLU 113          HB2       GLU 113  19.270   9.411 -40.702
  826   2HB   GLU 113          HB3       GLU 113  20.922   9.842 -41.114
  827   1HG   GLU 113          HG2       GLU 113  19.093   8.553 -43.178
  828   2HG   GLU 113          HG3       GLU 113  18.977  10.262 -42.806
  829    H    GLU 114           H        GLU 114  19.822   6.101 -42.908
  830    HA   GLU 114           HA       GLU 114  17.216   5.441 -41.851
  831   1HB   GLU 114          HB2       GLU 114  17.689   5.639 -44.284
  832   2HB   GLU 114          HB3       GLU 114  18.736   4.215 -44.185
  833   1HG   GLU 114          HG2       GLU 114  16.819   2.834 -43.464
  834   2HG   GLU 114          HG3       GLU 114  15.775   4.258 -43.454
  835    H    GLU 115           H        GLU 115  20.412   3.857 -42.111
  836    HA   GLU 115           HA       GLU 115  19.626   1.400 -40.937
  837   1HB   GLU 115          HB2       GLU 115  21.766   1.860 -42.209
  838   2HB   GLU 115          HB3       GLU 115  22.365   2.677 -40.761
  839   1HG   GLU 115          HG2       GLU 115  23.218   0.407 -40.852
  840   2HG   GLU 115          HG3       GLU 115  22.161   0.600 -39.467
  841    H    LYS 116           H        LYS 116  20.910   4.439 -39.512
  842    HA   LYS 116           HA       LYS 116  20.872   3.624 -36.792
  843   1HB   LYS 116          HB2       LYS 116  20.610   6.326 -38.161
  844   2HB   LYS 116          HB3       LYS 116  20.588   6.146 -36.394
  845   1HG   LYS 116          HG2       LYS 116  22.787   5.042 -36.456
  846   2HG   LYS 116          HG3       LYS 116  22.836   5.184 -38.217
  847   1HD   LYS 116          HD2       LYS 116  22.745   7.679 -37.986
  848   2HD   LYS 116          HD3       LYS 116  22.711   7.486 -36.220
  849   1HE   LYS 116          HE2       LYS 116  24.901   6.134 -36.500
  850   2HE   LYS 116          HE3       LYS 116  24.948   6.750 -38.156
  851   1HZ   LYS 116          HZ1       LYS 116  26.226   8.173 -36.694
  852   2HZ   LYS 116          HZ2       LYS 116  24.922   9.018 -37.183
  853   3HZ   LYS 116          HZ3       LYS 116  24.964   8.371 -35.669
  854    H    TRP 117           H        TRP 117  18.268   5.226 -38.755
  855    HA   TRP 117           HA       TRP 117  16.354   5.205 -36.677
  856   1HB   TRP 117          HB2       TRP 117  15.992   6.525 -38.625
  857   2HB   TRP 117          HB3       TRP 117  16.146   5.137 -39.693
  858    HD1  TRP 117           HD1      TRP 117  13.984   4.435 -40.689
  859    HE1  TRP 117           HE1      TRP 117  11.548   4.251 -39.992
  860    HE3  TRP 117           HE3      TRP 117  14.369   6.291 -35.919
  861    HZ2  TRP 117           HZ2      TRP 117   9.921   4.906 -37.673
  862    HZ3  TRP 117           HZ3      TRP 117  12.379   6.368 -34.460
  863    HH2  TRP 117           HH2      TRP 117  10.157   5.669 -35.318
  864    H    ALA 118           H        ALA 118  17.282   2.561 -38.947
  865    HA   ALA 118           HA       ALA 118  15.140   0.859 -38.095
  866   1HB   ALA 118          HB1       ALA 118  17.792   0.131 -39.394
  867   2HB   ALA 118          HB2       ALA 118  16.356  -0.911 -39.250
  868   3HB   ALA 118          HB3       ALA 118  16.281   0.559 -40.241
  869    H    PHE 119           H        PHE 119  18.535   1.266 -37.041
  870    HA   PHE 119           HA       PHE 119  18.372  -0.741 -35.018
  871   1HB   PHE 119          HB2       PHE 119  20.293   1.479 -35.610
  872   2HB   PHE 119          HB3       PHE 119  20.295   0.791 -33.994
  873    HD1  PHE 119           HD1      PHE 119  20.490  -1.737 -33.676
  874    HD2  PHE 119           HD2      PHE 119  21.384   0.249 -37.395
  875    HE1  PHE 119           HE1      PHE 119  21.766  -3.725 -34.435
  876    HE2  PHE 119           HE2      PHE 119  22.688  -1.728 -38.140
  877    HZ   PHE 119           HZ       PHE 119  22.872  -3.725 -36.664
  878    H    PHE 120           H        PHE 120  17.390   2.674 -34.998
  879    HA   PHE 120           HA       PHE 120  16.867   2.810 -32.202
  880   1HB   PHE 120          HB2       PHE 120  15.929   4.299 -34.622
  881   2HB   PHE 120          HB3       PHE 120  14.824   4.303 -33.268
  882    HD1  PHE 120           HD1      PHE 120  15.616   5.054 -30.991
  883    HD2  PHE 120           HD2      PHE 120  17.895   5.728 -34.588
  884    HE1  PHE 120           HE1      PHE 120  16.921   6.811 -29.841
  885    HE2  PHE 120           HE2      PHE 120  19.169   7.519 -33.442
  886    HZ   PHE 120           HZ       PHE 120  18.672   8.081 -31.075
  887    H    GLN 121           H        GLN 121  14.671   1.718 -34.855
  888    HA   GLN 121           HA       GLN 121  12.639   0.734 -33.144
  889   1HB   GLN 121          HB2       GLN 121  13.546   0.208 -35.958
  890   2HB   GLN 121          HB3       GLN 121  12.635  -1.098 -35.205
  891   1HG   GLN 121          HG2       GLN 121  11.290   0.571 -36.539
  892   2HG   GLN 121          HG3       GLN 121  10.723   0.196 -34.919
  893   1HE2  GLN 121          HE22      GLN 121  13.049   2.570 -36.453
  894   2HE2  GLN 121          HE21      GLN 121  12.342   3.951 -35.668
  895    H    ARG 122           H        ARG 122  15.583  -1.032 -34.295
  896    HA   ARG 122           HA       ARG 122  14.874  -3.462 -33.020
  897   1HB   ARG 122          HB2       ARG 122  17.643  -2.328 -33.613
  898   2HB   ARG 122          HB3       ARG 122  17.345  -3.990 -33.112
  899   1HG   ARG 122          HG2       ARG 122  16.124  -4.507 -35.117
  900   2HG   ARG 122          HG3       ARG 122  16.045  -2.817 -35.600
  901   1HD   ARG 122          HD2       ARG 122  18.583  -2.822 -35.724
  902   2HD   ARG 122          HD3       ARG 122  18.520  -4.576 -35.528
  903    HE   ARG 122           HE       ARG 122  16.995  -4.544 -37.569
  904   1HH1  ARG 122          HH11      ARG 122  19.685  -2.206 -37.213
  905   2HH1  ARG 122          HH12      ARG 122  19.712  -1.817 -38.906
  906   1HH2  ARG 122          HH21      ARG 122  17.154  -4.042 -39.822
  907   2HH2  ARG 122          HH22      ARG 122  18.333  -2.899 -40.363
  908    H    VAL 123           H        VAL 123  16.829  -0.720 -31.700
  909    HA   VAL 123           HA       VAL 123  17.259  -2.103 -29.194
  910    HB   VAL 123           HB       VAL 123  17.628   0.794 -30.073
  911   1HG1  VAL 123          HG11      VAL 123  19.106   1.018 -28.062
  912   2HG1  VAL 123          HG12      VAL 123  17.404   0.808 -27.649
  913   3HG1  VAL 123          HG13      VAL 123  18.528  -0.560 -27.490
  914   1HG2  VAL 123          HG21      VAL 123  20.022   0.197 -30.138
  915   2HG2  VAL 123          HG22      VAL 123  19.650  -1.455 -29.610
  916   3HG2  VAL 123          HG23      VAL 123  19.122  -0.881 -31.202
  917    H    ARG 124           H        ARG 124  14.816   0.265 -30.396
  918    HA   ARG 124           HA       ARG 124  13.575   0.859 -27.916
  919   1HB   ARG 124          HB2       ARG 124  13.114   2.075 -30.019
  920   2HB   ARG 124          HB3       ARG 124  12.505   0.610 -30.765
  921   1HG   ARG 124          HG2       ARG 124  10.828   0.848 -28.569
  922   2HG   ARG 124          HG3       ARG 124  11.179   2.529 -28.954
  923   1HD   ARG 124          HD2       ARG 124   9.215   1.930 -30.179
  924   2HD   ARG 124          HD3       ARG 124  10.536   2.024 -31.347
  925    HE   ARG 124           HE       ARG 124   9.977  -0.660 -30.248
  926   1HH1  ARG 124          HH22      ARG 124   9.491   1.608 -32.917
  927   2HH1  ARG 124          HH21      ARG 124   8.608   0.517 -33.912
  928   1HH2  ARG 124          HH11      ARG 124   8.846  -2.227 -31.615
  929   2HH2  ARG 124          HH12      ARG 124   8.313  -1.710 -33.173
  930    H    ASP 125           H        ASP 125  12.813  -1.653 -30.378
  931    HA   ASP 125           HA       ASP 125  10.624  -2.653 -28.904
  932   1HB   ASP 125          HB2       ASP 125  11.231  -2.885 -31.423
  933   2HB   ASP 125          HB3       ASP 125  12.159  -4.306 -30.938
  934    H    GLU 126           H        GLU 126  14.049  -3.750 -29.073
  935    HA   GLU 126           HA       GLU 126  13.829  -6.040 -27.402
  936   1HB   GLU 126          HB2       GLU 126  15.729  -5.674 -28.771
  937   2HB   GLU 126          HB3       GLU 126  16.107  -4.157 -27.939
  938   1HG   GLU 126          HG2       GLU 126  17.544  -5.992 -27.150
  939   2HG   GLU 126          HG3       GLU 126  16.529  -5.311 -25.874
  940    H    ILE 127           H        ILE 127  14.489  -2.591 -26.558
  941    HA   ILE 127           HA       ILE 127  14.749  -3.071 -23.765
  942    HB   ILE 127           HB       ILE 127  14.054  -0.631 -25.439
  943   1HG1  ILE 127          HG12      ILE 127  16.480  -1.345 -23.724
  944   2HG1  ILE 127          HG13      ILE 127  16.400  -1.624 -25.455
  945   1HG2  ILE 127          HG21      ILE 127  12.955  -0.322 -23.214
  946   2HG2  ILE 127          HG22      ILE 127  14.519  -0.620 -22.425
  947   3HG2  ILE 127          HG23      ILE 127  14.288   0.785 -23.500
  948   1HD1  ILE 127          HD11      ILE 127  16.472   1.051 -24.027
  949   2HD1  ILE 127          HD12      ILE 127  17.600   0.379 -25.209
  950   3HD1  ILE 127          HD13      ILE 127  15.985   0.893 -25.734
  951    H    GLY 128           H        GLY 128  11.877  -2.053 -25.716
  952   1HA   GLY 128          HA1       GLY 128   9.959  -2.034 -23.723
  953   2HA   GLY 128          HA2       GLY 128   9.664  -2.546 -25.401
  954    H    ASN 129           H        ASN 129  11.049  -4.927 -25.596
  955    HA   ASN 129           HA       ASN 129   9.288  -6.737 -24.290
  956   1HB   ASN 129          HB2       ASN 129  11.911  -7.128 -25.782
  957   2HB   ASN 129          HB3       ASN 129  11.160  -8.467 -24.930
  958   1HD2  ASN 129          HD22      ASN 129  10.733  -6.216 -27.646
  959   2HD2  ASN 129          HD21      ASN 129   9.505  -7.162 -28.445
  960    H    ARG 130           H        ARG 130  12.672  -5.825 -23.487
  961    HA   ARG 130           HA       ARG 130  12.606  -7.772 -21.337
  962   1HB   ARG 130          HB2       ARG 130  14.644  -6.512 -22.795
  963   2HB   ARG 130          HB3       ARG 130  14.792  -5.793 -21.206
  964   1HG   ARG 130          HG2       ARG 130  16.207  -7.796 -21.470
  965   2HG   ARG 130          HG3       ARG 130  15.029  -8.002 -20.175
  966   1HD   ARG 130          HD2       ARG 130  15.322 -10.045 -21.574
  967   2HD   ARG 130          HD3       ARG 130  13.664  -9.469 -21.533
  968    HE   ARG 130           HE       ARG 130  15.305  -8.516 -23.812
  969   1HH1  ARG 130          HH11      ARG 130  12.963 -11.008 -22.734
  970   2HH1  ARG 130          HH12      ARG 130  12.532 -11.433 -24.357
  971   1HH2  ARG 130          HH21      ARG 130  14.724  -9.077 -25.884
  972   2HH2  ARG 130          HH22      ARG 130  13.548 -10.323 -26.185
  973    H    LEU 131           H        LEU 131  11.850  -4.321 -21.511
  974    HA   LEU 131           HA       LEU 131  11.779  -3.997 -18.654
  975   1HB   LEU 131          HB2       LEU 131  11.487  -2.255 -20.804
  976   2HB   LEU 131          HB3       LEU 131   9.854  -2.385 -20.196
  977    HG   LEU 131           HG       LEU 131  10.929  -0.544 -19.160
  978   1HD1  LEU 131          HD11      LEU 131  10.853  -2.744 -17.080
  979   2HD1  LEU 131          HD12      LEU 131  10.749  -1.012 -16.770
  980   3HD1  LEU 131          HD13      LEU 131   9.451  -1.838 -17.658
  981   1HD2  LEU 131          HD21      LEU 131  12.992  -0.621 -17.914
  982   2HD2  LEU 131          HD22      LEU 131  13.145  -2.365 -18.148
  983   3HD2  LEU 131          HD23      LEU 131  13.276  -1.258 -19.532
  984    H    LYS 132           H        LYS 132   9.390  -5.095 -21.140
  985    HA   LYS 132           HA       LYS 132   7.206  -5.392 -19.382
  986   1HB   LYS 132          HB2       LYS 132   7.064  -5.625 -21.846
  987   2HB   LYS 132          HB3       LYS 132   7.966  -7.133 -21.767
  988   1HG   LYS 132          HG2       LYS 132   6.206  -8.198 -20.450
  989   2HG   LYS 132          HG3       LYS 132   5.285  -6.674 -20.414
  990   1HD   LYS 132          HD2       LYS 132   5.086  -6.728 -22.894
  991   2HD   LYS 132          HD3       LYS 132   6.080  -8.182 -22.950
  992   1HE   LYS 132          HE2       LYS 132   3.814  -8.882 -23.204
  993   2HE   LYS 132          HE3       LYS 132   4.366  -9.413 -21.614
  994   1HZ   LYS 132          HZ1       LYS 132   2.148  -8.459 -21.534
  995   2HZ   LYS 132          HZ2       LYS 132   3.151  -7.530 -20.651
  996   3HZ   LYS 132          HZ3       LYS 132   2.661  -7.039 -22.137
  997    H    GLU 133           H        GLU 133   9.791  -7.749 -20.209
  998    HA   GLU 133           HA       GLU 133   8.811  -9.682 -18.396
  999   1HB   GLU 133          HB2       GLU 133  11.668  -9.376 -19.377
 1000   2HB   GLU 133          HB3       GLU 133  10.999 -10.756 -18.483
 1001   1HG   GLU 133          HG2       GLU 133   9.237 -10.947 -20.327
 1002   2HG   GLU 133          HG3       GLU 133  10.237  -9.828 -21.264
 1003    H    PHE 134           H        PHE 134  11.141  -7.031 -17.845
 1004    HA   PHE 134           HA       PHE 134  11.876  -7.819 -15.232
 1005   1HB   PHE 134          HB2       PHE 134  13.146  -6.166 -16.413
 1006   2HB   PHE 134          HB3       PHE 134  11.734  -5.145 -16.646
 1007    HD1  PHE 134           HD1      PHE 134  11.141  -3.465 -15.087
 1008    HD2  PHE 134           HD2      PHE 134  14.055  -6.448 -14.001
 1009    HE1  PHE 134           HE1      PHE 134  11.734  -2.132 -13.095
 1010    HE2  PHE 134           HE2      PHE 134  14.599  -5.154 -11.954
 1011    HZ   PHE 134           HZ       PHE 134  13.449  -2.996 -11.498
 1012    H    ALA 135           H        ALA 135   9.034  -6.081 -16.420
 1013    HA   ALA 135           HA       ALA 135   8.194  -5.338 -13.749
 1014   1HB   ALA 135          HB1       ALA 135   6.195  -4.454 -14.898
 1015   2HB   ALA 135          HB2       ALA 135   7.662  -3.963 -15.774
 1016   3HB   ALA 135          HB3       ALA 135   6.657  -5.291 -16.394
 1017    H    GLU 136           H        GLU 136   7.378  -7.836 -16.121
 1018    HA   GLU 136           HA       GLU 136   5.094  -8.791 -14.613
 1019   1HB   GLU 136          HB2       GLU 136   5.067  -8.653 -17.066
 1020   2HB   GLU 136          HB3       GLU 136   6.467  -9.716 -17.167
 1021   1HG   GLU 136          HG2       GLU 136   4.569 -11.023 -17.726
 1022   2HG   GLU 136          HG3       GLU 136   5.119 -11.574 -16.153
 1023    H    THR 137           H        THR 137   8.305 -10.010 -15.502
 1024    HA   THR 137           HA       THR 137   7.842 -12.471 -13.927
 1025    HB   THR 137           HB       THR 137   9.310 -13.597 -15.392
 1026    HG1  THR 137           HG1      THR 137   9.926 -11.005 -16.334
 1027   1HG2  THR 137          HG21      THR 137   8.208 -13.447 -17.519
 1028   2HG2  THR 137          HG22      THR 137   6.986 -13.193 -16.259
 1029   3HG2  THR 137          HG23      THR 137   7.623 -11.809 -17.187
 1030    H    GLY 138           H        GLY 138   9.819  -9.595 -14.041
 1031   1HA   GLY 138          HA1       GLY 138  11.380  -8.826 -12.531
 1032   2HA   GLY 138          HA2       GLY 138  11.259 -10.332 -11.620
 1033    H    LYS 139           H        LYS 139  11.930 -10.579 -15.110
 1034    HA   LYS 139           HA       LYS 139  14.425 -11.905 -14.595
 1035   1HB   LYS 139          HB2       LYS 139  12.949 -11.013 -17.091
 1036   2HB   LYS 139          HB3       LYS 139  14.587 -11.684 -17.163
 1037   1HG   LYS 139          HG2       LYS 139  13.901 -13.761 -16.141
 1038   2HG   LYS 139          HG3       LYS 139  12.299 -13.134 -15.761
 1039   1HD   LYS 139          HD2       LYS 139  12.252 -14.678 -17.672
 1040   2HD   LYS 139          HD3       LYS 139  11.700 -13.059 -18.126
 1041   1HE   LYS 139          HE2       LYS 139  13.883 -12.535 -19.092
 1042   2HE   LYS 139          HE3       LYS 139  14.523 -14.111 -18.588
 1043   1HZ   LYS 139          HZ1       LYS 139  12.336 -13.656 -20.539
 1044   2HZ   LYS 139          HZ2       LYS 139  13.860 -14.112 -20.911
 1045   3HZ   LYS 139          HZ3       LYS 139  12.893 -15.145 -20.087
  Start of MODEL   12
    1   1H    MET   1           H1       MET   1   3.158   1.915   3.819
    2   2H    MET   1           H2       MET   1   2.484   3.396   3.675
    3   3H    MET   1           H3       MET   1   1.535   2.052   3.636
    4    HA   MET   1           HA       MET   1   2.533   1.318   1.617
    5   1HB   MET   1          HB2       MET   1   1.567   2.841   0.071
    6   2HB   MET   1          HB3       MET   1   0.509   2.757   1.462
    7   1HG   MET   1          HG2       MET   1   2.491   5.002   0.878
    8   2HG   MET   1          HG3       MET   1   0.788   5.037   0.479
    9   1HE   MET   1          HE1       MET   1  -1.140   5.633   2.040
   10   2HE   MET   1          HE2       MET   1  -0.886   4.090   2.888
   11   3HE   MET   1          HE3       MET   1  -1.046   5.596   3.812
   12    H    GLU   2           H        GLU   2   3.827   2.011  -0.362
   13    HA   GLU   2           HA       GLU   2   5.943   3.950   0.042
   14   1HB   GLU   2          HB2       GLU   2   7.781   2.387  -0.294
   15   2HB   GLU   2          HB3       GLU   2   6.913   1.985   1.182
   16   1HG   GLU   2          HG2       GLU   2   5.754   0.124   0.014
   17   2HG   GLU   2          HG3       GLU   2   6.572   0.549  -1.491
   18    H    ASN   3           H        ASN   3   7.396   3.812  -2.065
   19    HA   ASN   3           HA       ASN   3   6.045   2.723  -4.426
   20   1HB   ASN   3          HB2       ASN   3   5.277   5.181  -4.000
   21   2HB   ASN   3          HB3       ASN   3   6.946   5.640  -4.365
   22   1HD2  ASN   3          HD22      ASN   3   7.779   5.041  -6.597
   23   2HD2  ASN   3          HD21      ASN   3   6.558   4.938  -7.873
   24    H    LYS   4           H        LYS   4   7.705   2.138  -5.948
   25    HA   LYS   4           HA       LYS   4  10.420   2.124  -4.830
   26   1HB   LYS   4          HB2       LYS   4   8.904   0.572  -6.832
   27   2HB   LYS   4          HB3       LYS   4  10.426   1.126  -7.508
   28   1HG   LYS   4          HG2       LYS   4  10.833  -1.005  -6.503
   29   2HG   LYS   4          HG3       LYS   4  11.631   0.224  -5.519
   30   1HD   LYS   4          HD2       LYS   4   9.535   0.139  -3.987
   31   2HD   LYS   4          HD3       LYS   4   9.063  -1.299  -4.917
   32   1HE   LYS   4          HE2       LYS   4  11.321  -2.296  -4.359
   33   2HE   LYS   4          HE3       LYS   4  11.657  -0.868  -3.363
   34   1HZ   LYS   4          HZ1       LYS   4   9.724  -1.472  -1.987
   35   2HZ   LYS   4          HZ2       LYS   4   9.474  -2.817  -2.894
   36   3HZ   LYS   4          HZ3       LYS   4  10.837  -2.676  -2.011
   37    H    ILE   5           H        ILE   5  12.200   2.510  -6.588
   38    HA   ILE   5           HA       ILE   5  11.754   4.908  -8.204
   39    HB   ILE   5           HB       ILE   5  14.022   4.661  -6.199
   40   1HG1  ILE   5          HG12      ILE   5  12.891   6.886  -5.249
   41   2HG1  ILE   5          HG13      ILE   5  11.422   6.088  -5.782
   42   1HG2  ILE   5          HG21      ILE   5  14.584   5.967  -8.238
   43   2HG2  ILE   5          HG22      ILE   5  13.175   7.001  -7.960
   44   3HG2  ILE   5          HG23      ILE   5  14.539   7.014  -6.824
   45   1HD1  ILE   5          HD11      ILE   5  13.547   4.982  -3.879
   46   2HD1  ILE   5          HD12      ILE   5  11.947   5.590  -3.417
   47   3HD1  ILE   5          HD13      ILE   5  12.096   4.086  -4.341
   48    H    ILE   6           H        ILE   6  13.167   4.730 -10.078
   49    HA   ILE   6           HA       ILE   6  15.217   2.619 -10.068
   50    HB   ILE   6           HB       ILE   6  13.214   1.400 -10.665
   51   1HG1  ILE   6          HG12      ILE   6  14.911   1.825 -13.161
   52   2HG1  ILE   6          HG13      ILE   6  15.392   0.862 -11.760
   53   1HG2  ILE   6          HG21      ILE   6  12.841   3.283 -13.024
   54   2HG2  ILE   6          HG22      ILE   6  11.825   1.893 -12.604
   55   3HG2  ILE   6          HG23      ILE   6  11.837   3.299 -11.553
   56   1HD1  ILE   6          HD11      ILE   6  14.567  -0.607 -13.484
   57   2HD1  ILE   6          HD12      ILE   6  13.406  -0.614 -12.139
   58   3HD1  ILE   6          HD13      ILE   6  13.057   0.295 -13.630
   59    H    TYR   7           H        TYR   7  16.800   2.920 -11.709
   60    HA   TYR   7           HA       TYR   7  16.644   5.511 -13.151
   61   1HB   TYR   7          HB2       TYR   7  17.931   5.287 -10.835
   62   2HB   TYR   7          HB3       TYR   7  19.144   4.472 -11.791
   63    HD1  TYR   7           HD1      TYR   7  17.530   7.336 -13.510
   64    HD2  TYR   7           HD2      TYR   7  20.578   6.178 -10.678
   65    HE1  TYR   7           HE1      TYR   7  18.373   9.637 -13.488
   66    HE2  TYR   7           HE2      TYR   7  21.430   8.500 -10.666
   67    HH   TYR   7           HH       TYR   7  19.819  11.145 -12.465
   68    H    PHE   8           H        PHE   8  17.484   5.449 -15.197
   69    HA   PHE   8           HA       PHE   8  18.926   2.983 -16.112
   70   1HB   PHE   8          HB2       PHE   8  17.084   4.805 -17.717
   71   2HB   PHE   8          HB3       PHE   8  17.954   3.410 -18.331
   72    HD1  PHE   8           HD1      PHE   8  14.885   4.546 -16.871
   73    HD2  PHE   8           HD2      PHE   8  17.418   1.083 -17.255
   74    HE1  PHE   8           HE1      PHE   8  12.993   3.063 -16.281
   75    HE2  PHE   8           HE2      PHE   8  15.530  -0.383 -16.608
   76    HZ   PHE   8           HZ       PHE   8  13.318   0.615 -16.079
   77    H    LEU   9           H        LEU   9  20.933   3.376 -16.931
   78    HA   LEU   9           HA       LEU   9  21.754   6.224 -17.275
   79   1HB   LEU   9          HB2       LEU   9  23.189   3.888 -15.976
   80   2HB   LEU   9          HB3       LEU   9  23.916   5.462 -16.288
   81    HG   LEU   9           HG       LEU   9  21.641   4.865 -14.353
   82   1HD1  LEU   9          HD11      LEU   9  23.916   4.206 -13.623
   83   2HD1  LEU   9          HD12      LEU   9  24.496   5.857 -13.920
   84   3HD1  LEU   9          HD13      LEU   9  23.282   5.555 -12.662
   85   1HD2  LEU   9          HD21      LEU   9  21.171   7.049 -15.260
   86   2HD2  LEU   9          HD22      LEU   9  21.905   7.270 -13.680
   87   3HD2  LEU   9          HD23      LEU   9  22.878   7.527 -15.152
   88    H    CYS  10           H        CYS  10  23.107   6.729 -18.926
   89    HA   CYS  10           HA       CYS  10  24.467   4.551 -20.430
   90   1HB   CYS  10          HB2       CYS  10  22.716   6.728 -21.663
   91   2HB   CYS  10          HB3       CYS  10  23.859   5.758 -22.592
   92    HG   CYS  10           HG       CYS  10  22.017   4.060 -20.597
   93    H    THR  11           H        THR  11  26.138   5.476 -21.923
   94    HA   THR  11           HA       THR  11  27.896   7.280 -20.781
   95    HB   THR  11           HB       THR  11  27.565   6.653 -23.736
   96    HG1  THR  11           HG1      THR  11  27.925   4.653 -23.303
   97   1HG2  THR  11          HG21      THR  11  30.021   6.497 -23.703
   98   2HG2  THR  11          HG22      THR  11  29.486   8.110 -23.183
   99   3HG2  THR  11          HG23      THR  11  30.015   6.925 -21.964
  100    H    GLY  12           H        GLY  12  25.014   7.940 -22.736
  101   1HA   GLY  12          HA1       GLY  12  25.199  10.745 -22.022
  102   2HA   GLY  12          HA2       GLY  12  25.108  10.418 -23.768
  103    H    ASN  13           H        ASN  13  23.124  11.420 -21.561
  104    HA   ASN  13           HA       ASN  13  21.057   9.368 -21.483
  105   1HB   ASN  13          HB2       ASN  13  21.536  10.976 -19.617
  106   2HB   ASN  13          HB3       ASN  13  20.956  12.285 -20.640
  107   1HD2  ASN  13          HD22      ASN  13  19.383   8.951 -20.348
  108   2HD2  ASN  13          HD21      ASN  13  17.932   9.622 -19.624
  109    H    SER  14           H        SER  14  21.358   9.533 -24.094
  110    HA   SER  14           HA       SER  14  19.418  11.559 -25.124
  111   1HB   SER  14          HB2       SER  14  20.848  11.258 -27.239
  112   2HB   SER  14          HB3       SER  14  21.496  12.187 -25.878
  113    HG   SER  14           HG       SER  14  23.016  10.686 -26.725
  114    H    CYS  15           H        CYS  15  20.319   8.119 -25.311
  115    HA   CYS  15           HA       CYS  15  18.018   7.717 -27.189
  116   1HB   CYS  15          HB2       CYS  15  20.746   6.343 -27.191
  117   2HB   CYS  15          HB3       CYS  15  19.399   5.986 -28.281
  118    HG   CYS  15           HG       CYS  15  21.522   7.317 -29.243
  119    H    ARG  16           H        ARG  16  20.141   5.292 -25.715
  120    HA   ARG  16           HA       ARG  16  18.017   3.485 -25.351
  121   1HB   ARG  16          HB2       ARG  16  20.799   3.678 -24.157
  122   2HB   ARG  16          HB3       ARG  16  19.760   2.292 -23.855
  123   1HG   ARG  16          HG2       ARG  16  19.774   1.600 -26.095
  124   2HG   ARG  16          HG3       ARG  16  20.389   3.144 -26.699
  125   1HD   ARG  16          HD2       ARG  16  21.961   1.259 -24.889
  126   2HD   ARG  16          HD3       ARG  16  22.106   1.311 -26.654
  127    HE   ARG  16           HE       ARG  16  22.526   3.939 -25.921
  128   1HH1  ARG  16          HH12      ARG  16  24.155   0.831 -25.310
  129   2HH1  ARG  16          HH11      ARG  16  25.679   1.621 -25.015
  130   1HH2  ARG  16          HH21      ARG  16  24.493   4.850 -25.591
  131   2HH2  ARG  16          HH22      ARG  16  25.878   3.908 -25.026
  132    H    SER  17           H        SER  17  19.635   5.499 -22.786
  133    HA   SER  17           HA       SER  17  18.003   4.412 -20.715
  134   1HB   SER  17          HB2       SER  17  18.892   6.430 -19.446
  135   2HB   SER  17          HB3       SER  17  20.064   5.330 -20.124
  136    HG   SER  17           HG       SER  17  20.873   7.066 -20.962
  137    H    GLN  18           H        GLN  18  17.557   7.184 -22.866
  138    HA   GLN  18           HA       GLN  18  15.280   8.343 -21.584
  139   1HB   GLN  18          HB2       GLN  18  16.622   8.486 -24.292
  140   2HB   GLN  18          HB3       GLN  18  14.983   9.083 -24.179
  141   1HG   GLN  18          HG2       GLN  18  17.210   9.995 -22.312
  142   2HG   GLN  18          HG3       GLN  18  16.819  10.800 -23.827
  143   1HE2  GLN  18          HE22      GLN  18  16.559  12.520 -21.797
  144   2HE2  GLN  18          HE21      GLN  18  14.896  12.627 -21.212
  145    H    MET  19           H        MET  19  15.464   6.198 -24.433
  146    HA   MET  19           HA       MET  19  12.703   5.649 -24.683
  147   1HB   MET  19          HB2       MET  19  15.070   3.832 -25.345
  148   2HB   MET  19          HB3       MET  19  13.402   3.578 -25.861
  149   1HG   MET  19          HG2       MET  19  13.570   5.971 -26.881
  150   2HG   MET  19          HG3       MET  19  15.314   5.753 -26.740
  151   1HE   MET  19          HE1       MET  19  15.789   2.683 -27.461
  152   2HE   MET  19          HE2       MET  19  16.061   2.837 -29.209
  153   3HE   MET  19          HE3       MET  19  16.749   4.042 -28.096
  154    H    ALA  20           H        ALA  20  15.157   3.885 -22.683
  155    HA   ALA  20           HA       ALA  20  13.399   1.850 -21.809
  156   1HB   ALA  20          HB1       ALA  20  15.040   1.497 -20.004
  157   2HB   ALA  20          HB2       ALA  20  15.845   1.745 -21.567
  158   3HB   ALA  20          HB3       ALA  20  15.802   3.059 -20.366
  159    H    GLU  21           H        GLU  21  14.137   5.021 -20.273
  160    HA   GLU  21           HA       GLU  21  12.386   4.723 -18.076
  161   1HB   GLU  21          HB2       GLU  21  13.968   6.531 -18.210
  162   2HB   GLU  21          HB3       GLU  21  13.172   7.206 -19.638
  163   1HG   GLU  21          HG2       GLU  21  11.127   7.602 -18.248
  164   2HG   GLU  21          HG3       GLU  21  11.991   7.005 -16.839
  165    H    GLY  22           H        GLY  22  11.625   5.775 -21.457
  166   1HA   GLY  22          HA1       GLY  22   8.912   6.467 -21.033
  167   2HA   GLY  22          HA2       GLY  22   9.640   5.902 -22.560
  168    H    TRP  23           H        TRP  23  10.348   3.311 -22.068
  169    HA   TRP  23           HA       TRP  23   7.844   1.908 -22.141
  170   1HB   TRP  23          HB2       TRP  23  10.712   0.973 -21.723
  171   2HB   TRP  23          HB3       TRP  23   9.346  -0.128 -21.797
  172    HD1  TRP  23           HD1      TRP  23  11.733   1.652 -23.994
  173    HE1  TRP  23           HE1      TRP  23  11.227   1.177 -26.430
  174    HE3  TRP  23           HE3      TRP  23   7.077  -0.404 -23.451
  175    HZ2  TRP  23           HZ2      TRP  23   9.029   0.026 -28.002
  176    HZ3  TRP  23           HZ3      TRP  23   5.881  -1.326 -25.414
  177    HH2  TRP  23           HH2      TRP  23   6.879  -1.158 -27.684
  178    H    ALA  24           H        ALA  24  10.292   2.291 -19.545
  179    HA   ALA  24           HA       ALA  24   9.101   0.481 -17.746
  180   1HB   ALA  24          HB1       ALA  24  10.543   1.629 -16.064
  181   2HB   ALA  24          HB2       ALA  24  11.415   1.282 -17.562
  182   3HB   ALA  24          HB3       ALA  24  10.844   2.919 -17.254
  183    H    LYS  25           H        LYS  25   8.612   4.035 -18.091
  184    HA   LYS  25           HA       LYS  25   6.795   4.371 -15.966
  185   1HB   LYS  25          HB2       LYS  25   7.069   5.710 -18.675
  186   2HB   LYS  25          HB3       LYS  25   5.835   6.228 -17.512
  187   1HG   LYS  25          HG2       LYS  25   7.433   6.861 -15.871
  188   2HG   LYS  25          HG3       LYS  25   8.725   5.957 -16.660
  189   1HD   LYS  25          HD2       LYS  25   9.114   8.283 -16.947
  190   2HD   LYS  25          HD3       LYS  25   8.807   7.508 -18.507
  191   1HE   LYS  25          HE2       LYS  25   6.581   8.456 -18.627
  192   2HE   LYS  25          HE3       LYS  25   6.696   9.089 -16.974
  193   1HZ   LYS  25          HZ1       LYS  25   7.216  10.748 -18.801
  194   2HZ   LYS  25          HZ2       LYS  25   8.379  10.591 -17.661
  195   3HZ   LYS  25          HZ3       LYS  25   8.570   9.873 -19.118
  196    H    GLN  26           H        GLN  26   6.194   2.954 -19.161
  197    HA   GLN  26           HA       GLN  26   3.341   2.841 -18.732
  198   1HB   GLN  26          HB2       GLN  26   4.795   0.977 -20.622
  199   2HB   GLN  26          HB3       GLN  26   3.130   1.527 -20.663
  200   1HG   GLN  26          HG2       GLN  26   5.642   2.966 -21.461
  201   2HG   GLN  26          HG3       GLN  26   4.204   2.648 -22.410
  202   1HE2  GLN  26          HE22      GLN  26   5.879   5.094 -20.946
  203   2HE2  GLN  26          HE21      GLN  26   4.564   6.233 -20.680
  204    H    TYR  27           H        TYR  27   5.809   0.231 -18.774
  205    HA   TYR  27           HA       TYR  27   3.960  -1.733 -17.885
  206   1HB   TYR  27          HB2       TYR  27   6.999  -1.760 -17.755
  207   2HB   TYR  27          HB3       TYR  27   5.965  -3.155 -17.494
  208    HD1  TYR  27           HD1      TYR  27   4.166  -3.621 -19.449
  209    HD2  TYR  27           HD2      TYR  27   7.896  -1.516 -19.900
  210    HE1  TYR  27           HE1      TYR  27   4.194  -4.197 -21.858
  211    HE2  TYR  27           HE2      TYR  27   8.014  -2.209 -22.273
  212    HH   TYR  27           HH       TYR  27   6.903  -3.280 -24.027
  213    H    LEU  28           H        LEU  28   6.367   0.153 -16.033
  214    HA   LEU  28           HA       LEU  28   5.841  -1.251 -13.549
  215   1HB   LEU  28          HB2       LEU  28   7.239   1.412 -14.011
  216   2HB   LEU  28          HB3       LEU  28   7.302   0.450 -12.566
  217    HG   LEU  28           HG       LEU  28   8.450  -0.373 -15.257
  218   1HD1  LEU  28          HD11      LEU  28   9.657   1.430 -14.002
  219   2HD1  LEU  28          HD12      LEU  28   9.863   0.298 -12.650
  220   3HD1  LEU  28          HD13      LEU  28  10.605  -0.056 -14.224
  221   1HD2  LEU  28          HD21      LEU  28   8.621  -1.857 -12.602
  222   2HD2  LEU  28          HD22      LEU  28   7.671  -2.374 -14.008
  223   3HD2  LEU  28          HD23      LEU  28   9.421  -2.304 -14.126
  224    H    GLY  29           H        GLY  29   3.902   0.951 -15.190
  225   1HA   GLY  29          HA1       GLY  29   2.028   2.073 -14.622
  226   2HA   GLY  29          HA2       GLY  29   1.933   0.943 -13.260
  227    H    ASP  30           H        ASP  30   4.558   3.236 -13.577
  228    HA   ASP  30           HA       ASP  30   5.429   4.795 -12.270
  229   1HB   ASP  30          HB2       ASP  30   3.573   6.050 -13.283
  230   2HB   ASP  30          HB3       ASP  30   2.588   5.744 -11.850
  231    H    GLU  31           H        GLU  31   4.100   2.227 -10.923
  232    HA   GLU  31           HA       GLU  31   4.051   2.916  -8.119
  233   1HB   GLU  31          HB2       GLU  31   4.702   0.176  -9.272
  234   2HB   GLU  31          HB3       GLU  31   4.079   0.573  -7.675
  235   1HG   GLU  31          HG2       GLU  31   1.988   1.463  -8.889
  236   2HG   GLU  31          HG3       GLU  31   2.644   0.677 -10.339
  237    H    TRP  32           H        TRP  32   6.451   3.109 -10.323
  238    HA   TRP  32           HA       TRP  32   8.649   2.908  -8.391
  239   1HB   TRP  32          HB2       TRP  32   8.810   2.090 -11.319
  240   2HB   TRP  32          HB3       TRP  32  10.099   2.021 -10.135
  241    HD1  TRP  32           HD1      TRP  32   6.554   0.431 -10.389
  242    HE1  TRP  32           HE1      TRP  32   6.665  -2.029  -9.857
  243    HE3  TRP  32           HE3      TRP  32  11.606   0.033  -9.617
  244    HZ2  TRP  32           HZ2      TRP  32   8.701  -4.008  -9.432
  245    HZ3  TRP  32           HZ3      TRP  32  12.614  -2.198  -9.247
  246    HH2  TRP  32           HH2      TRP  32  11.181  -4.238  -9.192
  247    H    LYS  33           H        LYS  33   9.423   5.022  -8.320
  248    HA   LYS  33           HA       LYS  33   8.704   7.080 -10.208
  249   1HB   LYS  33          HB2       LYS  33  10.777   6.916  -7.975
  250   2HB   LYS  33          HB3       LYS  33  10.457   8.372  -8.914
  251   1HG   LYS  33          HG2       LYS  33   8.503   6.995  -7.029
  252   2HG   LYS  33          HG3       LYS  33   9.455   8.425  -6.705
  253   1HD   LYS  33          HD2       LYS  33   7.465   9.403  -7.202
  254   2HD   LYS  33          HD3       LYS  33   8.241   9.462  -8.787
  255   1HE   LYS  33          HE2       LYS  33   6.948   7.403  -9.445
  256   2HE   LYS  33          HE3       LYS  33   6.207   7.375  -7.842
  257   1HZ   LYS  33          HZ1       LYS  33   5.153   9.474  -8.332
  258   2HZ   LYS  33          HZ2       LYS  33   5.926   9.599  -9.773
  259   3HZ   LYS  33          HZ3       LYS  33   4.820   8.427  -9.556
  260    H    VAL  34           H        VAL  34   9.352   6.574 -12.251
  261    HA   VAL  34           HA       VAL  34  11.904   5.359 -12.751
  262    HB   VAL  34           HB       VAL  34  10.065   6.529 -14.854
  263   1HG1  VAL  34          HG11      VAL  34  10.886   4.815 -16.227
  264   2HG1  VAL  34          HG12      VAL  34  12.326   5.359 -15.358
  265   3HG1  VAL  34          HG13      VAL  34  11.511   3.867 -14.854
  266   1HG2  VAL  34          HG21      VAL  34   8.870   4.276 -14.916
  267   2HG2  VAL  34          HG22      VAL  34   9.540   3.954 -13.308
  268   3HG2  VAL  34          HG23      VAL  34   8.431   5.322 -13.570
  269    H    TYR  35           H        TYR  35  13.725   6.349 -13.568
  270    HA   TYR  35           HA       TYR  35  13.646   9.123 -14.597
  271   1HB   TYR  35          HB2       TYR  35  15.497   8.105 -12.393
  272   2HB   TYR  35          HB3       TYR  35  15.682   9.638 -13.225
  273    HD1  TYR  35           HD1      TYR  35  13.944  11.458 -12.936
  274    HD2  TYR  35           HD2      TYR  35  14.030   7.892 -10.505
  275    HE1  TYR  35           HE1      TYR  35  12.573  12.604 -11.225
  276    HE2  TYR  35           HE2      TYR  35  12.690   9.046  -8.770
  277    HH   TYR  35           HH       TYR  35  11.538  12.427  -9.139
  278    H    SER  36           H        SER  36  15.767   9.619 -15.715
  279    HA   SER  36           HA       SER  36  17.571   7.376 -16.099
  280   1HB   SER  36          HB2       SER  36  17.665   7.648 -18.513
  281   2HB   SER  36          HB3       SER  36  16.068   7.102 -18.010
  282    HG   SER  36           HG       SER  36  15.275   9.141 -18.344
  283    H    ALA  37           H        ALA  37  19.661   8.099 -16.968
  284    HA   ALA  37           HA       ALA  37  20.223  10.903 -17.261
  285   1HB   ALA  37          HB1       ALA  37  21.236   9.536 -14.728
  286   2HB   ALA  37          HB2       ALA  37  21.711  11.141 -15.319
  287   3HB   ALA  37          HB3       ALA  37  20.061  10.869 -14.805
  288    H    GLY  38           H        GLY  38  22.970  10.893 -16.825
  289   1HA   GLY  38          HA1       GLY  38  24.289   8.514 -17.622
  290   2HA   GLY  38          HA2       GLY  38  24.035   9.565 -19.032
  291    H    ILE  39           H        ILE  39  26.521   9.164 -18.635
  292    HA   ILE  39           HA       ILE  39  28.012  10.828 -16.887
  293    HB   ILE  39           HB       ILE  39  28.403   9.336 -19.450
  294   1HG1  ILE  39          HG12      ILE  39  30.208   9.503 -17.016
  295   2HG1  ILE  39          HG13      ILE  39  28.778   8.484 -17.070
  296   1HG2  ILE  39          HG21      ILE  39  30.428  11.437 -18.628
  297   2HG2  ILE  39          HG22      ILE  39  30.678  10.177 -19.860
  298   3HG2  ILE  39          HG23      ILE  39  29.463  11.410 -20.129
  299   1HD1  ILE  39          HD11      ILE  39  30.764   7.166 -17.621
  300   2HD1  ILE  39          HD12      ILE  39  29.696   7.261 -19.035
  301   3HD1  ILE  39          HD13      ILE  39  31.175   8.245 -18.951
  302    H    GLU  40           H        GLU  40  26.148  11.614 -19.780
  303    HA   GLU  40           HA       GLU  40  26.464  14.418 -19.221
  304   1HB   GLU  40          HB2       GLU  40  27.017  15.085 -21.483
  305   2HB   GLU  40          HB3       GLU  40  28.315  14.141 -20.759
  306   1HG   GLU  40          HG2       GLU  40  27.606  12.141 -22.022
  307   2HG   GLU  40          HG3       GLU  40  26.236  13.017 -22.701
  308    H    ALA  41           H        ALA  41  24.885  15.660 -20.664
  309    HA   ALA  41           HA       ALA  41  22.791  14.081 -21.960
  310   1HB   ALA  41          HB1       ALA  41  21.031  15.425 -20.740
  311   2HB   ALA  41          HB2       ALA  41  21.898  14.281 -19.691
  312   3HB   ALA  41          HB3       ALA  41  22.285  16.016 -19.640
  313    H    HIS  42           H        HIS  42  22.140  15.196 -23.760
  314    HA   HIS  42           HA       HIS  42  22.605  18.135 -23.941
  315   1HB   HIS  42          HB2       HIS  42  23.244  16.010 -26.033
  316   2HB   HIS  42          HB3       HIS  42  23.096  17.720 -26.403
  317    HD1  HIS  42           HD1      HIS  42  24.903  17.741 -23.236
  318    HD2  HIS  42           HD2      HIS  42  25.740  16.928 -27.281
  319    HE1  HIS  42           HE1      HIS  42  27.420  18.048 -23.523
  320    H    GLY  43           H        GLY  43  20.319  15.977 -23.458
  321   1HA   GLY  43          HA1       GLY  43  17.984  16.383 -23.797
  322   2HA   GLY  43          HA2       GLY  43  18.327  17.149 -25.351
  323    H    LEU  44           H        LEU  44  16.490  15.114 -25.164
  324    HA   LEU  44           HA       LEU  44  17.686  12.554 -25.740
  325   1HB   LEU  44          HB2       LEU  44  15.508  11.696 -25.852
  326   2HB   LEU  44          HB3       LEU  44  15.552  12.831 -24.513
  327    HG   LEU  44           HG       LEU  44  14.260  13.242 -27.244
  328   1HD1  LEU  44          HD11      LEU  44  13.144  13.017 -24.408
  329   2HD1  LEU  44          HD12      LEU  44  12.192  13.188 -25.897
  330   3HD1  LEU  44          HD13      LEU  44  13.156  11.726 -25.614
  331   1HD2  LEU  44          HD21      LEU  44  14.351  15.189 -24.886
  332   2HD2  LEU  44          HD22      LEU  44  14.985  15.476 -26.533
  333   3HD2  LEU  44          HD23      LEU  44  13.253  15.323 -26.272
  334    H    ASN  45           H        ASN  45  17.407  11.344 -27.692
  335    HA   ASN  45           HA       ASN  45  18.218  12.911 -29.975
  336   1HB   ASN  45          HB2       ASN  45  19.142  10.686 -29.255
  337   2HB   ASN  45          HB3       ASN  45  17.634   9.925 -29.750
  338   1HD2  ASN  45          HD22      ASN  45  20.728  10.641 -30.755
  339   2HD2  ASN  45          HD21      ASN  45  20.490  10.612 -32.486
  340    HA   PRO  46           HA       PRO  46  14.067  13.402 -31.694
  341   1HB   PRO  46          HB2       PRO  46  15.558  13.282 -34.323
  342   2HB   PRO  46          HB3       PRO  46  14.263  14.411 -33.816
  343   1HG   PRO  46          HG2       PRO  46  16.856  15.199 -33.763
  344   2HG   PRO  46          HG3       PRO  46  15.767  15.611 -32.398
  345   1HD   PRO  46          HD2       PRO  46  17.822  13.401 -32.559
  346   2HD   PRO  46          HD3       PRO  46  17.446  14.514 -31.207
  347    H    ASN  47           H        ASN  47  16.284  10.873 -32.972
  348    HA   ASN  47           HA       ASN  47  14.160   9.413 -34.333
  349   1HB   ASN  47          HB2       ASN  47  16.859   8.439 -33.378
  350   2HB   ASN  47          HB3       ASN  47  15.791   7.590 -34.483
  351   1HD2  ASN  47          HD22      ASN  47  18.293   9.916 -34.183
  352   2HD2  ASN  47          HD21      ASN  47  18.431  10.324 -35.887
  353    H    ALA  48           H        ALA  48  15.578   9.470 -31.082
  354    HA   ALA  48           HA       ALA  48  14.424   7.007 -30.170
  355   1HB   ALA  48          HB1       ALA  48  16.324   8.132 -28.998
  356   2HB   ALA  48          HB2       ALA  48  15.247   9.459 -28.532
  357   3HB   ALA  48          HB3       ALA  48  14.944   7.831 -27.927
  358    H    VAL  49           H        VAL  49  13.387  10.474 -30.107
  359    HA   VAL  49           HA       VAL  49  10.875  10.031 -28.883
  360    HB   VAL  49           HB       VAL  49  11.528  12.126 -31.005
  361   1HG1  VAL  49          HG11      VAL  49   9.104  11.942 -30.591
  362   2HG1  VAL  49          HG12      VAL  49   9.379  12.060 -28.840
  363   3HG1  VAL  49          HG13      VAL  49   9.739  13.437 -29.900
  364   1HG2  VAL  49          HG21      VAL  49  13.133  12.293 -29.148
  365   2HG2  VAL  49          HG22      VAL  49  11.983  13.626 -29.078
  366   3HG2  VAL  49          HG23      VAL  49  11.798  12.244 -27.978
  367    H    LYS  50           H        LYS  50  11.703  10.045 -32.431
  368    HA   LYS  50           HA       LYS  50   9.105   9.307 -33.286
  369   1HB   LYS  50          HB2       LYS  50  11.848   8.760 -34.519
  370   2HB   LYS  50          HB3       LYS  50  10.356   8.325 -35.321
  371   1HG   LYS  50          HG2       LYS  50  11.188  11.152 -34.543
  372   2HG   LYS  50          HG3       LYS  50  11.257  10.458 -36.154
  373   1HD   LYS  50          HD2       LYS  50   8.766  11.105 -34.526
  374   2HD   LYS  50          HD3       LYS  50   9.324  11.924 -35.967
  375   1HE   LYS  50          HE2       LYS  50   8.365   9.019 -35.871
  376   2HE   LYS  50          HE3       LYS  50   7.378  10.400 -36.342
  377   1HZ   LYS  50          HZ1       LYS  50   8.257   9.296 -38.276
  378   2HZ   LYS  50          HZ2       LYS  50   8.886  10.793 -38.197
  379   3HZ   LYS  50          HZ3       LYS  50   9.800   9.496 -37.793
  380    H    ALA  51           H        ALA  51  11.804   7.171 -32.277
  381    HA   ALA  51           HA       ALA  51  10.534   4.747 -32.971
  382   1HB   ALA  51          HB1       ALA  51  12.497   5.287 -30.693
  383   2HB   ALA  51          HB2       ALA  51  12.164   3.722 -31.465
  384   3HB   ALA  51          HB3       ALA  51  12.942   5.012 -32.388
  385    H    MET  52           H        MET  52  10.428   6.621 -29.874
  386    HA   MET  52           HA       MET  52   8.682   4.723 -28.590
  387   1HB   MET  52          HB2       MET  52   9.160   7.682 -28.013
  388   2HB   MET  52          HB3       MET  52   8.265   6.584 -26.972
  389   1HG   MET  52          HG2       MET  52  11.221   6.541 -27.615
  390   2HG   MET  52          HG3       MET  52  10.443   6.764 -26.063
  391   1HE   MET  52          HE1       MET  52   9.153   3.142 -25.267
  392   2HE   MET  52          HE2       MET  52   8.954   4.875 -24.981
  393   3HE   MET  52          HE3       MET  52   8.265   4.113 -26.455
  394    H    LYS  53           H        LYS  53   8.019   7.704 -30.502
  395    HA   LYS  53           HA       LYS  53   5.200   7.575 -30.161
  396   1HB   LYS  53          HB2       LYS  53   6.953   8.616 -32.385
  397   2HB   LYS  53          HB3       LYS  53   5.216   8.879 -32.358
  398   1HG   LYS  53          HG2       LYS  53   6.761   9.696 -29.888
  399   2HG   LYS  53          HG3       LYS  53   6.994  10.655 -31.350
  400   1HD   LYS  53          HD2       LYS  53   5.305  11.688 -30.004
  401   2HD   LYS  53          HD3       LYS  53   4.568  11.082 -31.492
  402   1HE   LYS  53          HE2       LYS  53   3.715   9.098 -30.248
  403   2HE   LYS  53          HE3       LYS  53   4.476   9.704 -28.768
  404   1HZ   LYS  53          HZ1       LYS  53   2.128  10.279 -28.855
  405   2HZ   LYS  53          HZ2       LYS  53   3.009  11.649 -28.911
  406   3HZ   LYS  53          HZ3       LYS  53   2.307  11.069 -30.266
  407    H    GLU  54           H        GLU  54   7.329   5.529 -32.069
  408    HA   GLU  54           HA       GLU  54   5.406   4.812 -34.043
  409   1HB   GLU  54          HB2       GLU  54   7.948   4.594 -34.105
  410   2HB   GLU  54          HB3       GLU  54   7.752   3.138 -33.154
  411   1HG   GLU  54          HG2       GLU  54   6.541   3.699 -35.900
  412   2HG   GLU  54          HG3       GLU  54   8.022   2.794 -35.622
  413    H    VAL  55           H        VAL  55   6.038   3.845 -30.722
  414    HA   VAL  55           HA       VAL  55   4.120   1.569 -30.961
  415    HB   VAL  55           HB       VAL  55   5.936   0.835 -29.779
  416   1HG1  VAL  55          HG11      VAL  55   5.980   3.291 -28.004
  417   2HG1  VAL  55          HG12      VAL  55   7.073   1.910 -27.928
  418   3HG1  VAL  55          HG13      VAL  55   7.119   2.958 -29.346
  419   1HG2  VAL  55          HG21      VAL  55   5.147   0.386 -27.509
  420   2HG2  VAL  55          HG22      VAL  55   4.014   1.729 -27.589
  421   3HG2  VAL  55          HG23      VAL  55   3.798   0.312 -28.646
  422    H    GLY  56           H        GLY  56   4.453   4.827 -29.641
  423   1HA   GLY  56          HA1       GLY  56   2.390   6.177 -29.647
  424   2HA   GLY  56          HA2       GLY  56   1.531   4.808 -28.927
  425    H    ILE  57           H        ILE  57   4.841   5.843 -28.054
  426    HA   ILE  57           HA       ILE  57   3.897   6.720 -25.362
  427    HB   ILE  57           HB       ILE  57   6.433   5.279 -26.226
  428   1HG1  ILE  57          HG12      ILE  57   4.400   4.470 -24.110
  429   2HG1  ILE  57          HG13      ILE  57   4.329   3.909 -25.774
  430   1HG2  ILE  57          HG21      ILE  57   5.828   6.570 -23.522
  431   2HG2  ILE  57          HG22      ILE  57   7.159   5.440 -23.787
  432   3HG2  ILE  57          HG23      ILE  57   7.159   6.980 -24.622
  433   1HD1  ILE  57          HD11      ILE  57   6.548   2.842 -25.557
  434   2HD1  ILE  57          HD12      ILE  57   6.591   3.302 -23.837
  435   3HD1  ILE  57          HD13      ILE  57   5.349   2.195 -24.440
  436    H    ASP  58           H        ASP  58   5.228   8.547 -24.590
  437    HA   ASP  58           HA       ASP  58   6.713  10.006 -26.705
  438   1HB   ASP  58          HB2       ASP  58   4.659  11.269 -26.530
  439   2HB   ASP  58          HB3       ASP  58   4.711  11.209 -24.755
  440    H    ILE  59           H        ILE  59   8.542  10.936 -25.948
  441    HA   ILE  59           HA       ILE  59   9.192  10.716 -23.074
  442    HB   ILE  59           HB       ILE  59  11.576  10.150 -23.748
  443   1HG1  ILE  59          HG12      ILE  59  10.324   9.210 -26.368
  444   2HG1  ILE  59          HG13      ILE  59  11.211  10.719 -26.227
  445   1HG2  ILE  59          HG21      ILE  59  11.107   7.768 -23.771
  446   2HG2  ILE  59          HG22      ILE  59   9.907   8.557 -22.753
  447   3HG2  ILE  59          HG23      ILE  59   9.460   8.043 -24.384
  448   1HD1  ILE  59          HD11      ILE  59  12.353   7.941 -25.660
  449   2HD1  ILE  59          HD12      ILE  59  12.677   8.961 -27.070
  450   3HD1  ILE  59          HD13      ILE  59  13.225   9.470 -25.469
  451    H    SER  60           H        SER  60   8.566  12.811 -25.569
  452    HA   SER  60           HA       SER  60  10.592  14.792 -25.256
  453   1HB   SER  60          HB2       SER  60   7.660  15.373 -25.753
  454   2HB   SER  60          HB3       SER  60   9.077  16.268 -26.324
  455    HG   SER  60           HG       SER  60   8.009  13.785 -27.124
  456    H    ASN  61           H        ASN  61   7.772  13.916 -23.351
  457    HA   ASN  61           HA       ASN  61   7.698  16.126 -21.573
  458   1HB   ASN  61          HB2       ASN  61   6.253  14.722 -20.204
  459   2HB   ASN  61          HB3       ASN  61   5.828  14.546 -21.898
  460   1HD2  ASN  61          HD22      ASN  61   6.303  12.548 -22.983
  461   2HD2  ASN  61          HD21      ASN  61   6.719  11.088 -22.116
  462    H    GLN  62           H        GLN  62  10.340  14.008 -21.775
  463    HA   GLN  62           HA       GLN  62  10.991  14.374 -18.902
  464   1HB   GLN  62          HB2       GLN  62  11.779  11.975 -18.848
  465   2HB   GLN  62          HB3       GLN  62  10.028  12.178 -18.923
  466   1HG   GLN  62          HG2       GLN  62   9.950  11.624 -21.244
  467   2HG   GLN  62          HG3       GLN  62  11.711  11.722 -21.403
  468   1HE2  GLN  62          HE22      GLN  62  12.816   9.907 -21.391
  469   2HE2  GLN  62          HE21      GLN  62  12.198   8.339 -20.920
  470    H    THR  63           H        THR  63  12.009  16.102 -20.567
  471    HA   THR  63           HA       THR  63  14.182  15.434 -22.142
  472    HB   THR  63           HB       THR  63  14.898  17.882 -21.527
  473    HG1  THR  63           HG1      THR  63  13.787  18.042 -19.551
  474   1HG2  THR  63          HG21      THR  63  13.038  18.815 -22.843
  475   2HG2  THR  63          HG22      THR  63  13.570  17.276 -23.539
  476   3HG2  THR  63          HG23      THR  63  12.084  17.341 -22.569
  477    H    SER  64           H        SER  64  16.381  15.267 -21.911
  478    HA   SER  64           HA       SER  64  17.220  13.698 -19.874
  479   1HB   SER  64          HB2       SER  64  18.914  15.362 -21.774
  480   2HB   SER  64          HB3       SER  64  19.339  13.799 -21.065
  481    HG   SER  64           HG       SER  64  18.512  13.059 -22.819
  482    H    ASP  65           H        ASP  65  19.085  13.826 -18.533
  483    HA   ASP  65           HA       ASP  65  20.243  16.374 -17.773
  484   1HB   ASP  65          HB2       ASP  65  18.128  16.269 -16.377
  485   2HB   ASP  65          HB3       ASP  65  18.738  14.781 -15.651
  486    H    ILE  66           H        ILE  66  22.052  16.006 -16.234
  487    HA   ILE  66           HA       ILE  66  23.447  13.454 -16.658
  488    HB   ILE  66           HB       ILE  66  25.044  14.724 -14.934
  489   1HG1  ILE  66          HG12      ILE  66  23.423  16.742 -14.771
  490   2HG1  ILE  66          HG13      ILE  66  25.150  16.992 -14.915
  491   1HG2  ILE  66          HG21      ILE  66  25.672  13.911 -17.071
  492   2HG2  ILE  66          HG22      ILE  66  24.851  15.258 -17.894
  493   3HG2  ILE  66          HG23      ILE  66  26.291  15.555 -16.879
  494   1HD1  ILE  66          HD11      ILE  66  23.246  17.249 -17.286
  495   2HD1  ILE  66          HD12      ILE  66  23.872  18.585 -16.304
  496   3HD1  ILE  66          HD13      ILE  66  24.980  17.602 -17.272
  497    H    ILE  67           H        ILE  67  24.412  12.435 -14.648
  498    HA   ILE  67           HA       ILE  67  22.346  11.452 -13.015
  499    HB   ILE  67           HB       ILE  67  25.372  11.338 -12.774
  500   1HG1  ILE  67          HG12      ILE  67  23.324   9.199 -13.505
  501   2HG1  ILE  67          HG13      ILE  67  24.125  10.192 -14.710
  502   1HG2  ILE  67          HG21      ILE  67  25.009   9.478 -11.113
  503   2HG2  ILE  67          HG22      ILE  67  24.464  11.032 -10.504
  504   3HG2  ILE  67          HG23      ILE  67  23.275   9.864 -11.107
  505   1HD1  ILE  67          HD11      ILE  67  25.249   8.104 -14.631
  506   2HD1  ILE  67          HD12      ILE  67  26.341   9.327 -13.950
  507   3HD1  ILE  67          HD13      ILE  67  25.480   8.189 -12.880
  508    H    ASP  68           H        ASP  68  21.745  11.848 -10.931
  509    HA   ASP  68           HA       ASP  68  22.878  14.205  -9.515
  510   1HB   ASP  68          HB2       ASP  68  20.867  14.922 -10.808
  511   2HB   ASP  68          HB3       ASP  68  19.906  13.716  -9.944
  512    H    SER  69           H        SER  69  22.938  14.005  -7.329
  513    HA   SER  69           HA       SER  69  23.144  11.526  -6.197
  514   1HB   SER  69          HB2       SER  69  22.554  14.099  -4.709
  515   2HB   SER  69          HB3       SER  69  23.486  12.704  -4.133
  516    HG   SER  69           HG       SER  69  24.829  14.419  -4.877
  517    H    ASP  70           H        ASP  70  20.223  13.453  -6.504
  518    HA   ASP  70           HA       ASP  70  18.838  12.360  -4.239
  519   1HB   ASP  70          HB2       ASP  70  18.356  14.576  -5.265
  520   2HB   ASP  70          HB3       ASP  70  17.739  13.754  -6.706
  521    H    ILE  71           H        ILE  71  19.578  11.029  -7.297
  522    HA   ILE  71           HA       ILE  71  17.422   8.989  -7.024
  523    HB   ILE  71           HB       ILE  71  18.804   9.950  -9.542
  524   1HG1  ILE  71          HG12      ILE  71  15.845  10.400  -9.033
  525   2HG1  ILE  71          HG13      ILE  71  16.988  11.565  -8.382
  526   1HG2  ILE  71          HG21      ILE  71  18.095   7.605  -9.605
  527   2HG2  ILE  71          HG22      ILE  71  16.457   8.044  -9.079
  528   3HG2  ILE  71          HG23      ILE  71  17.061   8.566 -10.664
  529   1HD1  ILE  71          HD11      ILE  71  16.219  12.274 -10.572
  530   2HD1  ILE  71          HD12      ILE  71  17.970  11.975 -10.547
  531   3HD1  ILE  71          HD13      ILE  71  16.872  10.794 -11.308
  532    H    LEU  72           H        LEU  72  20.884   9.627  -7.957
  533    HA   LEU  72           HA       LEU  72  21.499   6.976  -8.481
  534   1HB   LEU  72          HB2       LEU  72  23.752   7.514  -8.516
  535   2HB   LEU  72          HB3       LEU  72  22.904   9.010  -8.912
  536    HG   LEU  72           HG       LEU  72  23.227   9.508  -6.351
  537   1HD1  LEU  72          HD11      LEU  72  25.651   7.750  -6.880
  538   2HD1  LEU  72          HD12      LEU  72  25.414   8.816  -5.487
  539   3HD1  LEU  72          HD13      LEU  72  24.372   7.421  -5.689
  540   1HD2  LEU  72          HD21      LEU  72  25.332  10.718  -6.945
  541   2HD2  LEU  72          HD22      LEU  72  25.481   9.722  -8.411
  542   3HD2  LEU  72          HD23      LEU  72  24.131  10.857  -8.230
  543    H    ASN  73           H        ASN  73  21.554   8.530  -5.280
  544    HA   ASN  73           HA       ASN  73  22.366   5.996  -4.063
  545   1HB   ASN  73          HB2       ASN  73  23.258   7.160  -2.381
  546   2HB   ASN  73          HB3       ASN  73  23.230   8.500  -3.508
  547   1HD2  ASN  73          HD22      ASN  73  21.029   9.911  -3.349
  548   2HD2  ASN  73          HD21      ASN  73  20.433  10.119  -1.726
  549    H    ASN  74           H        ASN  74  19.507   6.963  -5.097
  550    HA   ASN  74           HA       ASN  74  17.929   6.244  -2.649
  551   1HB   ASN  74          HB2       ASN  74  17.945   8.655  -3.198
  552   2HB   ASN  74          HB3       ASN  74  17.482   8.270  -4.852
  553   1HD2  ASN  74          HD22      ASN  74  15.667   9.616  -4.717
  554   2HD2  ASN  74          HD21      ASN  74  14.216   9.131  -3.852
  555    H    ALA  75           H        ALA  75  18.337   5.830  -6.136
  556    HA   ALA  75           HA       ALA  75  15.900   4.554  -6.773
  557   1HB   ALA  75          HB1       ALA  75  17.052   3.775  -8.727
  558   2HB   ALA  75          HB2       ALA  75  17.461   5.468  -8.418
  559   3HB   ALA  75          HB3       ALA  75  18.632   4.192  -8.008
  560    H    ASP  76           H        ASP  76  15.143   2.567  -6.422
  561    HA   ASP  76           HA       ASP  76  16.429   0.792  -4.556
  562   1HB   ASP  76          HB2       ASP  76  13.976   0.967  -4.752
  563   2HB   ASP  76          HB3       ASP  76  14.058   0.360  -6.410
  564    H    LEU  77           H        LEU  77  16.459   1.229  -8.011
  565    HA   LEU  77           HA       LEU  77  18.493  -0.866  -8.324
  566   1HB   LEU  77          HB2       LEU  77  16.426  -2.093  -8.861
  567   2HB   LEU  77          HB3       LEU  77  15.889  -0.781  -9.912
  568    HG   LEU  77           HG       LEU  77  17.800  -1.232 -11.456
  569   1HD1  LEU  77          HD11      LEU  77  19.074  -3.326 -11.251
  570   2HD1  LEU  77          HD12      LEU  77  19.401  -2.290  -9.870
  571   3HD1  LEU  77          HD13      LEU  77  18.297  -3.671  -9.691
  572   1HD2  LEU  77          HD21      LEU  77  16.898  -3.316 -12.382
  573   2HD2  LEU  77          HD22      LEU  77  16.031  -3.623 -10.861
  574   3HD2  LEU  77          HD23      LEU  77  15.613  -2.219 -11.868
  575    H    VAL  78           H        VAL  78  19.993  -0.234  -9.804
  576    HA   VAL  78           HA       VAL  78  19.369   2.046 -11.616
  577    HB   VAL  78           HB       VAL  78  22.019   1.300 -10.295
  578   1HG1  VAL  78          HG11      VAL  78  21.324   3.576 -12.206
  579   2HG1  VAL  78          HG12      VAL  78  22.847   3.423 -11.306
  580   3HG1  VAL  78          HG13      VAL  78  22.429   2.219 -12.526
  581   1HG2  VAL  78          HG21      VAL  78  20.518   2.414  -8.689
  582   2HG2  VAL  78          HG22      VAL  78  21.818   3.507  -9.155
  583   3HG2  VAL  78          HG23      VAL  78  20.194   3.708  -9.851
  584    H    VAL  79           H        VAL  79  20.002   1.644 -13.812
  585    HA   VAL  79           HA       VAL  79  21.161  -1.040 -14.380
  586    HB   VAL  79           HB       VAL  79  18.908   0.239 -15.952
  587   1HG1  VAL  79          HG11      VAL  79  20.342  -1.392 -17.168
  588   2HG1  VAL  79          HG12      VAL  79  19.997  -2.606 -15.925
  589   3HG1  VAL  79          HG13      VAL  79  18.693  -1.989 -16.961
  590   1HG2  VAL  79          HG21      VAL  79  18.640  -1.887 -13.793
  591   2HG2  VAL  79          HG22      VAL  79  17.872  -0.283 -13.831
  592   3HG2  VAL  79          HG23      VAL  79  17.387  -1.512 -14.997
  593    H    THR  80           H        THR  80  22.908  -0.832 -15.714
  594    HA   THR  80           HA       THR  80  23.203   1.719 -17.245
  595    HB   THR  80           HB       THR  80  25.563   0.657 -17.643
  596    HG1  THR  80           HG1      THR  80  25.004  -1.308 -16.472
  597   1HG2  THR  80          HG21      THR  80  26.401   1.857 -15.666
  598   2HG2  THR  80          HG22      THR  80  25.125   2.754 -16.490
  599   3HG2  THR  80          HG23      THR  80  24.758   1.881 -14.979
  600    H    LEU  81           H        LEU  81  22.952   1.678 -19.376
  601    HA   LEU  81           HA       LEU  81  22.270  -0.954 -20.605
  602   1HB   LEU  81          HB2       LEU  81  21.548   1.874 -21.392
  603   2HB   LEU  81          HB3       LEU  81  21.207   0.468 -22.377
  604    HG   LEU  81           HG       LEU  81  19.770  -0.473 -20.602
  605   1HD1  LEU  81          HD11      LEU  81  20.282   2.194 -19.197
  606   2HD1  LEU  81          HD12      LEU  81  18.901   1.137 -18.844
  607   3HD1  LEU  81          HD13      LEU  81  20.521   0.555 -18.538
  608   1HD2  LEU  81          HD21      LEU  81  18.757   0.841 -22.404
  609   2HD2  LEU  81          HD22      LEU  81  17.895   1.099 -20.895
  610   3HD2  LEU  81          HD23      LEU  81  19.011   2.343 -21.478
  611    H    CYS  82           H        CYS  82  25.053   0.510 -20.222
  612    HA   CYS  82           HA       CYS  82  26.043   1.096 -22.808
  613   1HB   CYS  82          HB2       CYS  82  28.265   0.746 -21.727
  614   2HB   CYS  82          HB3       CYS  82  27.260   1.995 -20.985
  615    H    GLY  83           H        GLY  83  26.610  -0.229 -24.414
  616   1HA   GLY  83          HA1       GLY  83  27.934  -2.781 -23.853
  617   2HA   GLY  83          HA2       GLY  83  26.421  -2.919 -24.749
  618    H    ASP  84           H        ASP  84  27.714   0.050 -25.734
  619    HA   ASP  84           HA       ASP  84  28.867  -1.027 -28.211
  620   1HB   ASP  84          HB2       ASP  84  27.534   1.034 -28.314
  621   2HB   ASP  84          HB3       ASP  84  28.529   1.759 -27.062
  622    H    ALA  85           H        ALA  85  31.047  -0.521 -28.797
  623    HA   ALA  85           HA       ALA  85  32.965  -1.269 -26.841
  624   1HB   ALA  85          HB1       ALA  85  34.594  -0.915 -28.658
  625   2HB   ALA  85          HB2       ALA  85  33.165  -1.782 -29.251
  626   3HB   ALA  85          HB3       ALA  85  33.369  -0.048 -29.607
  627    H    ALA  86           H        ALA  86  31.768   1.941 -27.658
  628    HA   ALA  86           HA       ALA  86  34.034   3.161 -26.130
  629   1HB   ALA  86          HB1       ALA  86  33.505   5.232 -27.217
  630   2HB   ALA  86          HB2       ALA  86  33.797   3.990 -28.462
  631   3HB   ALA  86          HB3       ALA  86  32.126   4.506 -28.064
  632    H    ASP  87           H        ASP  87  31.107   1.957 -25.342
  633    HA   ASP  87           HA       ASP  87  30.006   4.281 -23.976
  634   1HB   ASP  87          HB2       ASP  87  29.541   1.292 -23.652
  635   2HB   ASP  87          HB3       ASP  87  28.918   2.534 -22.552
  636    H    LYS  88           H        LYS  88  31.388   5.237 -22.594
  637    HA   LYS  88           HA       LYS  88  33.435   3.960 -21.155
  638   1HB   LYS  88          HB2       LYS  88  32.005   6.595 -20.794
  639   2HB   LYS  88          HB3       LYS  88  32.966   5.998 -19.459
  640   1HG   LYS  88          HG2       LYS  88  34.352   7.448 -20.760
  641   2HG   LYS  88          HG3       LYS  88  34.956   5.799 -20.847
  642   1HD   LYS  88          HD2       LYS  88  35.191   6.790 -23.008
  643   2HD   LYS  88          HD3       LYS  88  33.932   5.565 -23.119
  644   1HE   LYS  88          HE2       LYS  88  32.231   7.479 -22.793
  645   2HE   LYS  88          HE3       LYS  88  33.586   8.598 -22.924
  646   1HZ   LYS  88          HZ1       LYS  88  32.764   6.663 -25.020
  647   2HZ   LYS  88          HZ2       LYS  88  32.484   8.281 -25.058
  648   3HZ   LYS  88          HZ3       LYS  88  34.011   7.724 -25.151
  649    H    CYS  89           H        CYS  89  30.024   3.903 -20.518
  650    HA   CYS  89           HA       CYS  89  28.674   3.028 -18.980
  651   1HB   CYS  89          HB2       CYS  89  31.084   1.577 -17.893
  652   2HB   CYS  89          HB3       CYS  89  29.457   1.404 -17.285
  653    HA   PRO  90           HA       PRO  90  29.340   6.435 -16.021
  654   1HB   PRO  90          HB2       PRO  90  26.526   5.621 -15.346
  655   2HB   PRO  90          HB3       PRO  90  27.210   7.264 -15.593
  656   1HG   PRO  90          HG2       PRO  90  25.708   6.086 -17.523
  657   2HG   PRO  90          HG3       PRO  90  27.166   7.035 -17.942
  658   1HD   PRO  90          HD2       PRO  90  26.863   4.046 -17.778
  659   2HD   PRO  90          HD3       PRO  90  27.720   5.047 -18.995
  660    H    MET  91           H        MET  91  29.922   6.384 -13.868
  661    HA   MET  91           HA       MET  91  30.116   3.831 -12.530
  662   1HB   MET  91          HB2       MET  91  30.841   6.670 -11.677
  663   2HB   MET  91          HB3       MET  91  31.162   5.217 -10.720
  664   1HG   MET  91          HG2       MET  91  32.548   4.300 -12.554
  665   2HG   MET  91          HG3       MET  91  32.270   5.765 -13.501
  666   1HE   MET  91          HE1       MET  91  35.147   4.563 -12.922
  667   2HE   MET  91          HE2       MET  91  34.861   6.040 -13.871
  668   3HE   MET  91          HE3       MET  91  36.056   6.047 -12.555
  669    H    THR  92           H        THR  92  29.099   3.312 -10.576
  670    HA   THR  92           HA       THR  92  26.704   4.844  -9.743
  671    HB   THR  92           HB       THR  92  25.790   2.488  -9.422
  672    HG1  THR  92           HG1      THR  92  27.674   1.294  -9.414
  673   1HG2  THR  92          HG21      THR  92  25.354   3.914 -11.495
  674   2HG2  THR  92          HG22      THR  92  26.661   3.010 -12.292
  675   3HG2  THR  92          HG23      THR  92  25.195   2.169 -11.741
  676    HA   PRO  93           HA       PRO  93  28.347   4.184  -5.612
  677   1HB   PRO  93          HB2       PRO  93  26.123   3.959  -4.035
  678   2HB   PRO  93          HB3       PRO  93  26.612   5.503  -4.802
  679   1HG   PRO  93          HG2       PRO  93  24.587   3.491  -5.806
  680   2HG   PRO  93          HG3       PRO  93  24.389   5.251  -5.636
  681   1HD   PRO  93          HD2       PRO  93  25.039   4.079  -8.009
  682   2HD   PRO  93          HD3       PRO  93  25.708   5.670  -7.552
  683    HA   PRO  94           HA       PRO  94  28.285  -0.316  -5.550
  684   1HB   PRO  94          HB2       PRO  94  29.808  -0.862  -3.351
  685   2HB   PRO  94          HB3       PRO  94  30.487  -0.161  -4.853
  686   1HG   PRO  94          HG2       PRO  94  29.647   1.295  -2.330
  687   2HG   PRO  94          HG3       PRO  94  31.173   1.471  -3.254
  688   1HD   PRO  94          HD2       PRO  94  29.031   3.165  -3.573
  689   2HD   PRO  94          HD3       PRO  94  30.111   2.732  -4.939
  690    H    HIS  95           H        HIS  95  27.054   1.636  -2.912
  691    HA   HIS  95           HA       HIS  95  25.960  -0.409  -1.266
  692   1HB   HIS  95          HB2       HIS  95  26.422   1.957  -0.609
  693   2HB   HIS  95          HB3       HIS  95  25.108   2.493  -1.656
  694    HD1  HIS  95           HD1      HIS  95  25.596   0.371   1.571
  695    HD2  HIS  95           HD2      HIS  95  22.703   2.537  -0.597
  696    HE1  HIS  95           HE1      HIS  95  23.524   0.467   3.042
  697    H    VAL  96           H        VAL  96  24.916   0.759  -4.401
  698    HA   VAL  96           HA       VAL  96  22.092   0.010  -3.834
  699    HB   VAL  96           HB       VAL  96  23.241   1.799  -5.990
  700   1HG1  VAL  96          HG11      VAL  96  20.365   1.171  -5.224
  701   2HG1  VAL  96          HG12      VAL  96  20.861   2.500  -6.293
  702   3HG1  VAL  96          HG13      VAL  96  21.162   0.835  -6.778
  703   1HG2  VAL  96          HG21      VAL  96  23.418   2.856  -3.737
  704   2HG2  VAL  96          HG22      VAL  96  22.143   3.628  -4.676
  705   3HG2  VAL  96          HG23      VAL  96  21.718   2.460  -3.411
  706    H    LYS  97           H        LYS  97  21.007  -1.414  -5.168
  707    HA   LYS  97           HA       LYS  97  22.466  -3.507  -6.448
  708   1HB   LYS  97          HB2       LYS  97  20.193  -3.723  -5.391
  709   2HB   LYS  97          HB3       LYS  97  19.518  -2.737  -6.700
  710   1HG   LYS  97          HG2       LYS  97  20.246  -4.463  -8.351
  711   2HG   LYS  97          HG3       LYS  97  20.922  -5.428  -7.026
  712   1HD   LYS  97          HD2       LYS  97  18.655  -5.648  -6.028
  713   2HD   LYS  97          HD3       LYS  97  17.993  -4.608  -7.291
  714   1HE   LYS  97          HE2       LYS  97  17.468  -6.861  -7.887
  715   2HE   LYS  97          HE3       LYS  97  18.683  -6.272  -9.022
  716   1HZ   LYS  97          HZ1       LYS  97  19.156  -8.516  -8.247
  717   2HZ   LYS  97          HZ2       LYS  97  20.353  -7.524  -7.768
  718   3HZ   LYS  97          HZ3       LYS  97  19.225  -8.034  -6.695
  719    H    ARG  98           H        ARG  98  22.956  -3.792  -8.580
  720    HA   ARG  98           HA       ARG  98  22.099  -1.740 -10.525
  721   1HB   ARG  98          HB2       ARG  98  24.320  -1.116  -9.751
  722   2HB   ARG  98          HB3       ARG  98  24.939  -2.732 -10.124
  723   1HG   ARG  98          HG2       ARG  98  24.597  -2.374 -12.517
  724   2HG   ARG  98          HG3       ARG  98  23.783  -0.818 -12.211
  725   1HD   ARG  98          HD2       ARG  98  25.813   0.116 -11.312
  726   2HD   ARG  98          HD3       ARG  98  26.647  -1.442 -11.397
  727    HE   ARG  98           HE       ARG  98  25.705  -0.739 -14.004
  728   1HH1  ARG  98          HH21      ARG  98  28.067   0.598 -11.732
  729   2HH1  ARG  98          HH22      ARG  98  29.356   0.662 -12.890
  730   1HH2  ARG  98          HH11      ARG  98  27.271  -0.477 -15.543
  731   2HH2  ARG  98          HH12      ARG  98  28.884   0.069 -15.159
  732    H    GLU  99           H        GLU  99  21.920  -2.475 -12.659
  733    HA   GLU  99           HA       GLU  99  22.513  -5.325 -13.248
  734   1HB   GLU  99          HB2       GLU  99  19.924  -3.804 -13.696
  735   2HB   GLU  99          HB3       GLU  99  20.440  -5.038 -14.850
  736   1HG   GLU  99          HG2       GLU  99  20.558  -6.724 -13.100
  737   2HG   GLU  99          HG3       GLU  99  20.101  -5.529 -11.872
  738    H    HIS 100           H        HIS 100  22.752  -5.635 -15.614
  739    HA   HIS 100           HA       HIS 100  23.846  -3.252 -17.018
  740   1HB   HIS 100          HB2       HIS 100  25.727  -4.361 -15.997
  741   2HB   HIS 100          HB3       HIS 100  25.142  -5.949 -16.489
  742    HD1  HIS 100           HD1      HIS 100  26.747  -2.806 -18.101
  743    HD2  HIS 100           HD2      HIS 100  25.803  -6.839 -18.867
  744    HE1  HIS 100           HE1      HIS 100  27.904  -3.413 -20.281
  745    H    TRP 101           H        TRP 101  22.646  -3.049 -18.770
  746    HA   TRP 101           HA       TRP 101  21.518  -5.445 -20.177
  747   1HB   TRP 101          HB2       TRP 101  20.307  -2.692 -19.699
  748   2HB   TRP 101          HB3       TRP 101  19.671  -3.872 -20.825
  749    HD1  TRP 101           HD1      TRP 101  20.578  -5.198 -17.348
  750    HE1  TRP 101           HE1      TRP 101  18.459  -5.646 -16.011
  751    HE3  TRP 101           HE3      TRP 101  17.163  -3.237 -20.628
  752    HZ2  TRP 101           HZ2      TRP 101  15.627  -5.226 -16.327
  753    HZ3  TRP 101           HZ3      TRP 101  14.741  -3.335 -20.104
  754    HH2  TRP 101           HH2      TRP 101  13.966  -4.311 -17.945
  755    H    GLY 102           H        GLY 102  23.955  -4.979 -21.042
  756   1HA   GLY 102          HA1       GLY 102  24.341  -2.589 -22.566
  757   2HA   GLY 102          HA2       GLY 102  25.383  -4.006 -22.550
  758    H    PHE 103           H        PHE 103  23.888  -2.091 -24.594
  759    HA   PHE 103           HA       PHE 103  24.163  -3.955 -26.757
  760   1HB   PHE 103          HB2       PHE 103  21.841  -3.006 -27.696
  761   2HB   PHE 103          HB3       PHE 103  21.970  -4.516 -26.825
  762    HD1  PHE 103           HD1      PHE 103  20.457  -4.953 -25.099
  763    HD2  PHE 103           HD2      PHE 103  21.375  -0.865 -26.108
  764    HE1  PHE 103           HE1      PHE 103  18.894  -4.171 -23.340
  765    HE2  PHE 103           HE2      PHE 103  19.840  -0.090 -24.314
  766    HZ   PHE 103           HZ       PHE 103  18.655  -1.737 -22.886
  767    H    ASP 104           H        ASP 104  24.283  -2.702 -28.780
  768    HA   ASP 104           HA       ASP 104  25.852  -0.392 -28.499
  769   1HB   ASP 104          HB2       ASP 104  26.021  -1.959 -30.374
  770   2HB   ASP 104          HB3       ASP 104  24.391  -1.535 -30.904
  771    H    ASP 105           H        ASP 105  25.455   1.729 -29.256
  772    HA   ASP 105           HA       ASP 105  22.832   2.744 -28.377
  773   1HB   ASP 105          HB2       ASP 105  25.079   3.889 -27.822
  774   2HB   ASP 105          HB3       ASP 105  25.075   4.452 -29.481
  775    HA   PRO 106           HA       PRO 106  21.553   2.562 -32.634
  776   1HB   PRO 106          HB2       PRO 106  19.277   4.136 -32.537
  777   2HB   PRO 106          HB3       PRO 106  19.359   2.419 -32.054
  778   1HG   PRO 106          HG2       PRO 106  19.455   4.861 -30.282
  779   2HG   PRO 106          HG3       PRO 106  18.586   3.326 -30.003
  780   1HD   PRO 106          HD2       PRO 106  20.998   3.904 -28.857
  781   2HD   PRO 106          HD3       PRO 106  20.595   2.238 -29.362
  782    H    ALA 107           H        ALA 107  22.215   5.660 -31.052
  783    HA   ALA 107           HA       ALA 107  22.194   7.213 -33.467
  784   1HB   ALA 107          HB1       ALA 107  23.768   7.665 -30.900
  785   2HB   ALA 107          HB2       ALA 107  23.475   8.857 -32.179
  786   3HB   ALA 107          HB3       ALA 107  22.115   8.242 -31.224
  787    H    ARG 108           H        ARG 108  24.339   4.722 -32.360
  788    HA   ARG 108           HA       ARG 108  26.624   5.768 -33.975
  789   1HB   ARG 108          HB2       ARG 108  26.551   3.596 -31.839
  790   2HB   ARG 108          HB3       ARG 108  27.991   4.173 -32.683
  791   1HG   ARG 108          HG2       ARG 108  27.704   6.425 -31.705
  792   2HG   ARG 108          HG3       ARG 108  26.217   5.898 -30.909
  793   1HD   ARG 108          HD2       ARG 108  27.672   4.075 -29.784
  794   2HD   ARG 108          HD3       ARG 108  29.065   5.053 -30.284
  795    HE   ARG 108           HE       ARG 108  27.429   6.895 -29.097
  796   1HH1  ARG 108          HH21      ARG 108  28.965   3.900 -27.938
  797   2HH1  ARG 108          HH22      ARG 108  28.333   4.089 -26.309
  798   1HH2  ARG 108          HH11      ARG 108  26.854   7.216 -26.852
  799   2HH2  ARG 108          HH12      ARG 108  27.347   6.029 -25.682
  800    H    ALA 109           H        ALA 109  23.986   3.831 -34.471
  801    HA   ALA 109           HA       ALA 109  25.197   1.637 -35.882
  802   1HB   ALA 109          HB1       ALA 109  22.865   1.145 -36.511
  803   2HB   ALA 109          HB2       ALA 109  23.007   1.477 -34.774
  804   3HB   ALA 109          HB3       ALA 109  22.347   2.715 -35.866
  805    H    GLN 110           H        GLN 110  26.488   3.818 -36.863
  806    HA   GLN 110           HA       GLN 110  25.293   5.202 -39.005
  807   1HB   GLN 110          HB2       GLN 110  27.807   5.535 -39.682
  808   2HB   GLN 110          HB3       GLN 110  27.113   6.319 -38.281
  809   1HG   GLN 110          HG2       GLN 110  29.395   5.478 -37.894
  810   2HG   GLN 110          HG3       GLN 110  28.222   4.883 -36.747
  811   1HE2  GLN 110          HE22      GLN 110  28.340   2.689 -36.310
  812   2HE2  GLN 110          HE21      GLN 110  29.068   1.501 -37.372
  813    H    GLY 111           H        GLY 111  25.720   5.153 -41.161
  814   1HA   GLY 111          HA1       GLY 111  26.734   3.382 -42.938
  815   2HA   GLY 111          HA2       GLY 111  25.241   2.565 -42.398
  816    H    THR 112           H        THR 112  23.425   4.410 -41.966
  817    HA   THR 112           HA       THR 112  23.422   6.787 -43.435
  818    HB   THR 112           HB       THR 112  23.093   5.487 -45.448
  819    HG1  THR 112           HG1      THR 112  21.280   6.409 -46.142
  820   1HG2  THR 112          HG21      THR 112  20.802   4.070 -44.038
  821   2HG2  THR 112          HG22      THR 112  21.163   3.962 -45.772
  822   3HG2  THR 112          HG23      THR 112  22.325   3.343 -44.598
  823    H    GLU 113           H        GLU 113  21.201   7.820 -43.193
  824    HA   GLU 113           HA       GLU 113  20.446   7.656 -40.449
  825   1HB   GLU 113          HB2       GLU 113  18.732   9.285 -41.015
  826   2HB   GLU 113          HB3       GLU 113  20.283   9.720 -41.730
  827   1HG   GLU 113          HG2       GLU 113  19.502   8.809 -43.932
  828   2HG   GLU 113          HG3       GLU 113  17.938   8.436 -43.205
  829    H    GLU 114           H        GLU 114  19.256   6.011 -43.344
  830    HA   GLU 114           HA       GLU 114  16.830   5.067 -42.160
  831   1HB   GLU 114          HB2       GLU 114  17.311   5.178 -44.615
  832   2HB   GLU 114          HB3       GLU 114  18.434   3.821 -44.426
  833   1HG   GLU 114          HG2       GLU 114  16.594   2.378 -43.644
  834   2HG   GLU 114          HG3       GLU 114  15.474   3.742 -43.694
  835    H    GLU 115           H        GLU 115  20.173   3.838 -42.233
  836    HA   GLU 115           HA       GLU 115  19.533   1.279 -41.048
  837   1HB   GLU 115          HB2       GLU 115  22.134   2.817 -41.410
  838   2HB   GLU 115          HB3       GLU 115  22.062   1.288 -40.545
  839   1HG   GLU 115          HG2       GLU 115  21.101   1.631 -43.414
  840   2HG   GLU 115          HG3       GLU 115  22.733   1.140 -42.975
  841    H    LYS 116           H        LYS 116  20.781   4.442 -39.844
  842    HA   LYS 116           HA       LYS 116  20.827   3.774 -37.103
  843   1HB   LYS 116          HB2       LYS 116  20.307   6.397 -38.560
  844   2HB   LYS 116          HB3       LYS 116  20.340   6.272 -36.787
  845   1HG   LYS 116          HG2       LYS 116  22.654   5.213 -37.031
  846   2HG   LYS 116          HG3       LYS 116  22.599   5.698 -38.742
  847   1HD   LYS 116          HD2       LYS 116  22.235   8.081 -37.976
  848   2HD   LYS 116          HD3       LYS 116  22.405   7.514 -36.296
  849   1HE   LYS 116          HE2       LYS 116  24.671   6.513 -37.066
  850   2HE   LYS 116          HE3       LYS 116  24.481   7.510 -38.520
  851   1HZ   LYS 116          HZ1       LYS 116  25.770   8.707 -36.915
  852   2HZ   LYS 116          HZ2       LYS 116  24.318   9.449 -36.951
  853   3HZ   LYS 116          HZ3       LYS 116  24.706   8.427 -35.712
  854    H    TRP 117           H        TRP 117  18.063   5.166 -38.989
  855    HA   TRP 117           HA       TRP 117  16.229   5.191 -36.870
  856   1HB   TRP 117          HB2       TRP 117  15.800   6.380 -38.895
  857   2HB   TRP 117          HB3       TRP 117  15.943   4.923 -39.870
  858    HD1  TRP 117           HD1      TRP 117  13.748   4.371 -40.879
  859    HE1  TRP 117           HE1      TRP 117  11.315   4.247 -40.169
  860    HE3  TRP 117           HE3      TRP 117  14.242   6.086 -36.065
  861    HZ2  TRP 117           HZ2      TRP 117   9.742   4.812 -37.774
  862    HZ3  TRP 117           HZ3      TRP 117  12.289   6.211 -34.591
  863    HH2  TRP 117           HH2      TRP 117  10.018   5.581 -35.423
  864    H    ALA 118           H        ALA 118  17.010   2.492 -39.132
  865    HA   ALA 118           HA       ALA 118  14.989   0.756 -38.112
  866   1HB   ALA 118          HB1       ALA 118  15.998   0.468 -40.307
  867   2HB   ALA 118          HB2       ALA 118  17.582   0.128 -39.565
  868   3HB   ALA 118          HB3       ALA 118  16.218  -0.991 -39.317
  869    H    PHE 119           H        PHE 119  18.382   1.343 -37.159
  870    HA   PHE 119           HA       PHE 119  18.382  -0.727 -35.192
  871   1HB   PHE 119          HB2       PHE 119  20.350   0.691 -36.322
  872   2HB   PHE 119          HB3       PHE 119  20.169   1.656 -34.868
  873    HD1  PHE 119           HD1      PHE 119  21.234  -1.548 -36.319
  874    HD2  PHE 119           HD2      PHE 119  20.602   0.558 -32.613
  875    HE1  PHE 119           HE1      PHE 119  22.600  -3.237 -35.119
  876    HE2  PHE 119           HE2      PHE 119  21.985  -1.114 -31.421
  877    HZ   PHE 119           HZ       PHE 119  22.984  -3.021 -32.670
  878    H    PHE 120           H        PHE 120  17.467   2.721 -35.087
  879    HA   PHE 120           HA       PHE 120  17.103   2.934 -32.270
  880   1HB   PHE 120          HB2       PHE 120  15.989   4.411 -34.658
  881   2HB   PHE 120          HB3       PHE 120  15.148   4.578 -33.135
  882    HD1  PHE 120           HD1      PHE 120  16.290   5.465 -31.093
  883    HD2  PHE 120           HD2      PHE 120  18.088   5.629 -35.010
  884    HE1  PHE 120           HE1      PHE 120  17.933   7.146 -30.290
  885    HE2  PHE 120           HE2      PHE 120  19.755   7.254 -34.187
  886    HZ   PHE 120           HZ       PHE 120  19.668   8.028 -31.826
  887    H    GLN 121           H        GLN 121  14.630   2.048 -34.768
  888    HA   GLN 121           HA       GLN 121  12.728   1.464 -32.711
  889   1HB   GLN 121          HB2       GLN 121  11.300   0.566 -34.427
  890   2HB   GLN 121          HB3       GLN 121  12.048   2.077 -34.932
  891   1HG   GLN 121          HG2       GLN 121  13.812   0.502 -36.096
  892   2HG   GLN 121          HG3       GLN 121  12.561  -0.731 -35.949
  893   1HE2  GLN 121          HE22      GLN 121  13.373   2.506 -37.226
  894   2HE2  GLN 121          HE21      GLN 121  12.161   2.547 -38.480
  895    H    ARG 122           H        ARG 122  15.254  -0.614 -34.199
  896    HA   ARG 122           HA       ARG 122  14.329  -3.035 -32.942
  897   1HB   ARG 122          HB2       ARG 122  17.041  -2.077 -33.932
  898   2HB   ARG 122          HB3       ARG 122  16.923  -3.487 -32.900
  899   1HG   ARG 122          HG2       ARG 122  15.165  -4.396 -34.581
  900   2HG   ARG 122          HG3       ARG 122  15.726  -3.110 -35.665
  901   1HD   ARG 122          HD2       ARG 122  16.888  -5.224 -36.131
  902   2HD   ARG 122          HD3       ARG 122  18.038  -4.017 -35.519
  903    HE   ARG 122           HE       ARG 122  17.089  -5.467 -33.283
  904   1HH1  ARG 122          HH21      ARG 122  19.058  -6.207 -36.160
  905   2HH1  ARG 122          HH22      ARG 122  20.001  -7.397 -35.341
  906   1HH2  ARG 122          HH11      ARG 122  18.259  -6.896 -32.249
  907   2HH2  ARG 122          HH12      ARG 122  19.526  -7.847 -33.005
  908    H    VAL 123           H        VAL 123  16.745  -0.568 -31.763
  909    HA   VAL 123           HA       VAL 123  17.147  -2.000 -29.321
  910    HB   VAL 123           HB       VAL 123  17.692   0.874 -30.161
  911   1HG1  VAL 123          HG11      VAL 123  18.540  -0.534 -27.587
  912   2HG1  VAL 123          HG12      VAL 123  19.232   0.980 -28.200
  913   3HG1  VAL 123          HG13      VAL 123  17.534   0.926 -27.728
  914   1HG2  VAL 123          HG21      VAL 123  20.021   0.098 -30.277
  915   2HG2  VAL 123          HG22      VAL 123  19.555  -1.508 -29.689
  916   3HG2  VAL 123          HG23      VAL 123  19.015  -0.956 -31.282
  917    H    ARG 124           H        ARG 124  14.846   0.584 -30.260
  918    HA   ARG 124           HA       ARG 124  13.624   1.090 -27.784
  919   1HB   ARG 124          HB2       ARG 124  13.168   2.291 -29.911
  920   2HB   ARG 124          HB3       ARG 124  12.487   0.839 -30.603
  921   1HG   ARG 124          HG2       ARG 124  10.937   1.183 -28.313
  922   2HG   ARG 124          HG3       ARG 124  11.271   2.829 -28.837
  923   1HD   ARG 124          HD2       ARG 124   9.246   2.201 -29.869
  924   2HD   ARG 124          HD3       ARG 124  10.463   2.150 -31.151
  925    HE   ARG 124           HE       ARG 124  10.265  -0.472 -30.119
  926   1HH1  ARG 124          HH21      ARG 124   8.332   1.921 -31.805
  927   2HH1  ARG 124          HH22      ARG 124   7.381   0.782 -32.707
  928   1HH2  ARG 124          HH11      ARG 124   8.675  -2.082 -31.020
  929   2HH2  ARG 124          HH12      ARG 124   7.543  -1.486 -32.170
  930    H    ASP 125           H        ASP 125  12.729  -1.388 -30.261
  931    HA   ASP 125           HA       ASP 125  10.600  -2.418 -28.699
  932   1HB   ASP 125          HB2       ASP 125  11.005  -2.627 -31.227
  933   2HB   ASP 125          HB3       ASP 125  12.095  -3.966 -30.852
  934    H    GLU 126           H        GLU 126  13.997  -3.522 -29.077
  935    HA   GLU 126           HA       GLU 126  13.694  -5.879 -27.515
  936   1HB   GLU 126          HB2       GLU 126  16.101  -4.197 -28.289
  937   2HB   GLU 126          HB3       GLU 126  16.220  -5.711 -27.373
  938   1HG   GLU 126          HG2       GLU 126  15.171  -6.972 -29.173
  939   2HG   GLU 126          HG3       GLU 126  14.850  -5.511 -30.093
  940    H    ILE 127           H        ILE 127  14.630  -2.512 -26.600
  941    HA   ILE 127           HA       ILE 127  15.036  -3.021 -23.814
  942    HB   ILE 127           HB       ILE 127  14.209  -0.586 -25.433
  943   1HG1  ILE 127          HG12      ILE 127  16.669  -1.146 -23.726
  944   2HG1  ILE 127          HG13      ILE 127  16.605  -1.461 -25.454
  945   1HG2  ILE 127          HG21      ILE 127  13.088  -0.320 -23.234
  946   2HG2  ILE 127          HG22      ILE 127  14.644  -0.593 -22.419
  947   3HG2  ILE 127          HG23      ILE 127  14.390   0.825 -23.466
  948   1HD1  ILE 127          HD11      ILE 127  16.486   1.246 -24.074
  949   2HD1  ILE 127          HD12      ILE 127  17.701   0.636 -25.199
  950   3HD1  ILE 127          HD13      ILE 127  16.070   1.014 -25.790
  951    H    GLY 128           H        GLY 128  12.083  -2.038 -25.654
  952   1HA   GLY 128          HA1       GLY 128  10.267  -1.977 -23.564
  953   2HA   GLY 128          HA2       GLY 128   9.874  -2.434 -25.237
  954    H    ASN 129           H        ASN 129  11.255  -4.842 -25.502
  955    HA   ASN 129           HA       ASN 129   9.513  -6.694 -24.243
  956   1HB   ASN 129          HB2       ASN 129  12.169  -7.039 -25.683
  957   2HB   ASN 129          HB3       ASN 129  11.402  -8.392 -24.872
  958   1HD2  ASN 129          HD22      ASN 129  10.932  -6.014 -27.500
  959   2HD2  ASN 129          HD21      ASN 129   9.799  -6.986 -28.390
  960    H    ARG 130           H        ARG 130  12.934  -5.869 -23.422
  961    HA   ARG 130           HA       ARG 130  12.850  -7.732 -21.257
  962   1HB   ARG 130          HB2       ARG 130  14.887  -7.047 -22.548
  963   2HB   ARG 130          HB3       ARG 130  14.851  -5.481 -21.745
  964   1HG   ARG 130          HG2       ARG 130  16.480  -7.221 -20.844
  965   2HG   ARG 130          HG3       ARG 130  15.457  -6.439 -19.658
  966   1HD   ARG 130          HD2       ARG 130  15.716  -8.864 -19.229
  967   2HD   ARG 130          HD3       ARG 130  14.048  -8.316 -19.408
  968    HE   ARG 130           HE       ARG 130  13.732  -9.746 -21.115
  969   1HH1  ARG 130          HH21      ARG 130  17.275  -9.359 -20.939
  970   2HH1  ARG 130          HH22      ARG 130  17.559 -10.571 -22.134
  971   1HH2  ARG 130          HH11      ARG 130  14.058 -11.226 -22.536
  972   2HH2  ARG 130          HH12      ARG 130  15.645 -11.702 -23.119
  973    H    LEU 131           H        LEU 131  12.003  -4.278 -21.481
  974    HA   LEU 131           HA       LEU 131  11.861  -3.892 -18.648
  975   1HB   LEU 131          HB2       LEU 131  11.454  -2.242 -20.887
  976   2HB   LEU 131          HB3       LEU 131   9.863  -2.394 -20.184
  977    HG   LEU 131           HG       LEU 131  10.857  -0.497 -19.235
  978   1HD1  LEU 131          HD11      LEU 131  11.147  -2.628 -17.098
  979   2HD1  LEU 131          HD12      LEU 131  10.904  -0.910 -16.833
  980   3HD1  LEU 131          HD13      LEU 131   9.621  -1.877 -17.588
  981   1HD2  LEU 131          HD21      LEU 131  13.218  -1.098 -19.813
  982   2HD2  LEU 131          HD22      LEU 131  13.013  -0.334 -18.243
  983   3HD2  LEU 131          HD23      LEU 131  13.275  -2.080 -18.333
  984    H    LYS 132           H        LYS 132   9.511  -5.062 -21.116
  985    HA   LYS 132           HA       LYS 132   7.299  -5.357 -19.397
  986   1HB   LYS 132          HB2       LYS 132   7.218  -5.586 -21.871
  987   2HB   LYS 132          HB3       LYS 132   8.088  -7.109 -21.767
  988   1HG   LYS 132          HG2       LYS 132   6.280  -8.157 -20.526
  989   2HG   LYS 132          HG3       LYS 132   5.393  -6.616 -20.447
  990   1HD   LYS 132          HD2       LYS 132   5.243  -6.552 -22.908
  991   2HD   LYS 132          HD3       LYS 132   6.135  -8.067 -23.039
  992   1HE   LYS 132          HE2       LYS 132   3.468  -7.771 -21.572
  993   2HE   LYS 132          HE3       LYS 132   3.607  -8.205 -23.278
  994   1HZ   LYS 132          HZ1       LYS 132   4.905 -10.166 -22.582
  995   2HZ   LYS 132          HZ2       LYS 132   4.613  -9.821 -20.995
  996   3HZ   LYS 132          HZ3       LYS 132   3.385 -10.173 -22.000
  997    H    GLU 133           H        GLU 133   9.834  -7.736 -20.249
  998    HA   GLU 133           HA       GLU 133   8.824  -9.701 -18.481
  999   1HB   GLU 133          HB2       GLU 133  11.689  -9.390 -19.454
 1000   2HB   GLU 133          HB3       GLU 133  10.990 -10.828 -18.683
 1001   1HG   GLU 133          HG2       GLU 133   9.375 -11.070 -20.517
 1002   2HG   GLU 133          HG3       GLU 133  10.023  -9.642 -21.314
 1003    H    PHE 134           H        PHE 134  11.189  -7.091 -17.877
 1004    HA   PHE 134           HA       PHE 134  11.925  -7.934 -15.282
 1005   1HB   PHE 134          HB2       PHE 134  13.211  -6.264 -16.389
 1006   2HB   PHE 134          HB3       PHE 134  11.804  -5.252 -16.676
 1007    HD1  PHE 134           HD1      PHE 134  11.124  -3.582 -15.149
 1008    HD2  PHE 134           HD2      PHE 134  14.044  -6.517 -13.950
 1009    HE1  PHE 134           HE1      PHE 134  11.626  -2.237 -13.133
 1010    HE2  PHE 134           HE2      PHE 134  14.491  -5.214 -11.885
 1011    HZ   PHE 134           HZ       PHE 134  13.289  -3.076 -11.472
 1012    H    ALA 135           H        ALA 135   9.095  -6.139 -16.432
 1013    HA   ALA 135           HA       ALA 135   8.262  -5.475 -13.736
 1014   1HB   ALA 135          HB1       ALA 135   6.309  -4.473 -14.867
 1015   2HB   ALA 135          HB2       ALA 135   7.799  -4.005 -15.717
 1016   3HB   ALA 135          HB3       ALA 135   6.753  -5.271 -16.389
 1017    H    GLU 136           H        GLU 136   7.439  -7.863 -16.196
 1018    HA   GLU 136           HA       GLU 136   5.095  -8.820 -14.779
 1019   1HB   GLU 136          HB2       GLU 136   5.014  -8.496 -17.163
 1020   2HB   GLU 136          HB3       GLU 136   6.444  -9.513 -17.410
 1021   1HG   GLU 136          HG2       GLU 136   5.262 -11.505 -16.770
 1022   2HG   GLU 136          HG3       GLU 136   3.855 -10.569 -16.242
 1023    H    THR 137           H        THR 137   8.326 -10.022 -15.590
 1024    HA   THR 137           HA       THR 137   7.731 -12.584 -14.224
 1025    HB   THR 137           HB       THR 137   9.211 -13.681 -15.717
 1026    HG1  THR 137           HG1      THR 137   9.886 -11.071 -16.522
 1027   1HG2  THR 137          HG21      THR 137   8.114 -13.423 -17.841
 1028   2HG2  THR 137          HG22      THR 137   6.894 -13.227 -16.568
 1029   3HG2  THR 137          HG23      THR 137   7.540 -11.799 -17.427
 1030    H    GLY 138           H        GLY 138   9.815  -9.773 -14.178
 1031   1HA   GLY 138          HA1       GLY 138  11.227  -9.099 -12.479
 1032   2HA   GLY 138          HA2       GLY 138  11.133 -10.696 -11.733
 1033    H    LYS 139           H        LYS 139  11.895 -10.683 -15.168
 1034    HA   LYS 139           HA       LYS 139  14.423 -11.935 -14.551
 1035   1HB   LYS 139          HB2       LYS 139  13.009 -11.344 -17.172
 1036   2HB   LYS 139          HB3       LYS 139  14.566 -12.171 -17.061
 1037   1HG   LYS 139          HG2       LYS 139  11.993 -13.136 -15.759
 1038   2HG   LYS 139          HG3       LYS 139  12.651 -13.738 -17.287
 1039   1HD   LYS 139          HD2       LYS 139  14.682 -14.503 -15.984
 1040   2HD   LYS 139          HD3       LYS 139  13.840 -13.988 -14.494
 1041   1HE   LYS 139          HE2       LYS 139  11.955 -15.478 -15.015
 1042   2HE   LYS 139          HE3       LYS 139  12.762 -16.013 -16.496
 1043   1HZ   LYS 139          HZ1       LYS 139  13.103 -17.580 -14.694
 1044   2HZ   LYS 139          HZ2       LYS 139  14.536 -16.935 -15.118
 1045   3HZ   LYS 139          HZ3       LYS 139  13.788 -16.446 -13.748
  Start of MODEL   13
    1   1H    MET   1           H1       MET   1   0.250   1.716   2.177
    2   2H    MET   1           H2       MET   1   1.841   1.330   2.179
    3   3H    MET   1           H3       MET   1   1.363   2.784   2.746
    4    HA   MET   1           HA       MET   1   1.157   1.874  -0.040
    5   1HB   MET   1          HB2       MET   1   0.411   4.557   1.211
    6   2HB   MET   1          HB3       MET   1   0.624   4.301  -0.516
    7   1HG   MET   1          HG2       MET   1  -1.438   2.944   1.255
    8   2HG   MET   1          HG3       MET   1  -1.735   4.214   0.081
    9   1HE   MET   1          HE1       MET   1  -1.423   2.441  -3.364
   10   2HE   MET   1          HE2       MET   1  -1.864   3.923  -2.491
   11   3HE   MET   1          HE3       MET   1  -0.165   3.397  -2.558
   12    H    GLU   2           H        GLU   2   2.829   2.473  -1.420
   13    HA   GLU   2           HA       GLU   2   4.884   4.340  -0.605
   14   1HB   GLU   2          HB2       GLU   2   6.748   2.810  -0.745
   15   2HB   GLU   2          HB3       GLU   2   5.646   2.241   0.502
   16   1HG   GLU   2          HG2       GLU   2   4.706   0.584  -1.179
   17   2HG   GLU   2          HG3       GLU   2   5.957   1.098  -2.313
   18    H    ASN   3           H        ASN   3   6.590   4.345  -2.513
   19    HA   ASN   3           HA       ASN   3   5.524   3.429  -5.095
   20   1HB   ASN   3          HB2       ASN   3   4.776   5.881  -4.636
   21   2HB   ASN   3          HB3       ASN   3   6.497   6.299  -4.764
   22   1HD2  ASN   3          HD22      ASN   3   7.605   5.693  -6.887
   23   2HD2  ASN   3          HD21      ASN   3   6.573   5.767  -8.310
   24    H    LYS   4           H        LYS   4   7.284   2.766  -6.355
   25    HA   LYS   4           HA       LYS   4   9.875   2.660  -4.935
   26   1HB   LYS   4          HB2       LYS   4   8.798   1.298  -7.441
   27   2HB   LYS   4          HB3       LYS   4  10.433   1.068  -6.801
   28   1HG   LYS   4          HG2       LYS   4   9.328   0.405  -4.575
   29   2HG   LYS   4          HG3       LYS   4   7.785   0.397  -5.428
   30   1HD   LYS   4          HD2       LYS   4   8.695  -1.852  -5.200
   31   2HD   LYS   4          HD3       LYS   4   8.595  -1.402  -6.914
   32   1HE   LYS   4          HE2       LYS   4  10.964  -0.933  -7.016
   33   2HE   LYS   4          HE3       LYS   4  11.124  -1.018  -5.258
   34   1HZ   LYS   4          HZ1       LYS   4  10.566  -3.307  -7.043
   35   2HZ   LYS   4          HZ2       LYS   4  11.994  -2.941  -6.301
   36   3HZ   LYS   4          HZ3       LYS   4  10.693  -3.400  -5.406
   37    H    ILE   5           H        ILE   5  11.788   2.651  -6.836
   38    HA   ILE   5           HA       ILE   5  11.615   5.098  -8.451
   39    HB   ILE   5           HB       ILE   5  13.817   4.608  -6.424
   40   1HG1  ILE   5          HG12      ILE   5  12.889   6.886  -5.405
   41   2HG1  ILE   5          HG13      ILE   5  11.355   6.262  -5.981
   42   1HG2  ILE   5          HG21      ILE   5  13.189   7.060  -8.116
   43   2HG2  ILE   5          HG22      ILE   5  14.529   6.930  -6.959
   44   3HG2  ILE   5          HG23      ILE   5  14.517   5.928  -8.403
   45   1HD1  ILE   5          HD11      ILE   5  11.825   4.146  -4.615
   46   2HD1  ILE   5          HD12      ILE   5  13.341   4.883  -4.107
   47   3HD1  ILE   5          HD13      ILE   5  11.799   5.623  -3.633
   48    H    ILE   6           H        ILE   6  13.141   4.898 -10.250
   49    HA   ILE   6           HA       ILE   6  15.111   2.740 -10.190
   50    HB   ILE   6           HB       ILE   6  13.170   1.511 -10.916
   51   1HG1  ILE   6          HG12      ILE   6  14.912   1.986 -13.363
   52   2HG1  ILE   6          HG13      ILE   6  15.413   1.055 -11.946
   53   1HG2  ILE   6          HG21      ILE   6  12.870   3.461 -13.230
   54   2HG2  ILE   6          HG22      ILE   6  11.868   2.036 -12.918
   55   3HG2  ILE   6          HG23      ILE   6  11.792   3.399 -11.816
   56   1HD1  ILE   6          HD11      ILE   6  14.652  -0.453 -13.663
   57   2HD1  ILE   6          HD12      ILE   6  13.505  -0.496 -12.305
   58   3HD1  ILE   6          HD13      ILE   6  13.102   0.387 -13.801
   59    H    TYR   7           H        TYR   7  16.733   3.017 -11.866
   60    HA   TYR   7           HA       TYR   7  16.646   5.640 -13.253
   61   1HB   TYR   7          HB2       TYR   7  17.846   5.401 -10.897
   62   2HB   TYR   7          HB3       TYR   7  19.091   4.583 -11.805
   63    HD1  TYR   7           HD1      TYR   7  20.409   6.334 -10.552
   64    HD2  TYR   7           HD2      TYR   7  17.632   7.404 -13.678
   65    HE1  TYR   7           HE1      TYR   7  21.343   8.636 -10.614
   66    HE2  TYR   7           HE2      TYR   7  18.518   9.686 -13.697
   67    HH   TYR   7           HH       TYR   7  19.968  11.206 -12.679
   68    H    PHE   8           H        PHE   8  17.544   5.589 -15.279
   69    HA   PHE   8           HA       PHE   8  18.940   3.101 -16.202
   70   1HB   PHE   8          HB2       PHE   8  17.083   4.947 -17.763
   71   2HB   PHE   8          HB3       PHE   8  17.958   3.575 -18.420
   72    HD1  PHE   8           HD1      PHE   8  17.397   1.213 -17.581
   73    HD2  PHE   8           HD2      PHE   8  14.933   4.648 -16.744
   74    HE1  PHE   8           HE1      PHE   8  15.521  -0.286 -16.995
   75    HE2  PHE   8           HE2      PHE   8  13.051   3.128 -16.188
   76    HZ   PHE   8           HZ       PHE   8  13.355   0.673 -16.252
   77    H    LEU   9           H        LEU   9  20.990   3.484 -16.889
   78    HA   LEU   9           HA       LEU   9  21.880   6.312 -17.256
   79   1HB   LEU   9          HB2       LEU   9  22.926   3.952 -15.715
   80   2HB   LEU   9          HB3       LEU   9  24.098   5.024 -16.460
   81    HG   LEU   9           HG       LEU   9  23.377   6.919 -15.221
   82   1HD1  LEU   9          HD11      LEU   9  21.124   5.212 -14.095
   83   2HD1  LEU   9          HD12      LEU   9  21.642   6.781 -13.439
   84   3HD1  LEU   9          HD13      LEU   9  20.978   6.704 -15.058
   85   1HD2  LEU   9          HD21      LEU   9  23.892   6.168 -12.929
   86   2HD2  LEU   9          HD22      LEU   9  23.534   4.491 -13.395
   87   3HD2  LEU   9          HD23      LEU   9  24.919   5.334 -14.098
   88    H    CYS  10           H        CYS  10  23.216   6.781 -18.974
   89    HA   CYS  10           HA       CYS  10  24.293   4.556 -20.643
   90   1HB   CYS  10          HB2       CYS  10  22.537   6.884 -21.556
   91   2HB   CYS  10          HB3       CYS  10  23.562   5.990 -22.676
   92    HG   CYS  10           HG       CYS  10  21.844   4.230 -20.580
   93    H    THR  11           H        THR  11  25.742   5.395 -22.337
   94    HA   THR  11           HA       THR  11  27.672   7.315 -21.398
   95    HB   THR  11           HB       THR  11  28.755   6.560 -23.589
   96    HG1  THR  11           HG1      THR  11  27.659   4.508 -24.329
   97   1HG2  THR  11          HG21      THR  11  29.184   5.407 -21.398
   98   2HG2  THR  11          HG22      THR  11  27.838   4.301 -21.737
   99   3HG2  THR  11          HG23      THR  11  29.252   4.306 -22.799
  100    H    GLY  12           H        GLY  12  25.085   8.442 -21.724
  101   1HA   GLY  12          HA1       GLY  12  25.040  10.821 -22.813
  102   2HA   GLY  12          HA2       GLY  12  24.934   9.877 -24.313
  103    H    ASN  13           H        ASN  13  23.124  11.257 -21.788
  104    HA   ASN  13           HA       ASN  13  20.962   9.338 -21.645
  105   1HB   ASN  13          HB2       ASN  13  21.609  10.941 -19.809
  106   2HB   ASN  13          HB3       ASN  13  21.022  12.261 -20.817
  107   1HD2  ASN  13          HD22      ASN  13  19.287   9.014 -20.495
  108   2HD2  ASN  13          HD21      ASN  13  17.908   9.762 -19.714
  109    H    SER  14           H        SER  14  21.097   9.511 -24.275
  110    HA   SER  14           HA       SER  14  19.019  11.511 -25.096
  111   1HB   SER  14          HB2       SER  14  21.558  10.719 -26.555
  112   2HB   SER  14          HB3       SER  14  20.304  11.811 -27.176
  113    HG   SER  14           HG       SER  14  20.696  13.223 -25.546
  114    H    CYS  15           H        CYS  15  19.912   8.153 -25.215
  115    HA   CYS  15           HA       CYS  15  17.803   7.707 -27.283
  116   1HB   CYS  15          HB2       CYS  15  20.550   6.378 -27.292
  117   2HB   CYS  15          HB3       CYS  15  19.261   6.176 -28.482
  118    HG   CYS  15           HG       CYS  15  21.462   7.515 -29.201
  119    H    ARG  16           H        ARG  16  20.047   5.368 -25.822
  120    HA   ARG  16           HA       ARG  16  18.048   3.436 -25.453
  121   1HB   ARG  16          HB2       ARG  16  20.752   3.856 -24.162
  122   2HB   ARG  16          HB3       ARG  16  19.816   2.405 -23.869
  123   1HG   ARG  16          HG2       ARG  16  20.073   1.613 -26.061
  124   2HG   ARG  16          HG3       ARG  16  20.547   3.191 -26.700
  125   1HD   ARG  16          HD2       ARG  16  22.199   1.640 -24.654
  126   2HD   ARG  16          HD3       ARG  16  22.471   1.563 -26.405
  127    HE   ARG  16           HE       ARG  16  22.493   4.243 -26.008
  128   1HH1  ARG  16          HH21      ARG  16  24.362   1.731 -24.290
  129   2HH1  ARG  16          HH22      ARG  16  25.824   2.715 -24.380
  130   1HH2  ARG  16          HH11      ARG  16  24.145   5.508 -25.748
  131   2HH2  ARG  16          HH12      ARG  16  25.588   5.038 -24.858
  132    H    SER  17           H        SER  17  19.533   5.496 -22.825
  133    HA   SER  17           HA       SER  17  17.846   4.370 -20.827
  134   1HB   SER  17          HB2       SER  17  18.653   6.362 -19.495
  135   2HB   SER  17          HB3       SER  17  19.875   5.308 -20.143
  136    HG   SER  17           HG       SER  17  20.663   7.119 -20.867
  137    H    GLN  18           H        GLN  18  17.437   7.183 -22.940
  138    HA   GLN  18           HA       GLN  18  15.150   8.329 -21.681
  139   1HB   GLN  18          HB2       GLN  18  16.487   8.441 -24.393
  140   2HB   GLN  18          HB3       GLN  18  14.850   9.039 -24.281
  141   1HG   GLN  18          HG2       GLN  18  17.090   9.980 -22.445
  142   2HG   GLN  18          HG3       GLN  18  16.674  10.769 -23.963
  143   1HE2  GLN  18          HE22      GLN  18  16.448  12.476 -21.878
  144   2HE2  GLN  18          HE21      GLN  18  14.788  12.569 -21.280
  145    H    MET  19           H        MET  19  15.357   6.161 -24.512
  146    HA   MET  19           HA       MET  19  12.607   5.575 -24.726
  147   1HB   MET  19          HB2       MET  19  14.992   3.805 -25.433
  148   2HB   MET  19          HB3       MET  19  13.320   3.518 -25.925
  149   1HG   MET  19          HG2       MET  19  13.401   5.898 -26.949
  150   2HG   MET  19          HG3       MET  19  15.151   5.772 -26.796
  151   1HE   MET  19          HE1       MET  19  15.616   2.596 -27.492
  152   2HE   MET  19          HE2       MET  19  15.966   2.767 -29.223
  153   3HE   MET  19          HE3       MET  19  16.642   3.938 -28.062
  154    H    ALA  20           H        ALA  20  15.113   3.852 -22.760
  155    HA   ALA  20           HA       ALA  20  13.407   1.786 -21.851
  156   1HB   ALA  20          HB1       ALA  20  15.786   3.053 -20.418
  157   2HB   ALA  20          HB2       ALA  20  15.066   1.470 -20.063
  158   3HB   ALA  20          HB3       ALA  20  15.873   1.743 -21.621
  159    H    GLU  21           H        GLU  21  14.124   4.953 -20.314
  160    HA   GLU  21           HA       GLU  21  12.390   4.658 -18.123
  161   1HB   GLU  21          HB2       GLU  21  14.045   6.487 -18.500
  162   2HB   GLU  21          HB3       GLU  21  12.951   7.198 -19.685
  163   1HG   GLU  21          HG2       GLU  21  11.208   7.261 -17.758
  164   2HG   GLU  21          HG3       GLU  21  12.561   6.859 -16.700
  165    H    GLY  22           H        GLY  22  11.600   5.637 -21.507
  166   1HA   GLY  22          HA1       GLY  22   8.883   6.357 -21.098
  167   2HA   GLY  22          HA2       GLY  22   9.627   5.779 -22.615
  168    H    TRP  23           H        TRP  23  10.345   3.216 -22.122
  169    HA   TRP  23           HA       TRP  23   7.855   1.785 -22.205
  170   1HB   TRP  23          HB2       TRP  23  10.750   0.912 -21.844
  171   2HB   TRP  23          HB3       TRP  23   9.415  -0.227 -21.865
  172    HD1  TRP  23           HD1      TRP  23  11.697   1.556 -24.171
  173    HE1  TRP  23           HE1      TRP  23  11.089   1.083 -26.590
  174    HE3  TRP  23           HE3      TRP  23   7.070  -0.493 -23.432
  175    HZ2  TRP  23           HZ2      TRP  23   8.820  -0.054 -28.066
  176    HZ3  TRP  23           HZ3      TRP  23   5.763  -1.368 -25.344
  177    HH2  TRP  23           HH2      TRP  23   6.653  -1.195 -27.655
  178    H    ALA  24           H        ALA  24  10.311   2.208 -19.629
  179    HA   ALA  24           HA       ALA  24   9.166   0.434 -17.775
  180   1HB   ALA  24          HB1       ALA  24  11.461   1.330 -17.625
  181   2HB   ALA  24          HB2       ALA  24  10.825   2.945 -17.327
  182   3HB   ALA  24          HB3       ALA  24  10.575   1.649 -16.127
  183    H    LYS  25           H        LYS  25   8.589   3.980 -18.204
  184    HA   LYS  25           HA       LYS  25   6.830   4.281 -16.042
  185   1HB   LYS  25          HB2       LYS  25   7.813   6.062 -17.571
  186   2HB   LYS  25          HB3       LYS  25   6.563   5.653 -18.750
  187   1HG   LYS  25          HG2       LYS  25   4.813   6.281 -17.081
  188   2HG   LYS  25          HG3       LYS  25   6.089   6.631 -15.895
  189   1HD   LYS  25          HD2       LYS  25   7.009   8.381 -17.453
  190   2HD   LYS  25          HD3       LYS  25   5.705   8.019 -18.583
  191   1HE   LYS  25          HE2       LYS  25   5.052   9.977 -17.421
  192   2HE   LYS  25          HE3       LYS  25   4.033   8.670 -16.814
  193   1HZ   LYS  25          HZ1       LYS  25   5.382   8.594 -14.811
  194   2HZ   LYS  25          HZ2       LYS  25   6.445   9.700 -15.422
  195   3HZ   LYS  25          HZ3       LYS  25   4.915  10.132 -15.069
  196    H    GLN  26           H        GLN  26   6.154   2.866 -19.227
  197    HA   GLN  26           HA       GLN  26   3.320   2.703 -18.737
  198   1HB   GLN  26          HB2       GLN  26   4.762   0.856 -20.654
  199   2HB   GLN  26          HB3       GLN  26   3.094   1.402 -20.672
  200   1HG   GLN  26          HG2       GLN  26   5.592   2.839 -21.511
  201   2HG   GLN  26          HG3       GLN  26   4.137   2.517 -22.432
  202   1HE2  GLN  26          HE22      GLN  26   5.843   4.973 -21.041
  203   2HE2  GLN  26          HE21      GLN  26   4.535   6.117 -20.761
  204    H    TYR  27           H        TYR  27   5.838   0.139 -18.818
  205    HA   TYR  27           HA       TYR  27   4.032  -1.867 -17.931
  206   1HB   TYR  27          HB2       TYR  27   7.073  -1.828 -17.818
  207   2HB   TYR  27          HB3       TYR  27   6.071  -3.242 -17.541
  208    HD1  TYR  27           HD1      TYR  27   7.941  -1.577 -19.972
  209    HD2  TYR  27           HD2      TYR  27   4.274  -3.775 -19.474
  210    HE1  TYR  27           HE1      TYR  27   8.091  -2.334 -22.324
  211    HE2  TYR  27           HE2      TYR  27   4.316  -4.398 -21.873
  212    HH   TYR  27           HH       TYR  27   7.003  -3.465 -24.060
  213    H    LEU  28           H        LEU  28   6.365   0.108 -16.091
  214    HA   LEU  28           HA       LEU  28   5.819  -1.217 -13.559
  215   1HB   LEU  28          HB2       LEU  28   7.142   1.471 -14.093
  216   2HB   LEU  28          HB3       LEU  28   7.198   0.557 -12.616
  217    HG   LEU  28           HG       LEU  28   8.467  -0.299 -15.240
  218   1HD1  LEU  28          HD11      LEU  28   9.746   0.522 -12.607
  219   2HD1  LEU  28          HD12      LEU  28  10.572   0.109 -14.122
  220   3HD1  LEU  28          HD13      LEU  28   9.576   1.577 -14.021
  221   1HD2  LEU  28          HD21      LEU  28   7.718  -2.292 -13.978
  222   2HD2  LEU  28          HD22      LEU  28   9.470  -2.156 -14.024
  223   3HD2  LEU  28          HD23      LEU  28   8.589  -1.706 -12.546
  224    H    GLY  29           H        GLY  29   3.808   0.687 -15.364
  225   1HA   GLY  29          HA1       GLY  29   1.813   1.635 -14.945
  226   2HA   GLY  29          HA2       GLY  29   1.854   0.810 -13.374
  227    H    ASP  30           H        ASP  30   4.279   3.170 -14.227
  228    HA   ASP  30           HA       ASP  30   5.095   4.943 -13.156
  229   1HB   ASP  30          HB2       ASP  30   3.155   5.905 -14.393
  230   2HB   ASP  30          HB3       ASP  30   2.222   5.868 -12.894
  231    H    GLU  31           H        GLU  31   3.961   2.562 -11.450
  232    HA   GLU  31           HA       GLU  31   3.671   3.716  -8.799
  233   1HB   GLU  31          HB2       GLU  31   4.226   0.827  -9.604
  234   2HB   GLU  31          HB3       GLU  31   3.704   1.410  -8.023
  235   1HG   GLU  31          HG2       GLU  31   1.590   2.275  -9.126
  236   2HG   GLU  31          HG3       GLU  31   2.099   1.442 -10.602
  237    H    TRP  32           H        TRP  32   6.217   3.662 -10.800
  238    HA   TRP  32           HA       TRP  32   8.234   3.523  -8.650
  239   1HB   TRP  32          HB2       TRP  32   8.579   2.591 -11.527
  240   2HB   TRP  32          HB3       TRP  32   9.837   2.672 -10.312
  241    HD1  TRP  32           HD1      TRP  32   6.376   0.865 -10.418
  242    HE1  TRP  32           HE1      TRP  32   6.711  -1.597  -9.887
  243    HE3  TRP  32           HE3      TRP  32  11.454   0.856  -9.687
  244    HZ2  TRP  32           HZ2      TRP  32   8.898  -3.414  -9.634
  245    HZ3  TRP  32           HZ3      TRP  32  12.656  -1.298  -9.460
  246    HH2  TRP  32           HH2      TRP  32  11.392  -3.454  -9.511
  247    H    LYS  33           H        LYS  33   9.240   5.493  -8.563
  248    HA   LYS  33           HA       LYS  33   8.807   7.630 -10.441
  249   1HB   LYS  33          HB2       LYS  33  10.846   7.269  -8.191
  250   2HB   LYS  33          HB3       LYS  33  10.607   8.757  -9.100
  251   1HG   LYS  33          HG2       LYS  33   8.687   7.429  -7.165
  252   2HG   LYS  33          HG3       LYS  33   9.564   8.923  -6.934
  253   1HD   LYS  33          HD2       LYS  33   7.307   8.489  -8.944
  254   2HD   LYS  33          HD3       LYS  33   7.196   9.328  -7.396
  255   1HE   LYS  33          HE2       LYS  33   8.879  10.998  -8.175
  256   2HE   LYS  33          HE3       LYS  33   8.940  10.196  -9.748
  257   1HZ   LYS  33          HZ1       LYS  33   6.582  10.734 -10.031
  258   2HZ   LYS  33          HZ2       LYS  33   6.539  11.481  -8.575
  259   3HZ   LYS  33          HZ3       LYS  33   7.449  12.089  -9.779
  260    H    VAL  34           H        VAL  34   9.374   6.767 -12.442
  261    HA   VAL  34           HA       VAL  34  11.897   5.555 -12.946
  262    HB   VAL  34           HB       VAL  34  10.442   6.886 -15.195
  263   1HG1  VAL  34          HG11      VAL  34  10.900   4.870 -16.315
  264   2HG1  VAL  34          HG12      VAL  34  12.341   5.156 -15.320
  265   3HG1  VAL  34          HG13      VAL  34  11.138   3.954 -14.810
  266   1HG2  VAL  34          HG21      VAL  34   8.681   5.185 -15.345
  267   2HG2  VAL  34          HG22      VAL  34   9.061   4.611 -13.711
  268   3HG2  VAL  34          HG23      VAL  34   8.419   6.255 -13.975
  269    H    TYR  35           H        TYR  35  13.769   6.490 -13.730
  270    HA   TYR  35           HA       TYR  35  13.810   9.309 -14.630
  271   1HB   TYR  35          HB2       TYR  35  15.615   8.102 -12.484
  272   2HB   TYR  35          HB3       TYR  35  15.923   9.630 -13.287
  273    HD1  TYR  35           HD1      TYR  35  14.379  11.596 -12.936
  274    HD2  TYR  35           HD2      TYR  35  14.128   7.976 -10.600
  275    HE1  TYR  35           HE1      TYR  35  13.156  12.829 -11.169
  276    HE2  TYR  35           HE2      TYR  35  12.941   9.204  -8.814
  277    HH   TYR  35           HH       TYR  35  12.081  11.262  -8.114
  278    H    SER  36           H        SER  36  15.860   9.745 -15.841
  279    HA   SER  36           HA       SER  36  17.573   7.444 -16.344
  280   1HB   SER  36          HB2       SER  36  17.627   7.854 -18.752
  281   2HB   SER  36          HB3       SER  36  16.047   7.278 -18.222
  282    HG   SER  36           HG       SER  36  15.219   9.280 -18.481
  283    H    ALA  37           H        ALA  37  19.667   8.097 -17.182
  284    HA   ALA  37           HA       ALA  37  20.357  10.896 -17.350
  285   1HB   ALA  37          HB1       ALA  37  21.340   9.288 -14.946
  286   2HB   ALA  37          HB2       ALA  37  21.898  10.908 -15.428
  287   3HB   ALA  37          HB3       ALA  37  20.245  10.697 -14.907
  288    H    GLY  38           H        GLY  38  23.079  10.773 -17.038
  289   1HA   GLY  38          HA1       GLY  38  24.358   8.406 -17.882
  290   2HA   GLY  38          HA2       GLY  38  24.060   9.438 -19.298
  291    H    ILE  39           H        ILE  39  26.562   9.074 -18.977
  292    HA   ILE  39           HA       ILE  39  28.056  10.779 -17.246
  293    HB   ILE  39           HB       ILE  39  28.454   9.195 -19.753
  294   1HG1  ILE  39          HG12      ILE  39  30.268   9.528 -17.327
  295   2HG1  ILE  39          HG13      ILE  39  28.847   8.497 -17.304
  296   1HG2  ILE  39          HG21      ILE  39  30.462  11.349 -19.036
  297   2HG2  ILE  39          HG22      ILE  39  30.717  10.035 -20.208
  298   3HG2  ILE  39          HG23      ILE  39  29.491  11.251 -20.529
  299   1HD1  ILE  39          HD11      ILE  39  29.761   7.167 -19.201
  300   2HD1  ILE  39          HD12      ILE  39  31.248   8.149 -19.149
  301   3HD1  ILE  39          HD13      ILE  39  30.808   7.142 -17.770
  302    H    GLU  40           H        GLU  40  26.078  11.519 -20.050
  303    HA   GLU  40           HA       GLU  40  26.471  14.311 -19.563
  304   1HB   GLU  40          HB2       GLU  40  26.866  14.964 -21.855
  305   2HB   GLU  40          HB3       GLU  40  28.219  14.019 -21.242
  306   1HG   GLU  40          HG2       GLU  40  27.502  12.040 -22.489
  307   2HG   GLU  40          HG3       GLU  40  25.988  12.824 -22.949
  308    H    ALA  41           H        ALA  41  24.799  15.535 -20.857
  309    HA   ALA  41           HA       ALA  41  22.640  13.984 -22.060
  310   1HB   ALA  41          HB1       ALA  41  21.871  14.139 -19.738
  311   2HB   ALA  41          HB2       ALA  41  22.256  15.875 -19.679
  312   3HB   ALA  41          HB3       ALA  41  20.948  15.298 -20.722
  313    H    HIS  42           H        HIS  42  22.014  15.107 -23.838
  314    HA   HIS  42           HA       HIS  42  22.364  18.048 -23.945
  315   1HB   HIS  42          HB2       HIS  42  23.430  16.023 -25.956
  316   2HB   HIS  42          HB3       HIS  42  23.143  17.714 -26.363
  317    HD1  HIS  42           HD1      HIS  42  25.912  15.625 -24.909
  318    HD2  HIS  42           HD2      HIS  42  24.450  19.589 -24.699
  319    HE1  HIS  42           HE1      HIS  42  27.761  17.025 -23.917
  320    H    GLY  43           H        GLY  43  20.159  16.067 -23.448
  321   1HA   GLY  43          HA1       GLY  43  17.855  16.412 -23.853
  322   2HA   GLY  43          HA2       GLY  43  18.211  17.120 -25.434
  323    H    LEU  44           H        LEU  44  16.327  15.213 -25.356
  324    HA   LEU  44           HA       LEU  44  17.508  12.604 -25.913
  325   1HB   LEU  44          HB2       LEU  44  15.343  11.730 -25.966
  326   2HB   LEU  44          HB3       LEU  44  15.427  12.822 -24.592
  327    HG   LEU  44           HG       LEU  44  14.020  13.319 -27.251
  328   1HD1  LEU  44          HD11      LEU  44  13.003  11.698 -25.667
  329   2HD1  LEU  44          HD12      LEU  44  12.997  12.927 -24.396
  330   3HD1  LEU  44          HD13      LEU  44  12.001  13.149 -25.849
  331   1HD2  LEU  44          HD21      LEU  44  13.014  15.328 -26.123
  332   2HD2  LEU  44          HD22      LEU  44  14.179  15.143 -24.799
  333   3HD2  LEU  44          HD23      LEU  44  14.727  15.527 -26.458
  334    H    ASN  45           H        ASN  45  17.311  11.495 -27.882
  335    HA   ASN  45           HA       ASN  45  17.899  13.164 -30.160
  336   1HB   ASN  45          HB2       ASN  45  18.975  10.980 -29.551
  337   2HB   ASN  45          HB3       ASN  45  17.481  10.147 -29.956
  338   1HD2  ASN  45          HD22      ASN  45  20.412  10.467 -31.135
  339   2HD2  ASN  45          HD21      ASN  45  20.097  10.611 -32.849
  340    HA   PRO  46           HA       PRO  46  13.619  13.450 -31.665
  341   1HB   PRO  46          HB2       PRO  46  15.029  13.481 -34.341
  342   2HB   PRO  46          HB3       PRO  46  13.661  14.495 -33.780
  343   1HG   PRO  46          HG2       PRO  46  16.178  15.494 -33.780
  344   2HG   PRO  46          HG3       PRO  46  15.102  15.786 -32.374
  345   1HD   PRO  46          HD2       PRO  46  17.329  13.762 -32.650
  346   2HD   PRO  46          HD3       PRO  46  16.903  14.802 -31.256
  347    H    ASN  47           H        ASN  47  15.943  11.068 -33.017
  348    HA   ASN  47           HA       ASN  47  13.855   9.450 -34.255
  349   1HB   ASN  47          HB2       ASN  47  16.773   8.934 -33.624
  350   2HB   ASN  47          HB3       ASN  47  15.710   7.690 -34.271
  351   1HD2  ASN  47          HD22      ASN  47  18.139   9.040 -35.482
  352   2HD2  ASN  47          HD21      ASN  47  17.569   9.587 -37.036
  353    H    ALA  48           H        ALA  48  15.301   9.693 -31.035
  354    HA   ALA  48           HA       ALA  48  14.297   7.185 -30.048
  355   1HB   ALA  48          HB1       ALA  48  14.780   9.713 -28.402
  356   2HB   ALA  48          HB2       ALA  48  14.801   8.032 -27.864
  357   3HB   ALA  48          HB3       ALA  48  16.094   8.648 -28.909
  358    H    VAL  49           H        VAL  49  13.107  10.592 -30.103
  359    HA   VAL  49           HA       VAL  49  10.618  10.090 -28.868
  360    HB   VAL  49           HB       VAL  49  11.207  12.186 -31.007
  361   1HG1  VAL  49          HG11      VAL  49   9.391  13.457 -29.898
  362   2HG1  VAL  49          HG12      VAL  49   8.793  11.944 -30.579
  363   3HG1  VAL  49          HG13      VAL  49   9.071  12.075 -28.830
  364   1HG2  VAL  49          HG21      VAL  49  11.495  12.327 -27.981
  365   2HG2  VAL  49          HG22      VAL  49  12.822  12.403 -29.160
  366   3HG2  VAL  49          HG23      VAL  49  11.638  13.705 -29.089
  367    H    LYS  50           H        LYS  50  11.450  10.041 -32.425
  368    HA   LYS  50           HA       LYS  50   8.877   9.188 -33.229
  369   1HB   LYS  50          HB2       LYS  50  11.616   9.110 -34.462
  370   2HB   LYS  50          HB3       LYS  50  10.505   7.915 -35.066
  371   1HG   LYS  50          HG2       LYS  50  10.119  10.913 -35.152
  372   2HG   LYS  50          HG3       LYS  50  10.423   9.820 -36.494
  373   1HD   LYS  50          HD2       LYS  50   7.885  10.249 -34.927
  374   2HD   LYS  50          HD3       LYS  50   8.130  10.343 -36.654
  375   1HE   LYS  50          HE2       LYS  50   8.095   7.769 -34.998
  376   2HE   LYS  50          HE3       LYS  50   6.749   8.402 -35.930
  377   1HZ   LYS  50          HZ1       LYS  50   7.972   8.033 -37.940
  378   2HZ   LYS  50          HZ2       LYS  50   9.317   7.549 -37.132
  379   3HZ   LYS  50          HZ3       LYS  50   7.948   6.648 -37.055
  380    H    ALA  51           H        ALA  51  11.675   7.182 -32.171
  381    HA   ALA  51           HA       ALA  51  10.529   4.700 -32.823
  382   1HB   ALA  51          HB1       ALA  51  12.416   5.392 -30.524
  383   2HB   ALA  51          HB2       ALA  51  12.156   3.780 -31.212
  384   3HB   ALA  51          HB3       ALA  51  12.907   5.049 -32.192
  385    H    MET  52           H        MET  52  10.253   6.628 -29.786
  386    HA   MET  52           HA       MET  52   8.538   4.681 -28.528
  387   1HB   MET  52          HB2       MET  52   8.965   7.638 -27.918
  388   2HB   MET  52          HB3       MET  52   8.109   6.494 -26.887
  389   1HG   MET  52          HG2       MET  52  11.048   6.551 -27.578
  390   2HG   MET  52          HG3       MET  52  10.289   6.670 -26.003
  391   1HE   MET  52          HE1       MET  52   8.965   4.710 -24.917
  392   2HE   MET  52          HE2       MET  52   8.188   4.043 -26.387
  393   3HE   MET  52          HE3       MET  52   9.136   3.000 -25.323
  394    H    LYS  53           H        LYS  53   7.839   7.656 -30.451
  395    HA   LYS  53           HA       LYS  53   5.023   7.468 -30.115
  396   1HB   LYS  53          HB2       LYS  53   6.738   8.576 -32.348
  397   2HB   LYS  53          HB3       LYS  53   4.990   8.763 -32.323
  398   1HG   LYS  53          HG2       LYS  53   6.480   9.626 -29.841
  399   2HG   LYS  53          HG3       LYS  53   6.704  10.595 -31.297
  400   1HD   LYS  53          HD2       LYS  53   4.961  11.569 -29.973
  401   2HD   LYS  53          HD3       LYS  53   4.266  10.943 -31.473
  402   1HE   LYS  53          HE2       LYS  53   3.459   8.930 -30.247
  403   2HE   LYS  53          HE3       LYS  53   4.181   9.553 -28.755
  404   1HZ   LYS  53          HZ1       LYS  53   2.657  11.446 -28.901
  405   2HZ   LYS  53          HZ2       LYS  53   1.992  10.861 -30.273
  406   3HZ   LYS  53          HZ3       LYS  53   1.819  10.051 -28.872
  407    H    GLU  54           H        GLU  54   7.232   5.559 -32.087
  408    HA   GLU  54           HA       GLU  54   5.281   4.602 -33.915
  409   1HB   GLU  54          HB2       GLU  54   7.955   4.572 -33.927
  410   2HB   GLU  54          HB3       GLU  54   7.731   3.012 -33.159
  411   1HG   GLU  54          HG2       GLU  54   8.014   2.728 -35.539
  412   2HG   GLU  54          HG3       GLU  54   6.360   2.291 -35.127
  413    H    VAL  55           H        VAL  55   5.818   3.921 -30.556
  414    HA   VAL  55           HA       VAL  55   4.056   1.512 -30.744
  415    HB   VAL  55           HB       VAL  55   5.085   0.821 -28.595
  416   1HG1  VAL  55          HG11      VAL  55   7.181   0.019 -29.625
  417   2HG1  VAL  55          HG12      VAL  55   5.837  -0.080 -30.765
  418   3HG1  VAL  55          HG13      VAL  55   7.025   1.228 -30.910
  419   1HG2  VAL  55          HG21      VAL  55   7.179   2.976 -29.118
  420   2HG2  VAL  55          HG22      VAL  55   5.892   3.128 -27.891
  421   3HG2  VAL  55          HG23      VAL  55   7.101   1.859 -27.754
  422    H    GLY  56           H        GLY  56   3.971   4.773 -29.954
  423   1HA   GLY  56          HA1       GLY  56   1.990   5.843 -29.346
  424   2HA   GLY  56          HA2       GLY  56   1.359   4.349 -28.637
  425    H    ILE  57           H        ILE  57   4.607   5.748 -28.012
  426    HA   ILE  57           HA       ILE  57   3.804   6.492 -25.246
  427    HB   ILE  57           HB       ILE  57   6.305   5.094 -26.268
  428   1HG1  ILE  57          HG12      ILE  57   4.343   4.254 -24.099
  429   2HG1  ILE  57          HG13      ILE  57   4.289   3.666 -25.755
  430   1HG2  ILE  57          HG21      ILE  57   7.139   5.235 -23.855
  431   2HG2  ILE  57          HG22      ILE  57   7.111   6.766 -24.702
  432   3HG2  ILE  57          HG23      ILE  57   5.826   6.372 -23.540
  433   1HD1  ILE  57          HD11      ILE  57   6.548   2.671 -25.508
  434   2HD1  ILE  57          HD12      ILE  57   6.540   3.128 -23.789
  435   3HD1  ILE  57          HD13      ILE  57   5.341   1.991 -24.417
  436    H    ASP  58           H        ASP  58   5.257   8.249 -24.494
  437    HA   ASP  58           HA       ASP  58   6.570   9.828 -26.610
  438   1HB   ASP  58          HB2       ASP  58   4.496  11.053 -26.384
  439   2HB   ASP  58          HB3       ASP  58   4.563  10.947 -24.612
  440    H    ILE  59           H        ILE  59   8.370  10.832 -25.849
  441    HA   ILE  59           HA       ILE  59   9.080  10.566 -22.994
  442    HB   ILE  59           HB       ILE  59  11.459  10.063 -23.729
  443   1HG1  ILE  59          HG12      ILE  59  10.173   9.150 -26.343
  444   2HG1  ILE  59          HG13      ILE  59  11.028  10.677 -26.186
  445   1HG2  ILE  59          HG21      ILE  59  11.036   7.666 -23.802
  446   2HG2  ILE  59          HG22      ILE  59   9.861   8.417 -22.725
  447   3HG2  ILE  59          HG23      ILE  59   9.364   7.930 -24.348
  448   1HD1  ILE  59          HD11      ILE  59  12.516   8.985 -27.093
  449   2HD1  ILE  59          HD12      ILE  59  13.079   9.455 -25.488
  450   3HD1  ILE  59          HD13      ILE  59  12.240   7.911 -25.716
  451    H    SER  60           H        SER  60   8.377  12.682 -25.451
  452    HA   SER  60           HA       SER  60  10.384  14.689 -25.171
  453   1HB   SER  60          HB2       SER  60   7.430  15.229 -25.576
  454   2HB   SER  60          HB3       SER  60   8.815  16.154 -26.179
  455    HG   SER  60           HG       SER  60   7.761  13.665 -26.978
  456    H    ASN  61           H        ASN  61   7.633  13.747 -23.205
  457    HA   ASN  61           HA       ASN  61   7.559  15.937 -21.403
  458   1HB   ASN  61          HB2       ASN  61   6.149  14.512 -20.042
  459   2HB   ASN  61          HB3       ASN  61   5.719  14.299 -21.731
  460   1HD2  ASN  61          HD22      ASN  61   6.245  12.292 -22.792
  461   2HD2  ASN  61          HD21      ASN  61   6.708  10.859 -21.899
  462    H    GLN  62           H        GLN  62  10.210  13.803 -21.673
  463    HA   GLN  62           HA       GLN  62  10.914  14.167 -18.809
  464   1HB   GLN  62          HB2       GLN  62  11.736  11.778 -18.794
  465   2HB   GLN  62          HB3       GLN  62   9.982  11.964 -18.796
  466   1HG   GLN  62          HG2       GLN  62   9.794  11.369 -21.089
  467   2HG   GLN  62          HG3       GLN  62  11.530  11.569 -21.357
  468   1HE2  GLN  62          HE22      GLN  62  12.697   9.832 -21.541
  469   2HE2  GLN  62          HE21      GLN  62  12.241   8.224 -21.034
  470    H    THR  63           H        THR  63  11.892  15.929 -20.427
  471    HA   THR  63           HA       THR  63  14.057  15.349 -22.060
  472    HB   THR  63           HB       THR  63  14.745  17.768 -21.365
  473    HG1  THR  63           HG1      THR  63  13.249  18.866 -20.164
  474   1HG2  THR  63          HG21      THR  63  13.403  17.211 -23.386
  475   2HG2  THR  63          HG22      THR  63  11.923  17.236 -22.403
  476   3HG2  THR  63          HG23      THR  63  12.864  18.724 -22.643
  477    H    SER  64           H        SER  64  16.278  15.262 -21.847
  478    HA   SER  64           HA       SER  64  17.174  13.624 -19.867
  479   1HB   SER  64          HB2       SER  64  18.781  15.371 -21.772
  480   2HB   SER  64          HB3       SER  64  19.261  13.803 -21.111
  481    HG   SER  64           HG       SER  64  18.413  13.079 -22.851
  482    H    ASP  65           H        ASP  65  19.071  13.784 -18.555
  483    HA   ASP  65           HA       ASP  65  20.238  16.332 -17.846
  484   1HB   ASP  65          HB2       ASP  65  18.184  16.269 -16.362
  485   2HB   ASP  65          HB3       ASP  65  18.801  14.778 -15.649
  486    H    ILE  66           H        ILE  66  22.123  15.976 -16.388
  487    HA   ILE  66           HA       ILE  66  23.459  13.398 -16.848
  488    HB   ILE  66           HB       ILE  66  25.171  14.648 -15.237
  489   1HG1  ILE  66          HG12      ILE  66  23.592  16.698 -14.999
  490   2HG1  ILE  66          HG13      ILE  66  25.314  16.913 -15.232
  491   1HG2  ILE  66          HG21      ILE  66  26.317  15.445 -17.258
  492   2HG2  ILE  66          HG22      ILE  66  25.659  13.813 -17.409
  493   3HG2  ILE  66          HG23      ILE  66  24.816  15.171 -18.186
  494   1HD1  ILE  66          HD11      ILE  66  25.032  17.510 -17.584
  495   2HD1  ILE  66          HD12      ILE  66  23.292  17.196 -17.500
  496   3HD1  ILE  66          HD13      ILE  66  24.000  18.524 -16.565
  497    H    ILE  67           H        ILE  67  24.494  12.368 -14.925
  498    HA   ILE  67           HA       ILE  67  22.528  11.330 -13.224
  499    HB   ILE  67           HB       ILE  67  25.559  11.254 -13.204
  500   1HG1  ILE  67          HG12      ILE  67  23.503   9.071 -13.808
  501   2HG1  ILE  67          HG13      ILE  67  24.151  10.136 -15.045
  502   1HG2  ILE  67          HG21      ILE  67  23.681   9.667 -11.405
  503   2HG2  ILE  67          HG22      ILE  67  25.425   9.363 -11.604
  504   3HG2  ILE  67          HG23      ILE  67  24.884  10.862 -10.870
  505   1HD1  ILE  67          HD11      ILE  67  25.362   8.118 -15.159
  506   2HD1  ILE  67          HD12      ILE  67  26.462   9.345 -14.504
  507   3HD1  ILE  67          HD13      ILE  67  25.734   8.121 -13.429
  508    H    ASP  68           H        ASP  68  22.029  11.590 -11.099
  509    HA   ASP  68           HA       ASP  68  23.348  13.726  -9.520
  510   1HB   ASP  68          HB2       ASP  68  21.252  14.620 -10.638
  511   2HB   ASP  68          HB3       ASP  68  20.328  13.449  -9.690
  512    H    SER  69           H        SER  69  23.694  13.140  -7.453
  513    HA   SER  69           HA       SER  69  23.578  10.537  -6.578
  514   1HB   SER  69          HB2       SER  69  23.616  13.010  -4.829
  515   2HB   SER  69          HB3       SER  69  24.319  11.421  -4.472
  516    HG   SER  69           HG       SER  69  25.885  12.937  -5.219
  517    H    ASP  70           H        ASP  70  21.021  12.942  -6.416
  518    HA   ASP  70           HA       ASP  70  19.646  11.890  -4.126
  519   1HB   ASP  70          HB2       ASP  70  19.468  14.235  -4.923
  520   2HB   ASP  70          HB3       ASP  70  18.636  13.662  -6.376
  521    H    ILE  71           H        ILE  71  19.931  10.744  -7.318
  522    HA   ILE  71           HA       ILE  71  17.490   9.060  -7.042
  523    HB   ILE  71           HB       ILE  71  18.982   9.849  -9.555
  524   1HG1  ILE  71          HG12      ILE  71  16.127  10.718  -9.022
  525   2HG1  ILE  71          HG13      ILE  71  17.423  11.672  -8.322
  526   1HG2  ILE  71          HG21      ILE  71  17.068   8.753 -10.701
  527   2HG2  ILE  71          HG22      ILE  71  17.913   7.624  -9.638
  528   3HG2  ILE  71          HG23      ILE  71  16.366   8.317  -9.125
  529   1HD1  ILE  71          HD11      ILE  71  18.464  12.034 -10.473
  530   2HD1  ILE  71          HD12      ILE  71  17.215  11.049 -11.282
  531   3HD1  ILE  71          HD13      ILE  71  16.775  12.577 -10.486
  532    H    LEU  72           H        LEU  72  20.985   9.171  -7.974
  533    HA   LEU  72           HA       LEU  72  21.529   6.479  -8.346
  534   1HB   LEU  72          HB2       LEU  72  23.152   8.496  -6.741
  535   2HB   LEU  72          HB3       LEU  72  23.723   6.888  -7.083
  536    HG   LEU  72           HG       LEU  72  23.164   9.002  -9.169
  537   1HD1  LEU  72          HD11      LEU  72  25.107   9.501  -7.766
  538   2HD1  LEU  72          HD12      LEU  72  25.735   7.855  -7.974
  539   3HD1  LEU  72          HD13      LEU  72  25.676   8.966  -9.348
  540   1HD2  LEU  72          HD21      LEU  72  22.804   6.766 -10.145
  541   2HD2  LEU  72          HD22      LEU  72  24.363   7.375 -10.698
  542   3HD2  LEU  72          HD23      LEU  72  24.298   6.165  -9.409
  543    H    ASN  73           H        ASN  73  21.751   8.072  -5.153
  544    HA   ASN  73           HA       ASN  73  22.039   5.538  -3.834
  545   1HB   ASN  73          HB2       ASN  73  22.693   6.687  -2.000
  546   2HB   ASN  73          HB3       ASN  73  22.982   7.951  -3.181
  547   1HD2  ASN  73          HD22      ASN  73  20.962   9.538  -3.472
  548   2HD2  ASN  73          HD21      ASN  73  20.093   9.911  -2.001
  549    H    ASN  74           H        ASN  74  19.289   6.758  -5.059
  550    HA   ASN  74           HA       ASN  74  17.511   6.127  -2.737
  551   1HB   ASN  74          HB2       ASN  74  17.730   8.494  -3.442
  552   2HB   ASN  74          HB3       ASN  74  17.309   8.035  -5.087
  553   1HD2  ASN  74          HD22      ASN  74  15.795   9.810  -4.750
  554   2HD2  ASN  74          HD21      ASN  74  14.211   9.443  -4.082
  555    H    ALA  75           H        ALA  75  18.139   5.607  -6.180
  556    HA   ALA  75           HA       ALA  75  15.703   4.432  -6.961
  557   1HB   ALA  75          HB1       ALA  75  16.922   3.680  -8.880
  558   2HB   ALA  75          HB2       ALA  75  17.354   5.349  -8.494
  559   3HB   ALA  75          HB3       ALA  75  18.476   4.033  -8.072
  560    H    ASP  76           H        ASP  76  14.835   2.469  -6.685
  561    HA   ASP  76           HA       ASP  76  15.978   0.573  -4.855
  562   1HB   ASP  76          HB2       ASP  76  13.540   0.779  -5.202
  563   2HB   ASP  76          HB3       ASP  76  13.725   0.226  -6.871
  564    H    LEU  77           H        LEU  77  16.213   1.129  -8.278
  565    HA   LEU  77           HA       LEU  77  18.284  -0.930  -8.518
  566   1HB   LEU  77          HB2       LEU  77  16.259  -2.178  -9.206
  567   2HB   LEU  77          HB3       LEU  77  15.807  -0.873 -10.303
  568    HG   LEU  77           HG       LEU  77  17.841  -1.317 -11.677
  569   1HD1  LEU  77          HD11      LEU  77  18.226  -3.719  -9.830
  570   2HD1  LEU  77          HD12      LEU  77  19.118  -3.403 -11.336
  571   3HD1  LEU  77          HD13      LEU  77  19.325  -2.329  -9.963
  572   1HD2  LEU  77          HD21      LEU  77  17.062  -3.418 -12.662
  573   2HD2  LEU  77          HD22      LEU  77  16.096  -3.752 -11.208
  574   3HD2  LEU  77          HD23      LEU  77  15.704  -2.364 -12.251
  575    H    VAL  78           H        VAL  78  19.846  -0.279  -9.948
  576    HA   VAL  78           HA       VAL  78  19.291   2.060 -11.707
  577    HB   VAL  78           HB       VAL  78  21.913   1.259 -10.359
  578   1HG1  VAL  78          HG11      VAL  78  22.739   3.436 -11.271
  579   2HG1  VAL  78          HG12      VAL  78  22.347   2.275 -12.544
  580   3HG1  VAL  78          HG13      VAL  78  21.229   3.610 -12.184
  581   1HG2  VAL  78          HG21      VAL  78  20.397   2.301  -8.721
  582   2HG2  VAL  78          HG22      VAL  78  21.690   3.423  -9.136
  583   3HG2  VAL  78          HG23      VAL  78  20.071   3.640  -9.839
  584    H    VAL  79           H        VAL  79  19.902   1.698 -13.894
  585    HA   VAL  79           HA       VAL  79  20.998  -1.004 -14.546
  586    HB   VAL  79           HB       VAL  79  18.843   0.474 -16.094
  587   1HG1  VAL  79          HG11      VAL  79  20.209  -1.180 -17.368
  588   2HG1  VAL  79          HG12      VAL  79  19.759  -2.431 -16.201
  589   3HG1  VAL  79          HG13      VAL  79  18.521  -1.679 -17.224
  590   1HG2  VAL  79          HG21      VAL  79  18.421  -1.735 -14.050
  591   2HG2  VAL  79          HG22      VAL  79  17.752  -0.089 -14.014
  592   3HG2  VAL  79          HG23      VAL  79  17.214  -1.225 -15.248
  593    H    THR  80           H        THR  80  22.838  -0.780 -15.782
  594    HA   THR  80           HA       THR  80  23.215   1.800 -17.253
  595    HB   THR  80           HB       THR  80  25.582   0.781 -17.569
  596    HG1  THR  80           HG1      THR  80  24.910  -1.260 -16.529
  597   1HG2  THR  80          HG21      THR  80  26.325   1.844 -15.482
  598   2HG2  THR  80          HG22      THR  80  25.068   2.787 -16.291
  599   3HG2  THR  80          HG23      THR  80  24.653   1.809 -14.861
  600    H    LEU  81           H        LEU  81  23.156   1.803 -19.409
  601    HA   LEU  81           HA       LEU  81  22.539  -0.802 -20.744
  602   1HB   LEU  81          HB2       LEU  81  21.711   2.005 -21.493
  603   2HB   LEU  81          HB3       LEU  81  21.374   0.573 -22.432
  604    HG   LEU  81           HG       LEU  81  19.956  -0.331 -20.614
  605   1HD1  LEU  81          HD11      LEU  81  20.462   2.385 -19.298
  606   2HD1  LEU  81          HD12      LEU  81  19.087   1.343 -18.902
  607   3HD1  LEU  81          HD13      LEU  81  20.702   0.772 -18.584
  608   1HD2  LEU  81          HD21      LEU  81  19.169   2.454 -21.556
  609   2HD2  LEU  81          HD22      LEU  81  18.891   0.923 -22.426
  610   3HD2  LEU  81          HD23      LEU  81  18.059   1.234 -20.913
  611    H    CYS  82           H        CYS  82  25.266   0.380 -20.207
  612    HA   CYS  82           HA       CYS  82  26.362   1.365 -22.664
  613   1HB   CYS  82          HB2       CYS  82  28.530   0.893 -21.512
  614   2HB   CYS  82          HB3       CYS  82  27.458   2.020 -20.688
  615    H    GLY  83           H        GLY  83  26.419   0.069 -24.471
  616   1HA   GLY  83          HA1       GLY  83  28.155  -2.238 -24.393
  617   2HA   GLY  83          HA2       GLY  83  26.489  -2.646 -24.834
  618    H    ASP  84           H        ASP  84  27.890   0.489 -25.456
  619    HA   ASP  84           HA       ASP  84  27.592   0.221 -28.374
  620   1HB   ASP  84          HB2       ASP  84  26.914   2.540 -28.259
  621   2HB   ASP  84          HB3       ASP  84  26.068   1.715 -26.945
  622    H    ALA  85           H        ALA  85  28.778   2.342 -29.366
  623    HA   ALA  85           HA       ALA  85  31.450   1.572 -29.593
  624   1HB   ALA  85          HB1       ALA  85  31.739   3.662 -30.863
  625   2HB   ALA  85          HB2       ALA  85  30.208   2.875 -31.290
  626   3HB   ALA  85          HB3       ALA  85  30.217   4.291 -30.208
  627    H    ALA  86           H        ALA  86  30.049   3.879 -27.280
  628    HA   ALA  86           HA       ALA  86  32.677   4.940 -26.501
  629   1HB   ALA  86          HB1       ALA  86  30.657   6.380 -26.504
  630   2HB   ALA  86          HB2       ALA  86  29.921   5.339 -25.266
  631   3HB   ALA  86          HB3       ALA  86  31.389   6.265 -24.896
  632    H    ASP  87           H        ASP  87  30.130   2.891 -25.082
  633    HA   ASP  87           HA       ASP  87  30.013   1.597 -23.231
  634   1HB   ASP  87          HB2       ASP  87  31.041   0.179 -24.924
  635   2HB   ASP  87          HB3       ASP  87  32.652   0.593 -24.333
  636    H    LYS  88           H        LYS  88  31.240   4.190 -22.552
  637    HA   LYS  88           HA       LYS  88  33.370   3.813 -20.720
  638   1HB   LYS  88          HB2       LYS  88  31.268   6.018 -20.798
  639   2HB   LYS  88          HB3       LYS  88  32.741   6.077 -19.855
  640   1HG   LYS  88          HG2       LYS  88  32.559   5.975 -22.894
  641   2HG   LYS  88          HG3       LYS  88  32.923   7.389 -21.919
  642   1HD   LYS  88          HD2       LYS  88  34.675   4.908 -22.200
  643   2HD   LYS  88          HD3       LYS  88  34.938   6.483 -22.952
  644   1HE   LYS  88          HE2       LYS  88  35.125   7.532 -20.693
  645   2HE   LYS  88          HE3       LYS  88  34.925   5.943 -19.947
  646   1HZ   LYS  88          HZ1       LYS  88  37.251   6.547 -20.118
  647   2HZ   LYS  88          HZ2       LYS  88  36.974   5.240 -21.049
  648   3HZ   LYS  88          HZ3       LYS  88  37.160   6.713 -21.735
  649    H    CYS  89           H        CYS  89  30.023   3.107 -20.319
  650    HA   CYS  89           HA       CYS  89  28.647   2.631 -18.623
  651   1HB   CYS  89          HB2       CYS  89  31.123   1.263 -17.590
  652   2HB   CYS  89          HB3       CYS  89  29.503   1.028 -16.952
  653    HA   PRO  90           HA       PRO  90  29.439   6.336 -16.102
  654   1HB   PRO  90          HB2       PRO  90  26.538   5.820 -15.537
  655   2HB   PRO  90          HB3       PRO  90  27.374   7.364 -15.893
  656   1HG   PRO  90          HG2       PRO  90  25.899   6.069 -17.783
  657   2HG   PRO  90          HG3       PRO  90  27.434   6.883 -18.215
  658   1HD   PRO  90          HD2       PRO  90  26.908   3.964 -17.793
  659   2HD   PRO  90          HD3       PRO  90  27.976   4.779 -18.977
  660    H    MET  91           H        MET  91  29.620   6.758 -13.903
  661    HA   MET  91           HA       MET  91  30.121   4.604 -12.152
  662   1HB   MET  91          HB2       MET  91  31.290   6.749 -12.124
  663   2HB   MET  91          HB3       MET  91  29.816   7.610 -11.704
  664   1HG   MET  91          HG2       MET  91  31.093   5.480  -9.947
  665   2HG   MET  91          HG3       MET  91  31.528   7.178  -9.868
  666   1HE   MET  91          HE1       MET  91  28.555   8.657 -10.124
  667   2HE   MET  91          HE2       MET  91  28.315   8.886  -8.383
  668   3HE   MET  91          HE3       MET  91  29.925   9.137  -9.091
  669    H    THR  92           H        THR  92  28.862   3.606 -10.657
  670    HA   THR  92           HA       THR  92  26.331   4.821  -9.741
  671    HB   THR  92           HB       THR  92  25.585   2.423  -9.604
  672    HG1  THR  92           HG1      THR  92  27.597   1.405  -9.592
  673   1HG2  THR  92          HG21      THR  92  25.112   3.910 -11.627
  674   2HG2  THR  92          HG22      THR  92  26.483   3.117 -12.426
  675   3HG2  THR  92          HG23      THR  92  25.058   2.168 -11.950
  676    HA   PRO  93           HA       PRO  93  28.146   4.034  -5.702
  677   1HB   PRO  93          HB2       PRO  93  25.952   3.632  -4.101
  678   2HB   PRO  93          HB3       PRO  93  26.413   5.239  -4.748
  679   1HG   PRO  93          HG2       PRO  93  24.386   3.284  -5.858
  680   2HG   PRO  93          HG3       PRO  93  24.174   5.036  -5.572
  681   1HD   PRO  93          HD2       PRO  93  24.797   4.023  -8.031
  682   2HD   PRO  93          HD3       PRO  93  25.502   5.573  -7.470
  683    HA   PRO  94           HA       PRO  94  28.238  -0.447  -5.718
  684   1HB   PRO  94          HB2       PRO  94  29.756  -0.996  -3.529
  685   2HB   PRO  94          HB3       PRO  94  30.421  -0.169  -4.972
  686   1HG   PRO  94          HG2       PRO  94  29.430   1.087  -2.396
  687   2HG   PRO  94          HG3       PRO  94  30.963   1.411  -3.269
  688   1HD   PRO  94          HD2       PRO  94  28.702   2.968  -3.557
  689   2HD   PRO  94          HD3       PRO  94  29.867   2.706  -4.896
  690    H    HIS  95           H        HIS  95  26.873   1.349  -3.014
  691    HA   HIS  95           HA       HIS  95  25.849  -1.009  -1.645
  692   1HB   HIS  95          HB2       HIS  95  25.010   0.618  -0.013
  693   2HB   HIS  95          HB3       HIS  95  26.718   0.818  -0.343
  694    HD1  HIS  95           HD1      HIS  95  27.465   3.251  -1.064
  695    HD2  HIS  95           HD2      HIS  95  23.314   2.550  -1.113
  696    HE1  HIS  95           HE1      HIS  95  26.363   5.501  -1.502
  697    H    VAL  96           H        VAL  96  24.832   0.208  -4.478
  698    HA   VAL  96           HA       VAL  96  21.952  -0.244  -3.823
  699    HB   VAL  96           HB       VAL  96  23.038   1.586  -5.976
  700   1HG1  VAL  96          HG11      VAL  96  20.186   1.049  -5.046
  701   2HG1  VAL  96          HG12      VAL  96  20.673   2.336  -6.166
  702   3HG1  VAL  96          HG13      VAL  96  20.878   0.653  -6.636
  703   1HG2  VAL  96          HG21      VAL  96  21.715   2.216  -3.286
  704   2HG2  VAL  96          HG22      VAL  96  23.379   2.624  -3.767
  705   3HG2  VAL  96          HG23      VAL  96  22.021   3.402  -4.568
  706    H    LYS  97           H        LYS  97  20.821  -1.604  -5.240
  707    HA   LYS  97           HA       LYS  97  22.293  -3.657  -6.566
  708   1HB   LYS  97          HB2       LYS  97  20.005  -3.876  -5.523
  709   2HB   LYS  97          HB3       LYS  97  19.344  -2.894  -6.840
  710   1HG   LYS  97          HG2       LYS  97  20.091  -4.611  -8.483
  711   2HG   LYS  97          HG3       LYS  97  20.794  -5.564  -7.162
  712   1HD   LYS  97          HD2       LYS  97  18.550  -5.813  -6.140
  713   2HD   LYS  97          HD3       LYS  97  17.839  -4.848  -7.454
  714   1HE   LYS  97          HE2       LYS  97  18.607  -6.528  -9.111
  715   2HE   LYS  97          HE3       LYS  97  19.359  -7.473  -7.820
  716   1HZ   LYS  97          HZ1       LYS  97  16.450  -6.949  -8.061
  717   2HZ   LYS  97          HZ2       LYS  97  17.195  -8.355  -8.411
  718   3HZ   LYS  97          HZ3       LYS  97  17.155  -7.825  -6.873
  719    H    ARG  98           H        ARG  98  22.756  -3.908  -8.714
  720    HA   ARG  98           HA       ARG  98  21.950  -1.779 -10.596
  721   1HB   ARG  98          HB2       ARG  98  24.161  -1.182  -9.787
  722   2HB   ARG  98          HB3       ARG  98  24.783  -2.791 -10.184
  723   1HG   ARG  98          HG2       ARG  98  24.489  -2.389 -12.566
  724   2HG   ARG  98          HG3       ARG  98  23.656  -0.844 -12.257
  725   1HD   ARG  98          HD2       ARG  98  25.655   0.117 -11.349
  726   2HD   ARG  98          HD3       ARG  98  26.505  -1.435 -11.383
  727    HE   ARG  98           HE       ARG  98  25.597  -0.753 -14.022
  728   1HH1  ARG  98          HH21      ARG  98  27.982   0.536 -11.763
  729   2HH1  ARG  98          HH22      ARG  98  29.301   0.480 -12.882
  730   1HH2  ARG  98          HH11      ARG  98  27.199  -0.612 -15.543
  731   2HH2  ARG  98          HH12      ARG  98  28.845  -0.188 -15.136
  732    H    GLU  99           H        GLU  99  21.790  -2.422 -12.734
  733    HA   GLU  99           HA       GLU  99  22.230  -5.280 -13.452
  734   1HB   GLU  99          HB2       GLU  99  19.858  -3.448 -13.822
  735   2HB   GLU  99          HB3       GLU  99  20.265  -4.515 -15.151
  736   1HG   GLU  99          HG2       GLU  99  19.890  -5.574 -12.333
  737   2HG   GLU  99          HG3       GLU  99  18.541  -5.337 -13.443
  738    H    HIS 100           H        HIS 100  22.730  -5.510 -15.762
  739    HA   HIS 100           HA       HIS 100  23.819  -3.087 -17.085
  740   1HB   HIS 100          HB2       HIS 100  25.723  -4.073 -16.028
  741   2HB   HIS 100          HB3       HIS 100  25.236  -5.704 -16.500
  742    HD1  HIS 100           HD1      HIS 100  26.797  -2.537 -18.076
  743    HD2  HIS 100           HD2      HIS 100  25.916  -6.570 -18.902
  744    HE1  HIS 100           HE1      HIS 100  27.995  -3.102 -20.245
  745    H    TRP 101           H        TRP 101  22.679  -2.916 -18.866
  746    HA   TRP 101           HA       TRP 101  21.726  -5.328 -20.362
  747   1HB   TRP 101          HB2       TRP 101  20.361  -2.636 -19.943
  748   2HB   TRP 101          HB3       TRP 101  19.811  -3.888 -21.038
  749    HD1  TRP 101           HD1      TRP 101  20.695  -5.347 -17.681
  750    HE1  TRP 101           HE1      TRP 101  18.636  -5.814 -16.328
  751    HE3  TRP 101           HE3      TRP 101  17.271  -3.058 -20.719
  752    HZ2  TRP 101           HZ2      TRP 101  15.793  -5.119 -16.431
  753    HZ3  TRP 101           HZ3      TRP 101  14.864  -3.107 -20.131
  754    HH2  TRP 101           HH2      TRP 101  14.123  -4.079 -17.957
  755    H    GLY 102           H        GLY 102  24.196  -4.688 -21.105
  756   1HA   GLY 102          HA1       GLY 102  24.511  -2.310 -22.637
  757   2HA   GLY 102          HA2       GLY 102  25.570  -3.725 -22.648
  758    H    PHE 103           H        PHE 103  24.042  -1.840 -24.689
  759    HA   PHE 103           HA       PHE 103  24.228  -3.720 -26.821
  760   1HB   PHE 103          HB2       PHE 103  21.855  -2.878 -27.700
  761   2HB   PHE 103          HB3       PHE 103  22.050  -4.350 -26.779
  762    HD1  PHE 103           HD1      PHE 103  20.464  -4.770 -25.131
  763    HD2  PHE 103           HD2      PHE 103  21.484  -0.681 -26.057
  764    HE1  PHE 103           HE1      PHE 103  18.903  -3.985 -23.374
  765    HE2  PHE 103           HE2      PHE 103  19.947   0.089 -24.272
  766    HZ   PHE 103           HZ       PHE 103  18.716  -1.551 -22.875
  767    H    ASP 104           H        ASP 104  24.131  -2.458 -28.886
  768    HA   ASP 104           HA       ASP 104  25.659  -0.121 -28.510
  769   1HB   ASP 104          HB2       ASP 104  25.989  -1.665 -30.404
  770   2HB   ASP 104          HB3       ASP 104  24.425  -1.176 -31.067
  771    H    ASP 105           H        ASP 105  25.284   1.981 -28.962
  772    HA   ASP 105           HA       ASP 105  22.616   2.939 -28.343
  773   1HB   ASP 105          HB2       ASP 105  24.791   4.131 -27.725
  774   2HB   ASP 105          HB3       ASP 105  24.897   4.634 -29.403
  775    HA   PRO 106           HA       PRO 106  21.478   2.635 -32.619
  776   1HB   PRO 106          HB2       PRO 106  19.064   3.905 -32.652
  777   2HB   PRO 106          HB3       PRO 106  19.321   2.280 -31.959
  778   1HG   PRO 106          HG2       PRO 106  19.220   4.910 -30.468
  779   2HG   PRO 106          HG3       PRO 106  18.389   3.377 -30.058
  780   1HD   PRO 106          HD2       PRO 106  20.747   4.117 -28.910
  781   2HD   PRO 106          HD3       PRO 106  20.421   2.404 -29.310
  782    H    ALA 107           H        ALA 107  21.892   5.789 -31.064
  783    HA   ALA 107           HA       ALA 107  21.877   7.226 -33.589
  784   1HB   ALA 107          HB1       ALA 107  22.699   9.114 -32.287
  785   2HB   ALA 107          HB2       ALA 107  21.323   8.354 -31.466
  786   3HB   ALA 107          HB3       ALA 107  22.982   8.069 -30.883
  787    H    ARG 108           H        ARG 108  24.027   5.010 -32.139
  788    HA   ARG 108           HA       ARG 108  26.390   6.144 -33.573
  789   1HB   ARG 108          HB2       ARG 108  26.315   4.242 -31.190
  790   2HB   ARG 108          HB3       ARG 108  27.765   4.844 -31.997
  791   1HG   ARG 108          HG2       ARG 108  27.157   7.169 -31.416
  792   2HG   ARG 108          HG3       ARG 108  25.702   6.600 -30.590
  793   1HD   ARG 108          HD2       ARG 108  27.090   5.378 -28.945
  794   2HD   ARG 108          HD3       ARG 108  28.557   5.962 -29.751
  795    HE   ARG 108           HE       ARG 108  27.419   8.296 -29.332
  796   1HH1  ARG 108          HH21      ARG 108  27.761   5.631 -26.945
  797   2HH1  ARG 108          HH22      ARG 108  27.432   6.663 -25.608
  798   1HH2  ARG 108          HH11      ARG 108  27.132   9.634 -27.476
  799   2HH2  ARG 108          HH12      ARG 108  27.193   8.928 -25.890
  800    H    ALA 109           H        ALA 109  23.970   3.923 -33.971
  801    HA   ALA 109           HA       ALA 109  25.323   1.747 -35.235
  802   1HB   ALA 109          HB1       ALA 109  23.044   1.598 -34.281
  803   2HB   ALA 109          HB2       ALA 109  22.452   2.752 -35.500
  804   3HB   ALA 109          HB3       ALA 109  23.057   1.168 -36.004
  805    H    GLN 110           H        GLN 110  26.726   3.638 -36.245
  806    HA   GLN 110           HA       GLN 110  25.791   5.292 -38.284
  807   1HB   GLN 110          HB2       GLN 110  28.197   5.679 -38.710
  808   2HB   GLN 110          HB3       GLN 110  27.771   5.728 -37.006
  809   1HG   GLN 110          HG2       GLN 110  28.559   3.132 -37.106
  810   2HG   GLN 110          HG3       GLN 110  29.456   3.725 -38.494
  811   1HE2  GLN 110          HE22      GLN 110  28.881   4.183 -34.965
  812   2HE2  GLN 110          HE21      GLN 110  30.432   4.926 -34.640
  813    H    GLY 111           H        GLY 111  25.924   5.286 -40.431
  814   1HA   GLY 111          HA1       GLY 111  27.003   3.613 -42.301
  815   2HA   GLY 111          HA2       GLY 111  25.480   2.801 -41.857
  816    H    THR 112           H        THR 112  23.655   4.648 -41.432
  817    HA   THR 112           HA       THR 112  23.772   7.073 -42.838
  818    HB   THR 112           HB       THR 112  23.516   5.759 -44.877
  819    HG1  THR 112           HG1      THR 112  21.807   6.797 -45.671
  820   1HG2  THR 112          HG21      THR 112  21.022   4.523 -43.649
  821   2HG2  THR 112          HG22      THR 112  21.559   4.340 -45.328
  822   3HG2  THR 112          HG23      THR 112  22.539   3.674 -44.021
  823    H    GLU 113           H        GLU 113  21.509   8.122 -42.710
  824    HA   GLU 113           HA       GLU 113  20.685   7.932 -39.978
  825   1HB   GLU 113          HB2       GLU 113  19.001   9.589 -40.554
  826   2HB   GLU 113          HB3       GLU 113  20.582  10.026 -41.203
  827   1HG   GLU 113          HG2       GLU 113  19.867   9.186 -43.455
  828   2HG   GLU 113          HG3       GLU 113  18.274   8.815 -42.793
  829    H    GLU 114           H        GLU 114  19.501   6.417 -42.948
  830    HA   GLU 114           HA       GLU 114  17.053   5.457 -41.817
  831   1HB   GLU 114          HB2       GLU 114  17.456   5.688 -44.234
  832   2HB   GLU 114          HB3       GLU 114  18.673   4.404 -44.169
  833   1HG   GLU 114          HG2       GLU 114  16.958   2.779 -43.482
  834   2HG   GLU 114          HG3       GLU 114  15.743   4.057 -43.396
  835    H    GLU 115           H        GLU 115  20.382   4.217 -41.891
  836    HA   GLU 115           HA       GLU 115  19.750   1.594 -40.890
  837   1HB   GLU 115          HB2       GLU 115  21.853   2.203 -42.155
  838   2HB   GLU 115          HB3       GLU 115  22.380   3.133 -40.753
  839   1HG   GLU 115          HG2       GLU 115  23.496   1.053 -40.644
  840   2HG   GLU 115          HG3       GLU 115  22.278   1.020 -39.377
  841    H    LYS 116           H        LYS 116  20.939   4.673 -39.453
  842    HA   LYS 116           HA       LYS 116  20.915   3.882 -36.740
  843   1HB   LYS 116          HB2       LYS 116  20.476   6.571 -38.100
  844   2HB   LYS 116          HB3       LYS 116  20.492   6.375 -36.336
  845   1HG   LYS 116          HG2       LYS 116  22.785   5.351 -36.529
  846   2HG   LYS 116          HG3       LYS 116  22.769   5.743 -38.261
  847   1HD   LYS 116          HD2       LYS 116  22.421   8.167 -37.649
  848   2HD   LYS 116          HD3       LYS 116  22.543   7.705 -35.938
  849   1HE   LYS 116          HE2       LYS 116  24.829   6.670 -36.551
  850   2HE   LYS 116          HE3       LYS 116  24.686   7.528 -38.097
  851   1HZ   LYS 116          HZ1       LYS 116  24.780   8.714 -35.386
  852   2HZ   LYS 116          HZ2       LYS 116  25.923   8.857 -36.542
  853   3HZ   LYS 116          HZ3       LYS 116  24.487   9.603 -36.746
  854    H    TRP 117           H        TRP 117  18.233   5.347 -38.681
  855    HA   TRP 117           HA       TRP 117  16.328   5.304 -36.608
  856   1HB   TRP 117          HB2       TRP 117  15.962   6.627 -38.554
  857   2HB   TRP 117          HB3       TRP 117  16.141   5.242 -39.624
  858    HD1  TRP 117           HD1      TRP 117  13.983   4.724 -40.732
  859    HE1  TRP 117           HE1      TRP 117  11.551   4.429 -40.068
  860    HE3  TRP 117           HE3      TRP 117  14.314   6.151 -35.816
  861    HZ2  TRP 117           HZ2      TRP 117   9.917   4.756 -37.686
  862    HZ3  TRP 117           HZ3      TRP 117  12.336   6.058 -34.364
  863    HH2  TRP 117           HH2      TRP 117  10.121   5.335 -35.273
  864    H    ALA 118           H        ALA 118  17.229   2.680 -38.918
  865    HA   ALA 118           HA       ALA 118  15.082   0.963 -38.099
  866   1HB   ALA 118          HB1       ALA 118  16.235   0.673 -40.237
  867   2HB   ALA 118          HB2       ALA 118  17.759   0.302 -39.391
  868   3HB   ALA 118          HB3       ALA 118  16.367  -0.796 -39.249
  869    H    PHE 119           H        PHE 119  18.477   1.356 -37.073
  870    HA   PHE 119           HA       PHE 119  18.419  -0.729 -35.150
  871   1HB   PHE 119          HB2       PHE 119  20.409   0.717 -36.202
  872   2HB   PHE 119          HB3       PHE 119  20.205   1.640 -34.723
  873    HD1  PHE 119           HD1      PHE 119  21.208  -1.571 -36.238
  874    HD2  PHE 119           HD2      PHE 119  20.678   0.521 -32.506
  875    HE1  PHE 119           HE1      PHE 119  22.531  -3.312 -35.065
  876    HE2  PHE 119           HE2      PHE 119  21.997  -1.216 -31.341
  877    HZ   PHE 119           HZ       PHE 119  22.929  -3.140 -32.615
  878    H    PHE 120           H        PHE 120  17.484   2.695 -34.953
  879    HA   PHE 120           HA       PHE 120  17.004   2.837 -32.159
  880   1HB   PHE 120          HB2       PHE 120  16.106   4.339 -34.578
  881   2HB   PHE 120          HB3       PHE 120  14.956   4.356 -33.266
  882    HD1  PHE 120           HD1      PHE 120  15.709   5.085 -30.947
  883    HD2  PHE 120           HD2      PHE 120  18.025   5.812 -34.513
  884    HE1  PHE 120           HE1      PHE 120  16.987   6.847 -29.770
  885    HE2  PHE 120           HE2      PHE 120  19.280   7.594 -33.334
  886    HZ   PHE 120           HZ       PHE 120  18.740   8.139 -30.975
  887    H    GLN 121           H        GLN 121  14.754   1.772 -34.763
  888    HA   GLN 121           HA       GLN 121  12.661   1.134 -32.915
  889   1HB   GLN 121          HB2       GLN 121  13.313   0.220 -35.741
  890   2HB   GLN 121          HB3       GLN 121  11.863  -0.318 -34.892
  891   1HG   GLN 121          HG2       GLN 121  10.921   1.836 -34.811
  892   2HG   GLN 121          HG3       GLN 121  12.462   2.646 -35.098
  893   1HE2  GLN 121          HE22      GLN 121  13.431   2.606 -37.202
  894   2HE2  GLN 121          HE21      GLN 121  12.458   2.312 -38.623
  895    H    ARG 122           H        ARG 122  15.420  -0.805 -34.126
  896    HA   ARG 122           HA       ARG 122  14.550  -3.264 -32.913
  897   1HB   ARG 122          HB2       ARG 122  17.308  -2.226 -33.710
  898   2HB   ARG 122          HB3       ARG 122  17.034  -3.844 -33.065
  899   1HG   ARG 122          HG2       ARG 122  15.668  -4.489 -34.934
  900   2HG   ARG 122          HG3       ARG 122  15.557  -2.832 -35.529
  901   1HD   ARG 122          HD2       ARG 122  17.111  -4.137 -36.887
  902   2HD   ARG 122          HD3       ARG 122  17.931  -2.793 -36.077
  903    HE   ARG 122           HE       ARG 122  18.123  -5.168 -34.487
  904   1HH1  ARG 122          HH21      ARG 122  19.430  -3.814 -37.501
  905   2HH1  ARG 122          HH22      ARG 122  20.928  -4.660 -37.397
  906   1HH2  ARG 122          HH11      ARG 122  20.131  -6.281 -34.338
  907   2HH2  ARG 122          HH12      ARG 122  21.326  -6.102 -35.562
  908    H    VAL 123           H        VAL 123  16.829  -0.696 -31.688
  909    HA   VAL 123           HA       VAL 123  17.233  -2.073 -29.206
  910    HB   VAL 123           HB       VAL 123  17.650   0.811 -30.095
  911   1HG1  VAL 123          HG11      VAL 123  17.430   0.895 -27.670
  912   2HG1  VAL 123          HG12      VAL 123  18.522  -0.497 -27.479
  913   3HG1  VAL 123          HG13      VAL 123  19.131   1.049 -28.102
  914   1HG2  VAL 123          HG21      VAL 123  19.627  -1.456 -29.547
  915   2HG2  VAL 123          HG22      VAL 123  19.086  -0.962 -31.160
  916   3HG2  VAL 123          HG23      VAL 123  20.014   0.161 -30.160
  917    H    ARG 124           H        ARG 124  14.859   0.416 -30.256
  918    HA   ARG 124           HA       ARG 124  13.547   0.882 -27.800
  919   1HB   ARG 124          HB2       ARG 124  13.061   2.193 -29.763
  920   2HB   ARG 124          HB3       ARG 124  12.739   0.775 -30.710
  921   1HG   ARG 124          HG2       ARG 124  10.725   0.582 -28.828
  922   2HG   ARG 124          HG3       ARG 124  10.923   2.322 -28.958
  923   1HD   ARG 124          HD2       ARG 124   9.228   1.501 -30.506
  924   2HD   ARG 124          HD3       ARG 124  10.600   2.163 -31.412
  925    HE   ARG 124           HE       ARG 124  11.175  -0.527 -31.234
  926   1HH1  ARG 124          HH21      ARG 124   8.481   1.335 -32.586
  927   2HH1  ARG 124          HH22      ARG 124   8.134   0.176 -33.823
  928   1HH2  ARG 124          HH11      ARG 124  10.793  -1.994 -32.897
  929   2HH2  ARG 124          HH12      ARG 124   9.464  -1.784 -33.981
  930    H    ASP 125           H        ASP 125  12.909  -1.667 -30.306
  931    HA   ASP 125           HA       ASP 125  10.726  -2.769 -28.854
  932   1HB   ASP 125          HB2       ASP 125  10.987  -3.170 -31.236
  933   2HB   ASP 125          HB3       ASP 125  12.535  -3.979 -30.985
  934    H    GLU 126           H        GLU 126  14.213  -3.748 -28.992
  935    HA   GLU 126           HA       GLU 126  13.872  -6.026 -27.328
  936   1HB   GLU 126          HB2       GLU 126  16.299  -4.328 -27.982
  937   2HB   GLU 126          HB3       GLU 126  16.360  -5.795 -26.987
  938   1HG   GLU 126          HG2       GLU 126  15.399  -7.123 -28.835
  939   2HG   GLU 126          HG3       GLU 126  15.357  -5.696 -29.864
  940    H    ILE 127           H        ILE 127  14.663  -2.610 -26.525
  941    HA   ILE 127           HA       ILE 127  15.030  -2.993 -23.717
  942    HB   ILE 127           HB       ILE 127  14.202  -0.649 -25.464
  943   1HG1  ILE 127          HG12      ILE 127  16.636  -1.163 -23.694
  944   2HG1  ILE 127          HG13      ILE 127  16.600  -1.469 -25.425
  945   1HG2  ILE 127          HG21      ILE 127  13.035  -0.314 -23.290
  946   2HG2  ILE 127          HG22      ILE 127  14.590  -0.493 -22.449
  947   3HG2  ILE 127          HG23      ILE 127  14.303   0.854 -23.584
  948   1HD1  ILE 127          HD11      ILE 127  16.470   1.223 -24.025
  949   2HD1  ILE 127          HD12      ILE 127  17.690   0.626 -25.150
  950   3HD1  ILE 127          HD13      ILE 127  16.060   1.012 -25.744
  951    H    GLY 128           H        GLY 128  12.076  -2.150 -25.648
  952   1HA   GLY 128          HA1       GLY 128  10.221  -2.104 -23.583
  953   2HA   GLY 128          HA2       GLY 128   9.881  -2.627 -25.246
  954    H    ASN 129           H        ASN 129  11.356  -4.975 -25.442
  955    HA   ASN 129           HA       ASN 129   9.669  -6.849 -24.148
  956   1HB   ASN 129          HB2       ASN 129  12.331  -7.150 -25.586
  957   2HB   ASN 129          HB3       ASN 129  11.601  -8.511 -24.751
  958   1HD2  ASN 129          HD22      ASN 129  11.122  -6.226 -27.441
  959   2HD2  ASN 129          HD21      ASN 129   9.950  -7.213 -28.276
  960    H    ARG 130           H        ARG 130  13.040  -5.875 -23.297
  961    HA   ARG 130           HA       ARG 130  13.019  -7.787 -21.121
  962   1HB   ARG 130          HB2       ARG 130  15.116  -7.083 -22.233
  963   2HB   ARG 130          HB3       ARG 130  14.891  -5.442 -21.615
  964   1HG   ARG 130          HG2       ARG 130  16.491  -6.566 -20.222
  965   2HG   ARG 130          HG3       ARG 130  15.018  -6.320 -19.299
  966   1HD   ARG 130          HD2       ARG 130  14.386  -8.727 -19.769
  967   2HD   ARG 130          HD3       ARG 130  16.026  -8.954 -20.399
  968    HE   ARG 130           HE       ARG 130  15.120  -8.720 -17.646
  969   1HH1  ARG 130          HH11      ARG 130  18.021  -8.120 -19.646
  970   2HH1  ARG 130          HH12      ARG 130  19.057  -7.930 -18.278
  971   1HH2  ARG 130          HH21      ARG 130  16.504  -8.584 -15.892
  972   2HH2  ARG 130          HH22      ARG 130  18.155  -8.056 -16.085
  973    H    LEU 131           H        LEU 131  12.106  -4.326 -21.390
  974    HA   LEU 131           HA       LEU 131  11.917  -3.899 -18.579
  975   1HB   LEU 131          HB2       LEU 131  11.420  -2.324 -20.885
  976   2HB   LEU 131          HB3       LEU 131   9.879  -2.464 -20.088
  977    HG   LEU 131           HG       LEU 131  10.859  -0.530 -19.267
  978   1HD1  LEU 131          HD11      LEU 131   9.790  -1.906 -17.489
  979   2HD1  LEU 131          HD12      LEU 131  11.386  -2.554 -17.069
  980   3HD1  LEU 131          HD13      LEU 131  11.066  -0.844 -16.859
  981   1HD2  LEU 131          HD21      LEU 131  13.057  -0.225 -18.456
  982   2HD2  LEU 131          HD22      LEU 131  13.387  -1.963 -18.445
  983   3HD2  LEU 131          HD23      LEU 131  13.200  -1.087 -19.983
  984    H    LYS 132           H        LYS 132   9.636  -5.190 -21.025
  985    HA   LYS 132           HA       LYS 132   7.392  -5.460 -19.338
  986   1HB   LYS 132          HB2       LYS 132   7.351  -5.760 -21.809
  987   2HB   LYS 132          HB3       LYS 132   8.243  -7.269 -21.642
  988   1HG   LYS 132          HG2       LYS 132   6.421  -8.276 -20.356
  989   2HG   LYS 132          HG3       LYS 132   5.513  -6.746 -20.409
  990   1HD   LYS 132          HD2       LYS 132   5.389  -6.891 -22.885
  991   2HD   LYS 132          HD3       LYS 132   6.388  -8.343 -22.860
  992   1HE   LYS 132          HE2       LYS 132   4.131  -9.057 -23.163
  993   2HE   LYS 132          HE3       LYS 132   4.635  -9.534 -21.542
  994   1HZ   LYS 132          HZ1       LYS 132   3.387  -7.628 -20.676
  995   2HZ   LYS 132          HZ2       LYS 132   2.942  -7.185 -22.192
  996   3HZ   LYS 132          HZ3       LYS 132   2.415  -8.587 -21.560
  997    H    GLU 133           H        GLU 133  10.004  -7.812 -20.042
  998    HA   GLU 133           HA       GLU 133   8.975  -9.753 -18.264
  999   1HB   GLU 133          HB2       GLU 133  11.878  -9.401 -19.087
 1000   2HB   GLU 133          HB3       GLU 133  11.168 -10.818 -18.282
 1001   1HG   GLU 133          HG2       GLU 133   9.615 -11.119 -20.199
 1002   2HG   GLU 133          HG3       GLU 133  10.374  -9.764 -21.027
 1003    H    PHE 134           H        PHE 134  11.232  -7.062 -17.660
 1004    HA   PHE 134           HA       PHE 134  11.915  -7.825 -15.026
 1005   1HB   PHE 134          HB2       PHE 134  13.224  -6.181 -16.177
 1006   2HB   PHE 134          HB3       PHE 134  11.815  -5.175 -16.493
 1007    HD1  PHE 134           HD1      PHE 134  13.876  -6.511 -13.637
 1008    HD2  PHE 134           HD2      PHE 134  11.262  -3.394 -15.067
 1009    HE1  PHE 134           HE1      PHE 134  14.278  -5.206 -11.565
 1010    HE2  PHE 134           HE2      PHE 134  11.728  -2.052 -13.045
 1011    HZ   PHE 134           HZ       PHE 134  13.235  -2.966 -11.274
 1012    H    ALA 135           H        ALA 135   9.110  -6.086 -16.304
 1013    HA   ALA 135           HA       ALA 135   8.201  -5.329 -13.653
 1014   1HB   ALA 135          HB1       ALA 135   6.770  -5.239 -16.354
 1015   2HB   ALA 135          HB2       ALA 135   6.266  -4.398 -14.873
 1016   3HB   ALA 135          HB3       ALA 135   7.777  -3.935 -15.690
 1017    H    GLU 136           H        GLU 136   7.436  -7.798 -16.067
 1018    HA   GLU 136           HA       GLU 136   5.053  -8.702 -14.684
 1019   1HB   GLU 136          HB2       GLU 136   5.143  -8.530 -17.137
 1020   2HB   GLU 136          HB3       GLU 136   6.511  -9.637 -17.187
 1021   1HG   GLU 136          HG2       GLU 136   4.609 -10.876 -17.851
 1022   2HG   GLU 136          HG3       GLU 136   5.055 -11.459 -16.259
 1023    H    THR 137           H        THR 137   8.264 -10.004 -15.466
 1024    HA   THR 137           HA       THR 137   7.650 -12.469 -13.950
 1025    HB   THR 137           HB       THR 137   9.150 -13.628 -15.333
 1026    HG1  THR 137           HG1      THR 137   9.939 -11.064 -16.204
 1027   1HG2  THR 137          HG21      THR 137   7.616 -11.774 -17.198
 1028   2HG2  THR 137          HG22      THR 137   8.164 -13.429 -17.514
 1029   3HG2  THR 137          HG23      THR 137   6.894 -13.142 -16.311
 1030    H    GLY 138           H        GLY 138   9.660  -9.637 -13.889
 1031   1HA   GLY 138          HA1       GLY 138  10.920  -8.886 -12.080
 1032   2HA   GLY 138          HA2       GLY 138  10.895 -10.499 -11.362
 1033    H    LYS 139           H        LYS 139  11.748 -10.484 -14.748
 1034    HA   LYS 139           HA       LYS 139  14.413 -11.383 -14.010
 1035   1HB   LYS 139          HB2       LYS 139  12.933 -11.447 -16.654
 1036   2HB   LYS 139          HB3       LYS 139  14.546 -12.108 -16.382
 1037   1HG   LYS 139          HG2       LYS 139  12.031 -12.993 -14.916
 1038   2HG   LYS 139          HG3       LYS 139  12.734 -13.817 -16.315
 1039   1HD   LYS 139          HD2       LYS 139  14.797 -14.263 -14.942
 1040   2HD   LYS 139          HD3       LYS 139  14.021 -13.443 -13.575
 1041   1HE   LYS 139          HE2       LYS 139  13.700 -15.755 -13.201
 1042   2HE   LYS 139          HE3       LYS 139  12.141 -15.065 -13.663
 1043   1HZ   LYS 139          HZ1       LYS 139  12.574 -17.170 -14.778
 1044   2HZ   LYS 139          HZ2       LYS 139  12.481 -15.987 -15.892
 1045   3HZ   LYS 139          HZ3       LYS 139  13.937 -16.601 -15.461
  Start of MODEL   14
    1   1H    MET   1           H1       MET   1   3.561   1.467   4.243
    2   2H    MET   1           H2       MET   1   4.924   1.265   3.331
    3   3H    MET   1           H3       MET   1   4.910   2.360   4.548
    4    HA   MET   1           HA       MET   1   3.273   2.500   2.112
    5   1HB   MET   1          HB2       MET   1   3.556   4.463   4.432
    6   2HB   MET   1          HB3       MET   1   2.953   4.911   2.838
    7   1HG   MET   1          HG2       MET   1   1.069   4.533   4.211
    8   2HG   MET   1          HG3       MET   1   1.141   3.232   3.029
    9   1HE   MET   1          HE1       MET   1  -0.600   1.572   6.126
   10   2HE   MET   1          HE2       MET   1  -0.769   3.252   5.568
   11   3HE   MET   1          HE3       MET   1  -0.706   1.923   4.387
   12    H    GLU   2           H        GLU   2   4.595   2.727   0.390
   13    HA   GLU   2           HA       GLU   2   6.855   4.527   0.349
   14   1HB   GLU   2          HB2       GLU   2   8.562   2.867   0.014
   15   2HB   GLU   2          HB3       GLU   2   7.846   2.627   1.590
   16   1HG   GLU   2          HG2       GLU   2   7.282   0.980  -0.908
   17   2HG   GLU   2          HG3       GLU   2   8.349   0.518   0.409
   18    H    ASN   3           H        ASN   3   8.045   4.080  -1.888
   19    HA   ASN   3           HA       ASN   3   6.325   2.933  -3.968
   20   1HB   ASN   3          HB2       ASN   3   5.830   5.480  -3.617
   21   2HB   ASN   3          HB3       ASN   3   7.462   5.753  -4.238
   22   1HD2  ASN   3          HD22      ASN   3   7.894   5.092  -6.523
   23   2HD2  ASN   3          HD21      ASN   3   6.484   5.074  -7.601
   24    H    LYS   4           H        LYS   4   7.742   2.296  -5.788
   25    HA   LYS   4           HA       LYS   4  10.523   1.890  -4.960
   26   1HB   LYS   4          HB2       LYS   4   9.087   1.249  -7.573
   27   2HB   LYS   4          HB3       LYS   4  10.653   0.637  -7.113
   28   1HG   LYS   4          HG2       LYS   4   8.022   0.013  -5.673
   29   2HG   LYS   4          HG3       LYS   4   8.719  -0.973  -6.941
   30   1HD   LYS   4          HD2       LYS   4  10.040  -0.411  -4.259
   31   2HD   LYS   4          HD3       LYS   4   9.180  -1.893  -4.725
   32   1HE   LYS   4          HE2       LYS   4  10.805  -2.087  -6.691
   33   2HE   LYS   4          HE3       LYS   4  11.732  -0.773  -5.947
   34   1HZ   LYS   4          HZ1       LYS   4  11.313  -3.488  -4.873
   35   2HZ   LYS   4          HZ2       LYS   4  12.729  -2.703  -5.198
   36   3HZ   LYS   4          HZ3       LYS   4  11.824  -2.260  -3.916
   37    H    ILE   5           H        ILE   5  12.255   2.376  -6.621
   38    HA   ILE   5           HA       ILE   5  11.851   4.788  -8.234
   39    HB   ILE   5           HB       ILE   5  14.116   4.522  -6.241
   40   1HG1  ILE   5          HG12      ILE   5  12.988   6.738  -5.252
   41   2HG1  ILE   5          HG13      ILE   5  11.517   5.946  -5.786
   42   1HG2  ILE   5          HG21      ILE   5  13.250   6.899  -7.946
   43   2HG2  ILE   5          HG22      ILE   5  14.636   6.878  -6.840
   44   3HG2  ILE   5          HG23      ILE   5  14.644   5.865  -8.280
   45   1HD1  ILE   5          HD11      ILE   5  12.210   3.920  -4.395
   46   2HD1  ILE   5          HD12      ILE   5  13.659   4.815  -3.921
   47   3HD1  ILE   5          HD13      ILE   5  12.057   5.405  -3.437
   48    H    ILE   6           H        ILE   6  13.241   4.640 -10.080
   49    HA   ILE   6           HA       ILE   6  15.302   2.548 -10.131
   50    HB   ILE   6           HB       ILE   6  13.312   1.311 -10.744
   51   1HG1  ILE   6          HG12      ILE   6  15.012   1.771 -13.230
   52   2HG1  ILE   6          HG13      ILE   6  15.496   0.798 -11.836
   53   1HG2  ILE   6          HG21      ILE   6  11.933   1.816 -12.698
   54   2HG2  ILE   6          HG22      ILE   6  11.925   3.206 -11.626
   55   3HG2  ILE   6          HG23      ILE   6  12.945   3.218 -13.089
   56   1HD1  ILE   6          HD11      ILE   6  13.167   0.232 -13.719
   57   2HD1  ILE   6          HD12      ILE   6  14.684  -0.657 -13.581
   58   3HD1  ILE   6          HD13      ILE   6  13.522  -0.690 -12.236
   59    H    TYR   7           H        TYR   7  16.844   2.872 -11.827
   60    HA   TYR   7           HA       TYR   7  16.652   5.480 -13.226
   61   1HB   TYR   7          HB2       TYR   7  17.916   5.303 -10.905
   62   2HB   TYR   7          HB3       TYR   7  19.156   4.496 -11.828
   63    HD1  TYR   7           HD1      TYR   7  17.527   7.320 -13.597
   64    HD2  TYR   7           HD2      TYR   7  20.548   6.234 -10.711
   65    HE1  TYR   7           HE1      TYR   7  18.330   9.637 -13.580
   66    HE2  TYR   7           HE2      TYR   7  21.364   8.569 -10.703
   67    HH   TYR   7           HH       TYR   7  19.738  11.174 -12.547
   68    H    PHE   8           H        PHE   8  17.498   5.427 -15.283
   69    HA   PHE   8           HA       PHE   8  19.002   2.988 -16.180
   70   1HB   PHE   8          HB2       PHE   8  17.117   4.774 -17.779
   71   2HB   PHE   8          HB3       PHE   8  18.015   3.404 -18.404
   72    HD1  PHE   8           HD1      PHE   8  14.940   4.471 -16.879
   73    HD2  PHE   8           HD2      PHE   8  17.514   1.050 -17.381
   74    HE1  PHE   8           HE1      PHE   8  13.078   2.947 -16.290
   75    HE2  PHE   8           HE2      PHE   8  15.654  -0.453 -16.747
   76    HZ   PHE   8           HZ       PHE   8  13.437   0.500 -16.162
   77    H    LEU   9           H        LEU   9  21.009   3.421 -17.001
   78    HA   LEU   9           HA       LEU   9  21.767   6.288 -17.360
   79   1HB   LEU   9          HB2       LEU   9  23.261   4.002 -16.040
   80   2HB   LEU   9          HB3       LEU   9  23.921   5.610 -16.329
   81    HG   LEU   9           HG       LEU   9  21.637   4.909 -14.439
   82   1HD1  LEU   9          HD11      LEU   9  24.452   5.972 -13.932
   83   2HD1  LEU   9          HD12      LEU   9  23.220   5.620 -12.708
   84   3HD1  LEU   9          HD13      LEU   9  23.912   4.302 -13.672
   85   1HD2  LEU   9          HD21      LEU   9  21.834   7.319 -13.738
   86   2HD2  LEU   9          HD22      LEU   9  22.819   7.608 -15.196
   87   3HD2  LEU   9          HD23      LEU   9  21.125   7.091 -15.329
   88    H    CYS  10           H        CYS  10  23.007   6.819 -19.060
   89    HA   CYS  10           HA       CYS  10  24.362   4.675 -20.633
   90   1HB   CYS  10          HB2       CYS  10  22.557   6.889 -21.728
   91   2HB   CYS  10          HB3       CYS  10  23.624   5.900 -22.731
   92    HG   CYS  10           HG       CYS  10  22.701   3.596 -21.994
   93    H    THR  11           H        THR  11  25.758   5.722 -22.385
   94    HA   THR  11           HA       THR  11  27.791   7.344 -21.302
   95    HB   THR  11           HB       THR  11  28.382   7.495 -23.820
   96    HG1  THR  11           HG1      THR  11  26.177   7.195 -24.534
   97   1HG2  THR  11          HG21      THR  11  29.173   5.700 -22.237
   98   2HG2  THR  11          HG22      THR  11  27.803   4.694 -22.752
   99   3HG2  THR  11          HG23      THR  11  29.035   5.177 -23.937
  100    H    GLY  12           H        GLY  12  24.730   8.200 -22.874
  101   1HA   GLY  12          HA1       GLY  12  24.968  10.882 -21.885
  102   2HA   GLY  12          HA2       GLY  12  24.878  10.804 -23.659
  103    H    ASN  13           H        ASN  13  22.864  11.636 -21.512
  104    HA   ASN  13           HA       ASN  13  20.831   9.556 -21.486
  105   1HB   ASN  13          HB2       ASN  13  21.240  11.144 -19.589
  106   2HB   ASN  13          HB3       ASN  13  20.660  12.459 -20.605
  107   1HD2  ASN  13          HD22      ASN  13  19.237   9.048 -20.216
  108   2HD2  ASN  13          HD21      ASN  13  17.714   9.684 -19.621
  109    H    SER  14           H        SER  14  21.073   9.700 -24.065
  110    HA   SER  14           HA       SER  14  18.973  11.601 -25.034
  111   1HB   SER  14          HB2       SER  14  21.617  10.911 -26.353
  112   2HB   SER  14          HB3       SER  14  20.368  11.977 -27.024
  113    HG   SER  14           HG       SER  14  20.682  13.412 -25.424
  114    H    CYS  15           H        CYS  15  20.036   8.287 -25.111
  115    HA   CYS  15           HA       CYS  15  18.038   7.749 -27.265
  116   1HB   CYS  15          HB2       CYS  15  20.823   6.510 -27.076
  117   2HB   CYS  15          HB3       CYS  15  19.579   6.136 -28.280
  118    HG   CYS  15           HG       CYS  15  21.637   7.480 -29.179
  119    H    ARG  16           H        ARG  16  20.112   5.314 -25.826
  120    HA   ARG  16           HA       ARG  16  18.017   3.531 -25.404
  121   1HB   ARG  16          HB2       ARG  16  20.755   3.768 -24.141
  122   2HB   ARG  16          HB3       ARG  16  19.728   2.379 -23.856
  123   1HG   ARG  16          HG2       ARG  16  19.902   1.599 -26.053
  124   2HG   ARG  16          HG3       ARG  16  20.467   3.151 -26.686
  125   1HD   ARG  16          HD2       ARG  16  22.045   1.450 -24.702
  126   2HD   ARG  16          HD3       ARG  16  22.287   1.409 -26.455
  127    HE   ARG  16           HE       ARG  16  22.511   4.074 -25.963
  128   1HH1  ARG  16          HH21      ARG  16  24.180   1.335 -24.390
  129   2HH1  ARG  16          HH22      ARG  16  25.716   2.185 -24.438
  130   1HH2  ARG  16          HH11      ARG  16  24.316   5.162 -25.726
  131   2HH2  ARG  16          HH12      ARG  16  25.691   4.572 -24.821
  132    H    SER  17           H        SER  17  19.585   5.568 -22.799
  133    HA   SER  17           HA       SER  17  17.918   4.438 -20.781
  134   1HB   SER  17          HB2       SER  17  18.745   6.399 -19.424
  135   2HB   SER  17          HB3       SER  17  19.972   5.382 -20.128
  136    HG   SER  17           HG       SER  17  20.695   7.267 -20.759
  137    H    GLN  18           H        GLN  18  17.539   7.332 -22.797
  138    HA   GLN  18           HA       GLN  18  15.220   8.420 -21.556
  139   1HB   GLN  18          HB2       GLN  18  16.474   8.572 -24.318
  140   2HB   GLN  18          HB3       GLN  18  14.892   9.254 -24.067
  141   1HG   GLN  18          HG2       GLN  18  17.283   9.982 -22.323
  142   2HG   GLN  18          HG3       GLN  18  16.891  10.835 -23.815
  143   1HE2  GLN  18          HE22      GLN  18  16.804  11.823 -20.865
  144   2HE2  GLN  18          HE21      GLN  18  15.158  12.445 -20.757
  145    H    MET  19           H        MET  19  15.476   6.269 -24.403
  146    HA   MET  19           HA       MET  19  12.725   5.720 -24.685
  147   1HB   MET  19          HB2       MET  19  15.074   3.885 -25.340
  148   2HB   MET  19          HB3       MET  19  13.415   3.678 -25.902
  149   1HG   MET  19          HG2       MET  19  13.655   6.088 -26.865
  150   2HG   MET  19          HG3       MET  19  15.390   5.843 -26.673
  151   1HE   MET  19          HE1       MET  19  16.062   2.828 -29.126
  152   2HE   MET  19          HE2       MET  19  16.791   3.923 -27.924
  153   3HE   MET  19          HE3       MET  19  15.643   2.661 -27.410
  154    H    ALA  20           H        ALA  20  15.149   3.932 -22.684
  155    HA   ALA  20           HA       ALA  20  13.396   1.870 -21.866
  156   1HB   ALA  20          HB1       ALA  20  15.780   3.065 -20.376
  157   2HB   ALA  20          HB2       ALA  20  15.026   1.493 -20.051
  158   3HB   ALA  20          HB3       ALA  20  15.850   1.772 -21.598
  159    H    GLU  21           H        GLU  21  14.099   5.012 -20.254
  160    HA   GLU  21           HA       GLU  21  12.368   4.649 -18.052
  161   1HB   GLU  21          HB2       GLU  21  13.973   6.521 -18.355
  162   2HB   GLU  21          HB3       GLU  21  12.885   7.240 -19.556
  163   1HG   GLU  21          HG2       GLU  21  11.114   7.163 -17.609
  164   2HG   GLU  21          HG3       GLU  21  12.509   6.906 -16.569
  165    H    GLY  22           H        GLY  22  11.597   5.713 -21.385
  166   1HA   GLY  22          HA1       GLY  22   8.882   6.444 -21.026
  167   2HA   GLY  22          HA2       GLY  22   9.633   5.827 -22.529
  168    H    TRP  23           H        TRP  23  10.302   3.309 -22.067
  169    HA   TRP  23           HA       TRP  23   7.825   1.870 -22.113
  170   1HB   TRP  23          HB2       TRP  23  10.723   0.998 -21.741
  171   2HB   TRP  23          HB3       TRP  23   9.383  -0.137 -21.799
  172    HD1  TRP  23           HD1      TRP  23  11.709   1.648 -24.051
  173    HE1  TRP  23           HE1      TRP  23  11.083   1.264 -26.483
  174    HE3  TRP  23           HE3      TRP  23   7.025  -0.286 -23.363
  175    HZ2  TRP  23           HZ2      TRP  23   8.862   0.090 -27.967
  176    HZ3  TRP  23           HZ3      TRP  23   5.712  -1.111 -25.290
  177    HH2  TRP  23           HH2      TRP  23   6.631  -0.974 -27.586
  178    H    ALA  24           H        ALA  24  10.284   2.305 -19.556
  179    HA   ALA  24           HA       ALA  24   9.211   0.413 -17.787
  180   1HB   ALA  24          HB1       ALA  24  11.489   1.279 -17.619
  181   2HB   ALA  24          HB2       ALA  24  10.880   2.897 -17.293
  182   3HB   ALA  24          HB3       ALA  24  10.643   1.588 -16.099
  183    H    LYS  25           H        LYS  25   8.522   3.973 -17.968
  184    HA   LYS  25           HA       LYS  25   6.783   3.943 -15.715
  185   1HB   LYS  25          HB2       LYS  25   6.801   5.692 -18.200
  186   2HB   LYS  25          HB3       LYS  25   5.678   5.946 -16.840
  187   1HG   LYS  25          HG2       LYS  25   7.500   6.178 -15.261
  188   2HG   LYS  25          HG3       LYS  25   8.701   5.851 -16.518
  189   1HD   LYS  25          HD2       LYS  25   6.865   8.279 -16.446
  190   2HD   LYS  25          HD3       LYS  25   8.552   8.220 -15.896
  191   1HE   LYS  25          HE2       LYS  25   9.099   7.320 -18.272
  192   2HE   LYS  25          HE3       LYS  25   7.491   7.897 -18.727
  193   1HZ   LYS  25          HZ1       LYS  25   8.199  10.128 -17.991
  194   2HZ   LYS  25          HZ2       LYS  25   9.708   9.532 -17.606
  195   3HZ   LYS  25          HZ3       LYS  25   9.225   9.511 -19.139
  196    H    GLN  26           H        GLN  26   6.170   2.962 -19.059
  197    HA   GLN  26           HA       GLN  26   3.329   2.797 -18.716
  198   1HB   GLN  26          HB2       GLN  26   4.849   0.996 -20.626
  199   2HB   GLN  26          HB3       GLN  26   3.171   1.500 -20.687
  200   1HG   GLN  26          HG2       GLN  26   5.643   3.006 -21.433
  201   2HG   GLN  26          HG3       GLN  26   4.187   2.729 -22.364
  202   1HE2  GLN  26          HE22      GLN  26   5.892   5.094 -20.771
  203   2HE2  GLN  26          HE21      GLN  26   4.584   6.225 -20.451
  204    H    TYR  27           H        TYR  27   5.832   0.233 -18.572
  205    HA   TYR  27           HA       TYR  27   3.865  -1.761 -17.848
  206   1HB   TYR  27          HB2       TYR  27   6.906  -1.875 -17.767
  207   2HB   TYR  27          HB3       TYR  27   5.830  -3.246 -17.553
  208    HD1  TYR  27           HD1      TYR  27   7.831  -1.644 -19.899
  209    HD2  TYR  27           HD2      TYR  27   3.965  -3.507 -19.521
  210    HE1  TYR  27           HE1      TYR  27   7.888  -2.237 -22.306
  211    HE2  TYR  27           HE2      TYR  27   3.949  -3.988 -21.944
  212    HH   TYR  27           HH       TYR  27   5.128  -3.862 -23.950
  213    H    LEU  28           H        LEU  28   6.440  -0.068 -15.994
  214    HA   LEU  28           HA       LEU  28   5.973  -1.557 -13.560
  215   1HB   LEU  28          HB2       LEU  28   7.312   1.152 -14.004
  216   2HB   LEU  28          HB3       LEU  28   7.399   0.201 -12.561
  217    HG   LEU  28           HG       LEU  28   8.559  -0.662 -15.225
  218   1HD1  LEU  28          HD11      LEU  28  10.714  -0.191 -14.210
  219   2HD1  LEU  28          HD12      LEU  28   9.699   1.262 -14.077
  220   3HD1  LEU  28          HD13      LEU  28   9.947   0.231 -12.663
  221   1HD2  LEU  28          HD21      LEU  28   7.858  -2.601 -13.808
  222   2HD2  LEU  28          HD22      LEU  28   9.604  -2.486 -13.985
  223   3HD2  LEU  28          HD23      LEU  28   8.831  -1.956 -12.477
  224    H    GLY  29           H        GLY  29   4.805   1.524 -14.835
  225   1HA   GLY  29          HA1       GLY  29   2.944   2.762 -14.236
  226   2HA   GLY  29          HA2       GLY  29   2.712   1.763 -12.788
  227    H    ASP  30           H        ASP  30   2.598   4.326 -12.318
  228    HA   ASP  30           HA       ASP  30   5.068   5.621 -11.636
  229   1HB   ASP  30          HB2       ASP  30   2.961   6.839 -12.096
  230   2HB   ASP  30          HB3       ASP  30   2.231   6.119 -10.658
  231    H    GLU  31           H        GLU  31   3.778   2.833 -10.431
  232    HA   GLU  31           HA       GLU  31   4.155   3.110  -7.580
  233   1HB   GLU  31          HB2       GLU  31   4.252   0.658  -9.395
  234   2HB   GLU  31          HB3       GLU  31   4.266   0.628  -7.628
  235   1HG   GLU  31          HG2       GLU  31   2.038   1.799  -7.645
  236   2HG   GLU  31          HG3       GLU  31   2.017   1.643  -9.406
  237    H    TRP  32           H        TRP  32   6.224   3.265 -10.241
  238    HA   TRP  32           HA       TRP  32   8.598   3.014  -8.525
  239   1HB   TRP  32          HB2       TRP  32   8.398   2.265 -11.472
  240   2HB   TRP  32          HB3       TRP  32   9.849   2.218 -10.484
  241    HD1  TRP  32           HD1      TRP  32   6.329   0.564 -10.346
  242    HE1  TRP  32           HE1      TRP  32   6.584  -1.910  -9.765
  243    HE3  TRP  32           HE3      TRP  32  11.433   0.340  -9.904
  244    HZ2  TRP  32           HZ2      TRP  32   8.705  -3.789  -9.362
  245    HZ3  TRP  32           HZ3      TRP  32  12.551  -1.838  -9.504
  246    HH2  TRP  32           HH2      TRP  32  11.201  -3.919  -9.264
  247    H    LYS  33           H        LYS  33   9.507   4.964  -8.383
  248    HA   LYS  33           HA       LYS  33   8.833   7.142 -10.176
  249   1HB   LYS  33          HB2       LYS  33  10.861   6.874  -7.898
  250   2HB   LYS  33          HB3       LYS  33  10.518   8.375  -8.774
  251   1HG   LYS  33          HG2       LYS  33   8.815   6.877  -6.791
  252   2HG   LYS  33          HG3       LYS  33   9.374   8.532  -6.723
  253   1HD   LYS  33          HD2       LYS  33   7.183   7.441  -8.546
  254   2HD   LYS  33          HD3       LYS  33   6.973   8.435  -7.106
  255   1HE   LYS  33          HE2       LYS  33   8.225  10.295  -8.204
  256   2HE   LYS  33          HE3       LYS  33   8.390   9.310  -9.664
  257   1HZ   LYS  33          HZ1       LYS  33   5.934   9.258  -9.798
  258   2HZ   LYS  33          HZ2       LYS  33   5.837  10.253  -8.499
  259   3HZ   LYS  33          HZ3       LYS  33   6.524  10.787  -9.878
  260    H    VAL  34           H        VAL  34   9.425   6.364 -12.162
  261    HA   VAL  34           HA       VAL  34  12.012   5.249 -12.671
  262    HB   VAL  34           HB       VAL  34  10.083   6.321 -14.741
  263   1HG1  VAL  34          HG11      VAL  34  10.935   4.727 -16.166
  264   2HG1  VAL  34          HG12      VAL  34  12.391   5.161 -15.253
  265   3HG1  VAL  34          HG13      VAL  34  11.521   3.673 -14.855
  266   1HG2  VAL  34          HG21      VAL  34   9.690   3.752 -13.151
  267   2HG2  VAL  34          HG22      VAL  34   8.536   5.083 -13.393
  268   3HG2  VAL  34          HG23      VAL  34   8.953   4.033 -14.742
  269    H    TYR  35           H        TYR  35  13.792   6.285 -13.511
  270    HA   TYR  35           HA       TYR  35  13.592   9.030 -14.609
  271   1HB   TYR  35          HB2       TYR  35  15.535   8.115 -12.444
  272   2HB   TYR  35          HB3       TYR  35  15.633   9.645 -13.296
  273    HD1  TYR  35           HD1      TYR  35  13.814  11.390 -12.982
  274    HD2  TYR  35           HD2      TYR  35  14.133   7.861 -10.517
  275    HE1  TYR  35           HE1      TYR  35  12.449  12.493 -11.234
  276    HE2  TYR  35           HE2      TYR  35  12.806   8.965  -8.753
  277    HH   TYR  35           HH       TYR  35  11.660  10.902  -8.107
  278    H    SER  36           H        SER  36  15.673   9.581 -15.770
  279    HA   SER  36           HA       SER  36  17.511   7.364 -16.230
  280   1HB   SER  36          HB2       SER  36  17.519   7.759 -18.656
  281   2HB   SER  36          HB3       SER  36  15.992   7.094 -18.095
  282    HG   SER  36           HG       SER  36  15.076   9.149 -18.266
  283    H    ALA  37           H        ALA  37  19.578   8.116 -17.052
  284    HA   ALA  37           HA       ALA  37  20.114  10.928 -17.359
  285   1HB   ALA  37          HB1       ALA  37  21.174   9.553 -14.847
  286   2HB   ALA  37          HB2       ALA  37  21.646  11.154 -15.446
  287   3HB   ALA  37          HB3       ALA  37  20.001  10.888 -14.903
  288    H    GLY  38           H        GLY  38  22.879  10.876 -16.959
  289   1HA   GLY  38          HA1       GLY  38  24.174   8.513 -17.808
  290   2HA   GLY  38          HA2       GLY  38  23.893   9.564 -19.214
  291    H    ILE  39           H        ILE  39  26.386   9.215 -18.867
  292    HA   ILE  39           HA       ILE  39  27.860  10.826 -17.065
  293    HB   ILE  39           HB       ILE  39  28.240   9.463 -19.719
  294   1HG1  ILE  39          HG12      ILE  39  30.018   9.319 -17.268
  295   2HG1  ILE  39          HG13      ILE  39  28.503   8.441 -17.361
  296   1HG2  ILE  39          HG21      ILE  39  30.337  11.388 -18.684
  297   2HG2  ILE  39          HG22      ILE  39  30.572  10.188 -19.978
  298   3HG2  ILE  39          HG23      ILE  39  29.428  11.497 -20.218
  299   1HD1  ILE  39          HD11      ILE  39  30.313   6.960 -18.031
  300   2HD1  ILE  39          HD12      ILE  39  29.299   7.284 -19.450
  301   3HD1  ILE  39          HD13      ILE  39  30.866   8.100 -19.258
  302    H    GLU  40           H        GLU  40  25.972  11.717 -19.900
  303    HA   GLU  40           HA       GLU  40  26.363  14.506 -19.296
  304   1HB   GLU  40          HB2       GLU  40  26.839  15.197 -21.575
  305   2HB   GLU  40          HB3       GLU  40  28.150  14.233 -20.901
  306   1HG   GLU  40          HG2       GLU  40  27.405  12.258 -22.153
  307   2HG   GLU  40          HG3       GLU  40  25.991  13.121 -22.761
  308    H    ALA  41           H        ALA  41  24.765  15.797 -20.729
  309    HA   ALA  41           HA       ALA  41  22.638  14.260 -22.000
  310   1HB   ALA  41          HB1       ALA  41  21.750  14.421 -19.731
  311   2HB   ALA  41          HB2       ALA  41  22.157  16.153 -19.640
  312   3HB   ALA  41          HB3       ALA  41  20.893  15.599 -20.750
  313    H    HIS  42           H        HIS  42  22.019  15.395 -23.787
  314    HA   HIS  42           HA       HIS  42  22.463  18.342 -23.909
  315   1HB   HIS  42          HB2       HIS  42  23.098  16.253 -26.037
  316   2HB   HIS  42          HB3       HIS  42  22.950  17.969 -26.379
  317    HD1  HIS  42           HD1      HIS  42  24.758  17.955 -23.217
  318    HD2  HIS  42           HD2      HIS  42  25.597  17.172 -27.268
  319    HE1  HIS  42           HE1      HIS  42  27.274  18.271 -23.503
  320    H    GLY  43           H        GLY  43  20.173  16.128 -23.509
  321   1HA   GLY  43          HA1       GLY  43  17.828  16.586 -23.862
  322   2HA   GLY  43          HA2       GLY  43  18.209  17.340 -25.415
  323    H    LEU  44           H        LEU  44  16.369  15.370 -25.434
  324    HA   LEU  44           HA       LEU  44  17.637  12.799 -25.925
  325   1HB   LEU  44          HB2       LEU  44  15.505  11.862 -26.052
  326   2HB   LEU  44          HB3       LEU  44  15.537  12.948 -24.671
  327    HG   LEU  44           HG       LEU  44  14.188  13.455 -27.363
  328   1HD1  LEU  44          HD11      LEU  44  12.126  13.199 -26.019
  329   2HD1  LEU  44          HD12      LEU  44  13.153  11.758 -25.909
  330   3HD1  LEU  44          HD13      LEU  44  13.097  12.910 -24.564
  331   1HD2  LEU  44          HD21      LEU  44  13.076  15.393 -26.207
  332   2HD2  LEU  44          HD22      LEU  44  14.219  15.213 -24.862
  333   3HD2  LEU  44          HD23      LEU  44  14.788  15.656 -26.501
  334    H    ASN  45           H        ASN  45  17.501  11.601 -27.841
  335    HA   ASN  45           HA       ASN  45  18.187  13.164 -30.165
  336   1HB   ASN  45          HB2       ASN  45  19.231  11.004 -29.434
  337   2HB   ASN  45          HB3       ASN  45  17.731  10.162 -29.795
  338   1HD2  ASN  45          HD22      ASN  45  20.708  10.443 -30.973
  339   2HD2  ASN  45          HD21      ASN  45  20.388  10.419 -32.692
  340    HA   PRO  46           HA       PRO  46  13.967  13.388 -31.673
  341   1HB   PRO  46          HB2       PRO  46  14.351  13.748 -34.398
  342   2HB   PRO  46          HB3       PRO  46  14.504  15.027 -33.157
  343   1HG   PRO  46          HG2       PRO  46  16.704  13.347 -34.386
  344   2HG   PRO  46          HG3       PRO  46  16.675  15.122 -34.128
  345   1HD   PRO  46          HD2       PRO  46  17.959  13.484 -32.406
  346   2HD   PRO  46          HD3       PRO  46  17.013  14.870 -31.790
  347    H    ASN  47           H        ASN  47  16.258  11.003 -33.053
  348    HA   ASN  47           HA       ASN  47  14.119   9.418 -34.260
  349   1HB   ASN  47          HB2       ASN  47  17.023   8.817 -33.644
  350   2HB   ASN  47          HB3       ASN  47  15.909   7.616 -34.288
  351   1HD2  ASN  47          HD22      ASN  47  18.394   8.961 -35.475
  352   2HD2  ASN  47          HD21      ASN  47  17.840   9.494 -37.040
  353    H    ALA  48           H        ALA  48  15.528   9.741 -31.032
  354    HA   ALA  48           HA       ALA  48  14.474   7.262 -30.013
  355   1HB   ALA  48          HB1       ALA  48  15.052   9.800 -28.415
  356   2HB   ALA  48          HB2       ALA  48  14.956   8.138 -27.828
  357   3HB   ALA  48          HB3       ALA  48  16.301   8.632 -28.869
  358    H    VAL  49           H        VAL  49  13.348  10.689 -30.157
  359    HA   VAL  49           HA       VAL  49  10.813  10.243 -29.000
  360    HB   VAL  49           HB       VAL  49  11.516  12.265 -31.175
  361   1HG1  VAL  49          HG11      VAL  49   9.081  12.056 -30.899
  362   2HG1  VAL  49          HG12      VAL  49   9.246  12.220 -29.138
  363   3HG1  VAL  49          HG13      VAL  49   9.645  13.580 -30.209
  364   1HG2  VAL  49          HG21      VAL  49  11.850  13.836 -29.281
  365   2HG2  VAL  49          HG22      VAL  49  11.605  12.498 -28.142
  366   3HG2  VAL  49          HG23      VAL  49  13.012  12.513 -29.225
  367    H    LYS  50           H        LYS  50  11.745  10.076 -32.526
  368    HA   LYS  50           HA       LYS  50   9.205   9.190 -33.414
  369   1HB   LYS  50          HB2       LYS  50  12.007   8.640 -34.492
  370   2HB   LYS  50          HB3       LYS  50  10.572   8.068 -35.301
  371   1HG   LYS  50          HG2       LYS  50  11.233  10.994 -34.767
  372   2HG   LYS  50          HG3       LYS  50  11.417  10.145 -36.296
  373   1HD   LYS  50          HD2       LYS  50   8.806  10.818 -34.880
  374   2HD   LYS  50          HD3       LYS  50   9.433  11.500 -36.379
  375   1HE   LYS  50          HE2       LYS  50   9.292   9.220 -37.439
  376   2HE   LYS  50          HE3       LYS  50   8.546   8.603 -35.959
  377   1HZ   LYS  50          HZ1       LYS  50   6.720  10.178 -36.315
  378   2HZ   LYS  50          HZ2       LYS  50   7.414  10.730 -37.688
  379   3HZ   LYS  50          HZ3       LYS  50   6.886   9.194 -37.603
  380    H    ALA  51           H        ALA  51  11.941   7.248 -32.151
  381    HA   ALA  51           HA       ALA  51  10.874   4.710 -32.704
  382   1HB   ALA  51          HB1       ALA  51  12.343   4.049 -30.704
  383   2HB   ALA  51          HB2       ALA  51  13.164   4.931 -32.011
  384   3HB   ALA  51          HB3       ALA  51  12.714   5.744 -30.503
  385    H    MET  52           H        MET  52  10.434   6.789 -29.785
  386    HA   MET  52           HA       MET  52   8.694   4.828 -28.550
  387   1HB   MET  52          HB2       MET  52   9.177   7.759 -27.906
  388   2HB   MET  52          HB3       MET  52   8.286   6.626 -26.889
  389   1HG   MET  52          HG2       MET  52  11.234   6.564 -27.600
  390   2HG   MET  52          HG3       MET  52  10.505   6.754 -26.020
  391   1HE   MET  52          HE1       MET  52   9.062   4.930 -24.899
  392   2HE   MET  52          HE2       MET  52   8.270   4.192 -26.324
  393   3HE   MET  52          HE3       MET  52   9.190   3.192 -25.194
  394    H    LYS  53           H        LYS  53   8.098   7.747 -30.561
  395    HA   LYS  53           HA       LYS  53   5.268   7.610 -30.299
  396   1HB   LYS  53          HB2       LYS  53   7.086   8.655 -32.483
  397   2HB   LYS  53          HB3       LYS  53   5.339   8.853 -32.549
  398   1HG   LYS  53          HG2       LYS  53   6.770   9.786 -30.045
  399   2HG   LYS  53          HG3       LYS  53   6.972  10.721 -31.524
  400   1HD   LYS  53          HD2       LYS  53   5.212  11.691 -30.221
  401   2HD   LYS  53          HD3       LYS  53   4.536  11.025 -31.712
  402   1HE   LYS  53          HE2       LYS  53   3.747   9.028 -30.454
  403   2HE   LYS  53          HE3       LYS  53   4.452   9.684 -28.968
  404   1HZ   LYS  53          HZ1       LYS  53   2.083  10.157 -29.109
  405   2HZ   LYS  53          HZ2       LYS  53   2.901  11.567 -29.177
  406   3HZ   LYS  53          HZ3       LYS  53   2.254  10.927 -30.532
  407    H    GLU  54           H        GLU  54   7.509   5.606 -32.135
  408    HA   GLU  54           HA       GLU  54   5.648   4.527 -33.972
  409   1HB   GLU  54          HB2       GLU  54   8.316   4.382 -33.677
  410   2HB   GLU  54          HB3       GLU  54   7.904   2.839 -32.953
  411   1HG   GLU  54          HG2       GLU  54   7.082   3.806 -35.731
  412   2HG   GLU  54          HG3       GLU  54   8.505   2.838 -35.399
  413    H    VAL  55           H        VAL  55   5.976   4.105 -30.521
  414    HA   VAL  55           HA       VAL  55   4.119   1.767 -30.613
  415    HB   VAL  55           HB       VAL  55   5.126   1.091 -28.473
  416   1HG1  VAL  55          HG11      VAL  55   7.174   1.460 -30.707
  417   2HG1  VAL  55          HG12      VAL  55   7.179   0.208 -29.461
  418   3HG1  VAL  55          HG13      VAL  55   5.909   0.214 -30.681
  419   1HG2  VAL  55          HG21      VAL  55   7.136   2.105 -27.600
  420   2HG2  VAL  55          HG22      VAL  55   7.277   3.188 -28.983
  421   3HG2  VAL  55          HG23      VAL  55   5.971   3.410 -27.793
  422    H    GLY  56           H        GLY  56   4.158   5.055 -29.925
  423   1HA   GLY  56          HA1       GLY  56   2.204   6.216 -29.375
  424   2HA   GLY  56          HA2       GLY  56   1.516   4.768 -28.624
  425    H    ILE  57           H        ILE  57   4.797   6.074 -28.028
  426    HA   ILE  57           HA       ILE  57   4.029   6.925 -25.288
  427    HB   ILE  57           HB       ILE  57   6.461   5.347 -26.210
  428   1HG1  ILE  57          HG12      ILE  57   4.328   4.584 -24.168
  429   2HG1  ILE  57          HG13      ILE  57   4.363   4.002 -25.829
  430   1HG2  ILE  57          HG21      ILE  57   7.186   5.420 -23.791
  431   2HG2  ILE  57          HG22      ILE  57   7.199   6.991 -24.559
  432   3HG2  ILE  57          HG23      ILE  57   5.862   6.546 -23.467
  433   1HD1  ILE  57          HD11      ILE  57   6.436   3.363 -23.705
  434   2HD1  ILE  57          HD12      ILE  57   5.252   2.278 -24.446
  435   3HD1  ILE  57          HD13      ILE  57   6.571   2.926 -25.421
  436    H    ASP  58           H        ASP  58   5.456   8.702 -24.592
  437    HA   ASP  58           HA       ASP  58   6.572  10.313 -26.832
  438   1HB   ASP  58          HB2       ASP  58   4.232  10.917 -26.768
  439   2HB   ASP  58          HB3       ASP  58   4.308  11.199 -25.022
  440    H    ILE  59           H        ILE  59   8.553   9.815 -25.852
  441    HA   ILE  59           HA       ILE  59   9.124  10.625 -23.151
  442    HB   ILE  59           HB       ILE  59  11.511  10.138 -23.792
  443   1HG1  ILE  59          HG12      ILE  59  10.356   9.148 -26.432
  444   2HG1  ILE  59          HG13      ILE  59  11.186  10.684 -26.271
  445   1HG2  ILE  59          HG21      ILE  59   9.916   8.497 -22.791
  446   2HG2  ILE  59          HG22      ILE  59   9.471   7.950 -24.411
  447   3HG2  ILE  59          HG23      ILE  59  11.130   7.732 -23.806
  448   1HD1  ILE  59          HD11      ILE  59  12.409   7.951 -25.652
  449   2HD1  ILE  59          HD12      ILE  59  12.732   8.970 -27.061
  450   3HD1  ILE  59          HD13      ILE  59  13.217   9.516 -25.455
  451    H    SER  60           H        SER  60   8.448  12.692 -25.722
  452    HA   SER  60           HA       SER  60  10.439  14.681 -25.409
  453   1HB   SER  60          HB2       SER  60   7.507  15.295 -25.819
  454   2HB   SER  60          HB3       SER  60   8.921  16.149 -26.455
  455    HG   SER  60           HG       SER  60   7.651  13.792 -27.243
  456    H    ASN  61           H        ASN  61   8.034  13.565 -23.192
  457    HA   ASN  61           HA       ASN  61   7.791  16.029 -21.656
  458   1HB   ASN  61          HB2       ASN  61   6.779  13.200 -21.104
  459   2HB   ASN  61          HB3       ASN  61   6.328  14.643 -20.205
  460   1HD2  ASN  61          HD22      ASN  61   5.748  12.801 -23.125
  461   2HD2  ASN  61          HD21      ASN  61   4.658  13.910 -23.901
  462    H    GLN  62           H        GLN  62  10.381  13.932 -21.816
  463    HA   GLN  62           HA       GLN  62  11.044  14.254 -18.928
  464   1HB   GLN  62          HB2       GLN  62  12.004  11.923 -18.992
  465   2HB   GLN  62          HB3       GLN  62  10.243  12.006 -19.049
  466   1HG   GLN  62          HG2       GLN  62  10.157  11.506 -21.359
  467   2HG   GLN  62          HG3       GLN  62  11.882  11.829 -21.585
  468   1HE2  GLN  62          HE22      GLN  62  13.234  10.172 -21.619
  469   2HE2  GLN  62          HE21      GLN  62  12.790   8.504 -21.240
  470    H    THR  63           H        THR  63  11.899  16.118 -20.534
  471    HA   THR  63           HA       THR  63  14.101  15.776 -22.160
  472    HB   THR  63           HB       THR  63  14.587  18.219 -21.368
  473    HG1  THR  63           HG1      THR  63  13.479  18.116 -19.380
  474   1HG2  THR  63          HG21      THR  63  13.311  17.636 -23.415
  475   2HG2  THR  63          HG22      THR  63  11.828  17.465 -22.449
  476   3HG2  THR  63          HG23      THR  63  12.619  19.051 -22.607
  477    H    SER  64           H        SER  64  16.229  15.456 -21.951
  478    HA   SER  64           HA       SER  64  17.119  13.954 -19.946
  479   1HB   SER  64          HB2       SER  64  18.816  15.630 -21.827
  480   2HB   SER  64          HB3       SER  64  19.207  14.032 -21.175
  481    HG   SER  64           HG       SER  64  18.248  13.256 -22.814
  482    H    ASP  65           H        ASP  65  18.923  14.018 -18.573
  483    HA   ASP  65           HA       ASP  65  20.158  16.523 -17.783
  484   1HB   ASP  65          HB2       ASP  65  18.039  16.452 -16.396
  485   2HB   ASP  65          HB3       ASP  65  18.598  14.928 -15.703
  486    H    ILE  66           H        ILE  66  21.954  16.081 -16.274
  487    HA   ILE  66           HA       ILE  66  23.298  13.514 -16.746
  488    HB   ILE  66           HB       ILE  66  24.932  14.736 -15.018
  489   1HG1  ILE  66          HG12      ILE  66  23.340  16.769 -14.802
  490   2HG1  ILE  66          HG13      ILE  66  25.068  16.998 -14.958
  491   1HG2  ILE  66          HG21      ILE  66  24.720  15.331 -17.966
  492   2HG2  ILE  66          HG22      ILE  66  26.173  15.580 -16.958
  493   3HG2  ILE  66          HG23      ILE  66  25.524  13.951 -17.182
  494   1HD1  ILE  66          HD11      ILE  66  24.884  17.657 -17.301
  495   2HD1  ILE  66          HD12      ILE  66  23.145  17.328 -17.304
  496   3HD1  ILE  66          HD13      ILE  66  23.798  18.636 -16.302
  497    H    ILE  67           H        ILE  67  24.310  12.489 -14.736
  498    HA   ILE  67           HA       ILE  67  22.266  11.488 -13.082
  499    HB   ILE  67           HB       ILE  67  25.296  11.416 -12.846
  500   1HG1  ILE  67          HG12      ILE  67  23.279   9.253 -13.589
  501   2HG1  ILE  67          HG13      ILE  67  24.073  10.257 -14.792
  502   1HG2  ILE  67          HG21      ILE  67  24.956   9.554 -11.188
  503   2HG2  ILE  67          HG22      ILE  67  24.381  11.100 -10.582
  504   3HG2  ILE  67          HG23      ILE  67  23.215   9.910 -11.188
  505   1HD1  ILE  67          HD11      ILE  67  25.216   8.179 -14.706
  506   2HD1  ILE  67          HD12      ILE  67  26.293   9.416 -14.030
  507   3HD1  ILE  67          HD13      ILE  67  25.446   8.273 -12.955
  508    H    ASP  68           H        ASP  68  21.663  11.914 -11.008
  509    HA   ASP  68           HA       ASP  68  22.791  14.294  -9.625
  510   1HB   ASP  68          HB2       ASP  68  20.773  14.989 -10.910
  511   2HB   ASP  68          HB3       ASP  68  19.821  13.777 -10.043
  512    H    SER  69           H        SER  69  22.865  14.121  -7.437
  513    HA   SER  69           HA       SER  69  23.107  11.658  -6.287
  514   1HB   SER  69          HB2       SER  69  22.494  14.234  -4.813
  515   2HB   SER  69          HB3       SER  69  23.450  12.855  -4.233
  516    HG   SER  69           HG       SER  69  24.763  14.584  -5.002
  517    H    ASP  70           H        ASP  70  20.156  13.535  -6.595
  518    HA   ASP  70           HA       ASP  70  18.810  12.459  -4.294
  519   1HB   ASP  70          HB2       ASP  70  18.279  14.652  -5.339
  520   2HB   ASP  70          HB3       ASP  70  17.670  13.806  -6.769
  521    H    ILE  71           H        ILE  71  19.516  11.133  -7.367
  522    HA   ILE  71           HA       ILE  71  17.403   9.054  -7.052
  523    HB   ILE  71           HB       ILE  71  18.749  10.028  -9.584
  524   1HG1  ILE  71          HG12      ILE  71  15.786  10.403  -9.034
  525   2HG1  ILE  71          HG13      ILE  71  16.910  11.602  -8.415
  526   1HG2  ILE  71          HG21      ILE  71  17.040   8.592 -10.692
  527   2HG2  ILE  71          HG22      ILE  71  18.099   7.663  -9.633
  528   3HG2  ILE  71          HG23      ILE  71  16.455   8.063  -9.100
  529   1HD1  ILE  71          HD11      ILE  71  16.765  10.799 -11.329
  530   2HD1  ILE  71          HD12      ILE  71  16.081  12.269 -10.598
  531   3HD1  ILE  71          HD13      ILE  71  17.843  12.020 -10.596
  532    H    LEU  72           H        LEU  72  20.858   9.736  -7.998
  533    HA   LEU  72           HA       LEU  72  21.489   7.076  -8.488
  534   1HB   LEU  72          HB2       LEU  72  23.738   7.596  -8.500
  535   2HB   LEU  72          HB3       LEU  72  22.899   9.090  -8.962
  536    HG   LEU  72           HG       LEU  72  23.212   9.650  -6.403
  537   1HD1  LEU  72          HD11      LEU  72  25.447   8.969  -5.571
  538   2HD1  LEU  72          HD12      LEU  72  24.351   7.607  -5.666
  539   3HD1  LEU  72          HD13      LEU  72  25.597   7.823  -6.916
  540   1HD2  LEU  72          HD21      LEU  72  24.108  10.962  -8.307
  541   2HD2  LEU  72          HD22      LEU  72  25.321  10.844  -7.032
  542   3HD2  LEU  72          HD23      LEU  72  25.453   9.822  -8.481
  543    H    ASN  73           H        ASN  73  21.499   8.684  -5.317
  544    HA   ASN  73           HA       ASN  73  22.370   6.188  -4.063
  545   1HB   ASN  73          HB2       ASN  73  23.213   7.406  -2.386
  546   2HB   ASN  73          HB3       ASN  73  23.151   8.729  -3.531
  547   1HD2  ASN  73          HD22      ASN  73  20.913  10.067  -3.409
  548   2HD2  ASN  73          HD21      ASN  73  20.288  10.276  -1.794
  549    H    ASN  74           H        ASN  74  19.513   6.995  -5.155
  550    HA   ASN  74           HA       ASN  74  17.916   6.258  -2.725
  551   1HB   ASN  74          HB2       ASN  74  17.858   8.657  -3.281
  552   2HB   ASN  74          HB3       ASN  74  17.467   8.263  -4.950
  553   1HD2  ASN  74          HD22      ASN  74  15.651   9.625  -4.805
  554   2HD2  ASN  74          HD21      ASN  74  14.167   9.089  -4.028
  555    H    ALA  75           H        ALA  75  18.370   5.890  -6.217
  556    HA   ALA  75           HA       ALA  75  15.995   4.484  -6.854
  557   1HB   ALA  75          HB1       ALA  75  18.727   4.400  -8.136
  558   2HB   ALA  75          HB2       ALA  75  17.196   3.811  -8.844
  559   3HB   ALA  75          HB3       ALA  75  17.411   5.538  -8.514
  560    H    ASP  76           H        ASP  76  15.325   2.523  -6.395
  561    HA   ASP  76           HA       ASP  76  16.786   0.820  -4.604
  562   1HB   ASP  76          HB2       ASP  76  14.323   0.926  -4.628
  563   2HB   ASP  76          HB3       ASP  76  14.300   0.296  -6.279
  564    H    LEU  77           H        LEU  77  16.525   1.141  -8.064
  565    HA   LEU  77           HA       LEU  77  18.578  -0.933  -8.448
  566   1HB   LEU  77          HB2       LEU  77  16.506  -2.148  -8.947
  567   2HB   LEU  77          HB3       LEU  77  15.925  -0.813  -9.946
  568    HG   LEU  77           HG       LEU  77  17.776  -1.207 -11.568
  569   1HD1  LEU  77          HD11      LEU  77  19.442  -2.286 -10.053
  570   2HD1  LEU  77          HD12      LEU  77  18.371  -3.698  -9.908
  571   3HD1  LEU  77          HD13      LEU  77  19.098  -3.259 -11.470
  572   1HD2  LEU  77          HD21      LEU  77  15.594  -2.234 -11.924
  573   2HD2  LEU  77          HD22      LEU  77  16.881  -3.291 -12.512
  574   3HD2  LEU  77          HD23      LEU  77  16.076  -3.653 -10.969
  575    H    VAL  78           H        VAL  78  20.073  -0.230  -9.870
  576    HA   VAL  78           HA       VAL  78  19.410   2.042 -11.678
  577    HB   VAL  78           HB       VAL  78  22.073   1.372 -10.337
  578   1HG1  VAL  78          HG11      VAL  78  22.471   2.328 -12.545
  579   2HG1  VAL  78          HG12      VAL  78  21.282   3.617 -12.254
  580   3HG1  VAL  78          HG13      VAL  78  22.790   3.566 -11.327
  581   1HG2  VAL  78          HG21      VAL  78  20.133   3.682  -9.868
  582   2HG2  VAL  78          HG22      VAL  78  20.566   2.413  -8.704
  583   3HG2  VAL  78          HG23      VAL  78  21.776   3.596  -9.207
  584    H    VAL  79           H        VAL  79  20.059   1.660 -13.862
  585    HA   VAL  79           HA       VAL  79  21.284  -0.999 -14.418
  586    HB   VAL  79           HB       VAL  79  19.028   0.236 -16.018
  587   1HG1  VAL  79          HG11      VAL  79  20.167  -2.587 -15.965
  588   2HG1  VAL  79          HG12      VAL  79  18.860  -1.996 -17.014
  589   3HG1  VAL  79          HG13      VAL  79  20.500  -1.372 -17.212
  590   1HG2  VAL  79          HG21      VAL  79  17.980  -0.286 -13.909
  591   2HG2  VAL  79          HG22      VAL  79  17.531  -1.536 -15.066
  592   3HG2  VAL  79          HG23      VAL  79  18.777  -1.874 -13.846
  593    H    THR  80           H        THR  80  23.015  -0.803 -15.757
  594    HA   THR  80           HA       THR  80  23.334   1.754 -17.265
  595    HB   THR  80           HB       THR  80  25.722   0.747 -17.582
  596    HG1  THR  80           HG1      THR  80  25.179  -1.257 -16.480
  597   1HG2  THR  80          HG21      THR  80  25.172   2.806 -16.387
  598   2HG2  THR  80          HG22      THR  80  24.797   1.877 -14.912
  599   3HG2  THR  80          HG23      THR  80  26.457   1.926 -15.557
  600    H    LEU  81           H        LEU  81  23.154   1.728 -19.390
  601    HA   LEU  81           HA       LEU  81  22.413  -0.876 -20.637
  602   1HB   LEU  81          HB2       LEU  81  21.758   1.973 -21.401
  603   2HB   LEU  81          HB3       LEU  81  21.340   0.577 -22.371
  604    HG   LEU  81           HG       LEU  81  19.880  -0.290 -20.582
  605   1HD1  LEU  81          HD11      LEU  81  20.736   0.646 -18.527
  606   2HD1  LEU  81          HD12      LEU  81  20.579   2.312 -19.147
  607   3HD1  LEU  81          HD13      LEU  81  19.149   1.331 -18.774
  608   1HD2  LEU  81          HD21      LEU  81  18.091   1.464 -20.768
  609   2HD2  LEU  81          HD22      LEU  81  19.294   2.568 -21.450
  610   3HD2  LEU  81          HD23      LEU  81  18.843   1.070 -22.305
  611    H    CYS  82           H        CYS  82  25.226   0.285 -20.230
  612    HA   CYS  82           HA       CYS  82  26.279   1.058 -22.766
  613   1HB   CYS  82          HB2       CYS  82  28.454   0.746 -21.620
  614   2HB   CYS  82          HB3       CYS  82  27.353   1.858 -20.818
  615    H    GLY  83           H        GLY  83  26.232  -0.373 -24.465
  616   1HA   GLY  83          HA1       GLY  83  28.022  -2.667 -24.289
  617   2HA   GLY  83          HA2       GLY  83  26.355  -3.099 -24.705
  618    H    ASP  84           H        ASP  84  27.824  -0.070 -25.441
  619    HA   ASP  84           HA       ASP  84  27.479  -0.372 -28.343
  620   1HB   ASP  84          HB2       ASP  84  27.045   2.071 -28.171
  621   2HB   ASP  84          HB3       ASP  84  26.066   1.214 -26.974
  622    H    ALA  85           H        ALA  85  28.699   1.550 -29.464
  623    HA   ALA  85           HA       ALA  85  31.347   0.695 -29.705
  624   1HB   ALA  85          HB1       ALA  85  31.549   2.533 -31.329
  625   2HB   ALA  85          HB2       ALA  85  29.986   1.718 -31.507
  626   3HB   ALA  85          HB3       ALA  85  30.082   3.293 -30.681
  627    H    ALA  86           H        ALA  86  30.222   2.859 -27.264
  628    HA   ALA  86           HA       ALA  86  32.998   3.873 -26.850
  629   1HB   ALA  86          HB1       ALA  86  30.382   5.285 -26.193
  630   2HB   ALA  86          HB2       ALA  86  32.018   5.886 -25.859
  631   3HB   ALA  86          HB3       ALA  86  31.474   5.695 -27.538
  632    H    ASP  87           H        ASP  87  29.972   2.818 -25.364
  633    HA   ASP  87           HA       ASP  87  29.446   2.076 -23.312
  634   1HB   ASP  87          HB2       ASP  87  29.987  -0.133 -23.007
  635   2HB   ASP  87          HB3       ASP  87  30.043   0.135 -24.720
  636    H    LYS  88           H        LYS  88  30.775   4.248 -22.670
  637    HA   LYS  88           HA       LYS  88  32.975   3.905 -20.933
  638   1HB   LYS  88          HB2       LYS  88  30.956   6.181 -20.950
  639   2HB   LYS  88          HB3       LYS  88  32.568   6.212 -20.235
  640   1HG   LYS  88          HG2       LYS  88  33.584   5.864 -22.479
  641   2HG   LYS  88          HG3       LYS  88  31.974   5.815 -23.206
  642   1HD   LYS  88          HD2       LYS  88  32.891   7.958 -23.619
  643   2HD   LYS  88          HD3       LYS  88  31.554   8.143 -22.475
  644   1HE   LYS  88          HE2       LYS  88  33.152   8.342 -20.599
  645   2HE   LYS  88          HE3       LYS  88  34.506   8.006 -21.685
  646   1HZ   LYS  88          HZ1       LYS  88  34.033  10.076 -22.838
  647   2HZ   LYS  88          HZ2       LYS  88  32.760  10.396 -21.864
  648   3HZ   LYS  88          HZ3       LYS  88  34.273  10.369 -21.257
  649    H    CYS  89           H        CYS  89  29.730   3.104 -20.347
  650    HA   CYS  89           HA       CYS  89  28.455   2.582 -18.580
  651   1HB   CYS  89          HB2       CYS  89  31.076   1.391 -17.698
  652   2HB   CYS  89          HB3       CYS  89  29.507   1.005 -17.011
  653    HA   PRO  90           HA       PRO  90  29.160   6.354 -16.113
  654   1HB   PRO  90          HB2       PRO  90  26.281   5.693 -15.511
  655   2HB   PRO  90          HB3       PRO  90  27.028   7.290 -15.852
  656   1HG   PRO  90          HG2       PRO  90  25.644   5.959 -17.773
  657   2HG   PRO  90          HG3       PRO  90  27.153   6.832 -18.172
  658   1HD   PRO  90          HD2       PRO  90  26.722   3.895 -17.808
  659   2HD   PRO  90          HD3       PRO  90  27.772   4.771 -18.964
  660    H    MET  91           H        MET  91  29.364   6.829 -13.949
  661    HA   MET  91           HA       MET  91  29.983   4.763 -12.132
  662   1HB   MET  91          HB2       MET  91  31.043   6.955 -12.165
  663   2HB   MET  91          HB3       MET  91  29.527   7.765 -11.799
  664   1HG   MET  91          HG2       MET  91  30.851   5.766  -9.930
  665   2HG   MET  91          HG3       MET  91  31.245   7.475  -9.928
  666   1HE   MET  91          HE1       MET  91  28.289   8.914 -10.272
  667   2HE   MET  91          HE2       MET  91  28.002   9.189  -8.544
  668   3HE   MET  91          HE3       MET  91  29.629   9.430  -9.217
  669    H    THR  92           H        THR  92  28.800   3.770 -10.576
  670    HA   THR  92           HA       THR  92  26.206   4.873  -9.689
  671    HB   THR  92           HB       THR  92  25.614   2.452  -9.398
  672    HG1  THR  92           HG1      THR  92  27.655   1.518  -9.364
  673   1HG2  THR  92          HG21      THR  92  26.448   2.980 -12.274
  674   2HG2  THR  92          HG22      THR  92  25.041   2.054 -11.700
  675   3HG2  THR  92          HG23      THR  92  25.081   3.816 -11.517
  676    HA   PRO  93           HA       PRO  93  28.257   4.409  -5.699
  677   1HB   PRO  93          HB2       PRO  93  26.186   4.250  -3.944
  678   2HB   PRO  93          HB3       PRO  93  26.568   5.758  -4.833
  679   1HG   PRO  93          HG2       PRO  93  24.474   3.684  -5.455
  680   2HG   PRO  93          HG3       PRO  93  24.309   5.456  -5.472
  681   1HD   PRO  93          HD2       PRO  93  24.760   3.930  -7.731
  682   2HD   PRO  93          HD3       PRO  93  25.284   5.635  -7.579
  683    HA   PRO  94           HA       PRO  94  28.412   0.043  -5.173
  684   1HB   PRO  94          HB2       PRO  94  29.396  -0.361  -2.668
  685   2HB   PRO  94          HB3       PRO  94  30.333   0.468  -3.950
  686   1HG   PRO  94          HG2       PRO  94  28.701   1.726  -1.725
  687   2HG   PRO  94          HG3       PRO  94  30.377   2.121  -2.229
  688   1HD   PRO  94          HD2       PRO  94  28.178   3.533  -3.089
  689   2HD   PRO  94          HD3       PRO  94  29.625   3.300  -4.121
  690    H    HIS  95           H        HIS  95  26.319   1.760  -2.891
  691    HA   HIS  95           HA       HIS  95  25.371  -0.676  -1.630
  692   1HB   HIS  95          HB2       HIS  95  23.987   0.898  -0.290
  693   2HB   HIS  95          HB3       HIS  95  25.714   1.211  -0.243
  694    HD1  HIS  95           HD1      HIS  95  26.400   3.688  -0.727
  695    HD2  HIS  95           HD2      HIS  95  22.526   2.654  -2.010
  696    HE1  HIS  95           HE1      HIS  95  25.325   5.834  -1.573
  697    H    VAL  96           H        VAL  96  24.245   1.163  -4.422
  698    HA   VAL  96           HA       VAL  96  21.491   0.254  -4.125
  699    HB   VAL  96           HB       VAL  96  21.178   1.189  -6.349
  700   1HG1  VAL  96          HG11      VAL  96  20.907   2.564  -4.334
  701   2HG1  VAL  96          HG12      VAL  96  22.576   3.136  -4.495
  702   3HG1  VAL  96          HG13      VAL  96  21.374   3.498  -5.752
  703   1HG2  VAL  96          HG21      VAL  96  22.964   2.578  -7.402
  704   2HG2  VAL  96          HG22      VAL  96  24.140   1.732  -6.370
  705   3HG2  VAL  96          HG23      VAL  96  23.172   0.830  -7.536
  706    H    LYS  97           H        LYS  97  20.515  -1.235  -5.657
  707    HA   LYS  97           HA       LYS  97  22.225  -3.496  -6.431
  708   1HB   LYS  97          HB2       LYS  97  19.837  -3.859  -5.717
  709   2HB   LYS  97          HB3       LYS  97  19.304  -2.850  -7.062
  710   1HG   LYS  97          HG2       LYS  97  18.961  -5.087  -7.723
  711   2HG   LYS  97          HG3       LYS  97  20.323  -4.501  -8.666
  712   1HD   LYS  97          HD2       LYS  97  21.879  -5.718  -7.046
  713   2HD   LYS  97          HD3       LYS  97  20.434  -6.299  -6.209
  714   1HE   LYS  97          HE2       LYS  97  20.834  -8.091  -7.624
  715   2HE   LYS  97          HE3       LYS  97  19.674  -7.151  -8.565
  716   1HZ   LYS  97          HZ1       LYS  97  21.785  -6.161  -9.658
  717   2HZ   LYS  97          HZ2       LYS  97  22.570  -7.442  -9.002
  718   3HZ   LYS  97          HZ3       LYS  97  21.338  -7.652 -10.074
  719    H    ARG  98           H        ARG  98  22.974  -3.769  -8.552
  720    HA   ARG  98           HA       ARG  98  22.197  -1.721 -10.545
  721   1HB   ARG  98          HB2       ARG  98  24.432  -1.219  -9.711
  722   2HB   ARG  98          HB3       ARG  98  24.981  -2.851 -10.124
  723   1HG   ARG  98          HG2       ARG  98  24.707  -2.423 -12.497
  724   2HG   ARG  98          HG3       ARG  98  23.873  -0.879 -12.182
  725   1HD   ARG  98          HD2       ARG  98  25.892   0.055 -11.222
  726   2HD   ARG  98          HD3       ARG  98  26.738  -1.491 -11.364
  727    HE   ARG  98           HE       ARG  98  25.806  -0.749 -13.949
  728   1HH1  ARG  98          HH21      ARG  98  28.047   0.714 -11.638
  729   2HH1  ARG  98          HH22      ARG  98  29.358   0.837 -12.761
  730   1HH2  ARG  98          HH11      ARG  98  27.399  -0.426 -15.456
  731   2HH2  ARG  98          HH12      ARG  98  28.982   0.178 -15.027
  732    H    GLU  99           H        GLU  99  22.129  -2.482 -12.718
  733    HA   GLU  99           HA       GLU  99  22.614  -5.337 -13.247
  734   1HB   GLU  99          HB2       GLU  99  20.024  -3.811 -13.739
  735   2HB   GLU  99          HB3       GLU  99  20.485  -5.135 -14.790
  736   1HG   GLU  99          HG2       GLU  99  20.083  -5.345 -11.782
  737   2HG   GLU  99          HG3       GLU  99  18.941  -5.864 -13.016
  738    H    HIS 100           H        HIS 100  22.737  -5.651 -15.650
  739    HA   HIS 100           HA       HIS 100  23.889  -3.275 -17.032
  740   1HB   HIS 100          HB2       HIS 100  25.737  -4.491 -16.070
  741   2HB   HIS 100          HB3       HIS 100  25.074  -6.039 -16.592
  742    HD1  HIS 100           HD1      HIS 100  26.887  -2.973 -18.089
  743    HD2  HIS 100           HD2      HIS 100  25.560  -6.852 -19.060
  744    HE1  HIS 100           HE1      HIS 100  27.952  -3.559 -20.321
  745    H    TRP 101           H        TRP 101  22.700  -2.985 -18.780
  746    HA   TRP 101           HA       TRP 101  21.487  -5.300 -20.243
  747   1HB   TRP 101          HB2       TRP 101  20.344  -2.537 -19.669
  748   2HB   TRP 101          HB3       TRP 101  19.701  -3.634 -20.871
  749    HD1  TRP 101           HD1      TRP 101  20.531  -5.103 -17.429
  750    HE1  TRP 101           HE1      TRP 101  18.389  -5.679 -16.215
  751    HE3  TRP 101           HE3      TRP 101  17.174  -3.108 -20.752
  752    HZ2  TRP 101           HZ2      TRP 101  15.550  -5.237 -16.552
  753    HZ3  TRP 101           HZ3      TRP 101  14.738  -3.276 -20.304
  754    HH2  TRP 101           HH2      TRP 101  13.929  -4.306 -18.179
  755    H    GLY 102           H        GLY 102  24.000  -4.788 -20.954
  756   1HA   GLY 102          HA1       GLY 102  24.445  -2.479 -22.578
  757   2HA   GLY 102          HA2       GLY 102  25.431  -3.936 -22.545
  758    H    PHE 103           H        PHE 103  23.817  -2.028 -24.586
  759    HA   PHE 103           HA       PHE 103  23.961  -3.954 -26.707
  760   1HB   PHE 103          HB2       PHE 103  21.605  -3.059 -27.553
  761   2HB   PHE 103          HB3       PHE 103  21.768  -4.509 -26.592
  762    HD1  PHE 103           HD1      PHE 103  20.175  -4.828 -24.935
  763    HD2  PHE 103           HD2      PHE 103  21.360  -0.805 -25.944
  764    HE1  PHE 103           HE1      PHE 103  18.649  -3.943 -23.193
  765    HE2  PHE 103           HE2      PHE 103  19.853   0.066 -24.177
  766    HZ   PHE 103           HZ       PHE 103  18.544  -1.493 -22.760
  767    H    ASP 104           H        ASP 104  23.789  -2.685 -28.825
  768    HA   ASP 104           HA       ASP 104  25.515  -0.468 -28.431
  769   1HB   ASP 104          HB2       ASP 104  25.796  -2.041 -30.298
  770   2HB   ASP 104          HB3       ASP 104  24.280  -1.471 -31.004
  771    H    ASP 105           H        ASP 105  25.294   1.653 -28.914
  772    HA   ASP 105           HA       ASP 105  22.695   2.790 -28.335
  773   1HB   ASP 105          HB2       ASP 105  24.943   3.865 -27.757
  774   2HB   ASP 105          HB3       ASP 105  25.045   4.363 -29.442
  775    HA   PRO 106           HA       PRO 106  21.504   2.411 -32.591
  776   1HB   PRO 106          HB2       PRO 106  19.137   3.801 -32.620
  777   2HB   PRO 106          HB3       PRO 106  19.330   2.160 -31.960
  778   1HG   PRO 106          HG2       PRO 106  19.288   4.759 -30.420
  779   2HG   PRO 106          HG3       PRO 106  18.466   3.218 -30.028
  780   1HD   PRO 106          HD2       PRO 106  20.849   3.970 -28.907
  781   2HD   PRO 106          HD3       PRO 106  20.493   2.255 -29.273
  782    H    ALA 107           H        ALA 107  22.084   5.570 -31.108
  783    HA   ALA 107           HA       ALA 107  22.044   6.998 -33.625
  784   1HB   ALA 107          HB1       ALA 107  23.373   7.757 -30.995
  785   2HB   ALA 107          HB2       ALA 107  23.048   8.827 -32.370
  786   3HB   ALA 107          HB3       ALA 107  21.693   8.136 -31.454
  787    H    ARG 108           H        ARG 108  24.187   4.662 -32.321
  788    HA   ARG 108           HA       ARG 108  26.448   5.661 -34.000
  789   1HB   ARG 108          HB2       ARG 108  26.538   4.003 -31.434
  790   2HB   ARG 108          HB3       ARG 108  27.925   4.368 -32.476
  791   1HG   ARG 108          HG2       ARG 108  27.342   6.829 -32.219
  792   2HG   ARG 108          HG3       ARG 108  26.226   6.363 -30.932
  793   1HD   ARG 108          HD2       ARG 108  29.178   5.570 -30.906
  794   2HD   ARG 108          HD3       ARG 108  28.656   7.139 -30.329
  795    HE   ARG 108           HE       ARG 108  28.351   4.577 -29.002
  796   1HH1  ARG 108          HH21      ARG 108  27.021   7.875 -29.147
  797   2HH1  ARG 108          HH22      ARG 108  26.667   7.948 -27.463
  798   1HH2  ARG 108          HH11      ARG 108  27.991   4.714 -26.768
  799   2HH2  ARG 108          HH12      ARG 108  27.246   6.098 -26.065
  800    H    ALA 109           H        ALA 109  23.968   3.724 -34.393
  801    HA   ALA 109           HA       ALA 109  25.212   1.343 -35.427
  802   1HB   ALA 109          HB1       ALA 109  22.468   2.605 -35.847
  803   2HB   ALA 109          HB2       ALA 109  22.934   0.963 -36.341
  804   3HB   ALA 109          HB3       ALA 109  22.899   1.405 -34.614
  805    H    GLN 110           H        GLN 110  26.944   2.768 -36.526
  806    HA   GLN 110           HA       GLN 110  26.371   4.674 -38.452
  807   1HB   GLN 110          HB2       GLN 110  28.806   2.874 -38.609
  808   2HB   GLN 110          HB3       GLN 110  28.654   4.537 -39.150
  809   1HG   GLN 110          HG2       GLN 110  28.822   3.527 -36.289
  810   2HG   GLN 110          HG3       GLN 110  30.042   4.400 -37.180
  811   1HE2  GLN 110          HE22      GLN 110  29.500   5.393 -34.764
  812   2HE2  GLN 110          HE21      GLN 110  28.611   6.889 -34.893
  813    H    GLY 111           H        GLY 111  25.995   4.724 -40.565
  814   1HA   GLY 111          HA1       GLY 111  26.696   3.002 -42.577
  815   2HA   GLY 111          HA2       GLY 111  25.113   2.391 -42.051
  816    H    THR 112           H        THR 112  23.494   4.328 -41.571
  817    HA   THR 112           HA       THR 112  23.757   6.787 -42.907
  818    HB   THR 112           HB       THR 112  23.453   5.530 -44.979
  819    HG1  THR 112           HG1      THR 112  21.828   6.694 -45.772
  820   1HG2  THR 112          HG21      THR 112  22.331   3.495 -44.182
  821   2HG2  THR 112          HG22      THR 112  20.871   4.433 -43.803
  822   3HG2  THR 112          HG23      THR 112  21.411   4.255 -45.483
  823    H    GLU 113           H        GLU 113  21.503   7.922 -42.794
  824    HA   GLU 113           HA       GLU 113  20.659   7.724 -40.070
  825   1HB   GLU 113          HB2       GLU 113  19.020   9.427 -40.634
  826   2HB   GLU 113          HB3       GLU 113  20.614   9.833 -41.270
  827   1HG   GLU 113          HG2       GLU 113  19.891   9.039 -43.536
  828   2HG   GLU 113          HG3       GLU 113  18.286   8.697 -42.886
  829    H    GLU 114           H        GLU 114  19.430   6.273 -43.054
  830    HA   GLU 114           HA       GLU 114  16.961   5.370 -41.922
  831   1HB   GLU 114          HB2       GLU 114  17.364   5.615 -44.343
  832   2HB   GLU 114          HB3       GLU 114  18.535   4.289 -44.294
  833   1HG   GLU 114          HG2       GLU 114  16.766   2.719 -43.608
  834   2HG   GLU 114          HG3       GLU 114  15.597   4.040 -43.513
  835    H    GLU 115           H        GLU 115  20.252   4.026 -42.046
  836    HA   GLU 115           HA       GLU 115  19.549   1.417 -41.056
  837   1HB   GLU 115          HB2       GLU 115  21.664   1.975 -42.325
  838   2HB   GLU 115          HB3       GLU 115  22.221   2.880 -40.920
  839   1HG   GLU 115          HG2       GLU 115  23.279   0.765 -40.834
  840   2HG   GLU 115          HG3       GLU 115  22.078   0.770 -39.553
  841    H    LYS 116           H        LYS 116  20.801   4.463 -39.606
  842    HA   LYS 116           HA       LYS 116  20.781   3.603 -36.906
  843   1HB   LYS 116          HB2       LYS 116  20.478   6.357 -38.178
  844   2HB   LYS 116          HB3       LYS 116  20.547   6.096 -36.419
  845   1HG   LYS 116          HG2       LYS 116  22.721   4.911 -36.707
  846   2HG   LYS 116          HG3       LYS 116  22.680   5.285 -38.440
  847   1HD   LYS 116          HD2       LYS 116  22.679   7.729 -37.869
  848   2HD   LYS 116          HD3       LYS 116  22.789   7.285 -36.146
  849   1HE   LYS 116          HE2       LYS 116  24.842   5.869 -36.809
  850   2HE   LYS 116          HE3       LYS 116  24.789   6.685 -38.376
  851   1HZ   LYS 116          HZ1       LYS 116  25.156   7.978 -35.736
  852   2HZ   LYS 116          HZ2       LYS 116  26.322   7.713 -36.862
  853   3HZ   LYS 116          HZ3       LYS 116  25.116   8.791 -37.178
  854    H    TRP 117           H        TRP 117  18.146   5.174 -38.821
  855    HA   TRP 117           HA       TRP 117  16.268   5.197 -36.724
  856   1HB   TRP 117          HB2       TRP 117  15.902   6.485 -38.703
  857   2HB   TRP 117          HB3       TRP 117  16.012   5.065 -39.737
  858    HD1  TRP 117           HD1      TRP 117  13.784   4.631 -40.770
  859    HE1  TRP 117           HE1      TRP 117  11.382   4.374 -39.989
  860    HE3  TRP 117           HE3      TRP 117  14.376   6.054 -35.880
  861    HZ2  TRP 117           HZ2      TRP 117   9.860   4.767 -37.534
  862    HZ3  TRP 117           HZ3      TRP 117  12.476   5.999 -34.334
  863    HH2  TRP 117           HH2      TRP 117  10.197   5.347 -35.137
  864    H    ALA 118           H        ALA 118  17.066   2.538 -39.038
  865    HA   ALA 118           HA       ALA 118  14.947   0.839 -38.124
  866   1HB   ALA 118          HB1       ALA 118  17.564   0.152 -39.509
  867   2HB   ALA 118          HB2       ALA 118  16.166  -0.929 -39.312
  868   3HB   ALA 118          HB3       ALA 118  16.013   0.540 -40.297
  869    H    PHE 119           H        PHE 119  18.364   1.231 -37.174
  870    HA   PHE 119           HA       PHE 119  18.329  -0.842 -35.238
  871   1HB   PHE 119          HB2       PHE 119  20.303   0.603 -36.323
  872   2HB   PHE 119          HB3       PHE 119  20.118   1.534 -34.846
  873    HD1  PHE 119           HD1      PHE 119  21.234  -1.611 -36.371
  874    HD2  PHE 119           HD2      PHE 119  20.516   0.370 -32.611
  875    HE1  PHE 119           HE1      PHE 119  22.604  -3.317 -35.202
  876    HE2  PHE 119           HE2      PHE 119  21.886  -1.328 -31.448
  877    HZ   PHE 119           HZ       PHE 119  22.937  -3.180 -32.740
  878    H    PHE 120           H        PHE 120  17.445   2.602 -35.018
  879    HA   PHE 120           HA       PHE 120  16.973   2.736 -32.218
  880   1HB   PHE 120          HB2       PHE 120  16.126   4.285 -34.625
  881   2HB   PHE 120          HB3       PHE 120  14.990   4.334 -33.304
  882    HD1  PHE 120           HD1      PHE 120  18.140   5.653 -34.537
  883    HD2  PHE 120           HD2      PHE 120  15.749   5.055 -31.000
  884    HE1  PHE 120           HE1      PHE 120  19.465   7.377 -33.348
  885    HE2  PHE 120           HE2      PHE 120  17.085   6.771 -29.815
  886    HZ   PHE 120           HZ       PHE 120  18.921   7.962 -31.000
  887    H    GLN 121           H        GLN 121  14.751   1.686 -34.863
  888    HA   GLN 121           HA       GLN 121  12.620   1.025 -33.048
  889   1HB   GLN 121          HB2       GLN 121  13.276   0.086 -35.856
  890   2HB   GLN 121          HB3       GLN 121  11.820  -0.401 -34.977
  891   1HG   GLN 121          HG2       GLN 121  10.917   1.773 -34.963
  892   2HG   GLN 121          HG3       GLN 121  12.473   2.548 -35.267
  893   1HE2  GLN 121          HE22      GLN 121  13.404   2.512 -37.353
  894   2HE2  GLN 121          HE21      GLN 121  12.443   2.176 -38.779
  895    H    ARG 122           H        ARG 122  15.435  -0.935 -34.255
  896    HA   ARG 122           HA       ARG 122  14.433  -3.297 -32.944
  897   1HB   ARG 122          HB2       ARG 122  17.219  -2.505 -33.870
  898   2HB   ARG 122          HB3       ARG 122  16.896  -4.057 -33.113
  899   1HG   ARG 122          HG2       ARG 122  15.421  -3.136 -35.628
  900   2HG   ARG 122          HG3       ARG 122  16.953  -3.995 -35.650
  901   1HD   ARG 122          HD2       ARG 122  15.400  -5.683 -35.975
  902   2HD   ARG 122          HD3       ARG 122  15.859  -5.858 -34.294
  903    HE   ARG 122           HE       ARG 122  13.313  -4.719 -35.383
  904   1HH1  ARG 122          HH21      ARG 122  14.983  -6.184 -32.597
  905   2HH1  ARG 122          HH22      ARG 122  13.528  -6.470 -31.717
  906   1HH2  ARG 122          HH11      ARG 122  11.391  -5.152 -34.203
  907   2HH2  ARG 122          HH12      ARG 122  11.471  -5.806 -32.595
  908    H    VAL 123           H        VAL 123  16.729  -0.760 -31.774
  909    HA   VAL 123           HA       VAL 123  17.129  -2.128 -29.287
  910    HB   VAL 123           HB       VAL 123  17.563   0.753 -30.166
  911   1HG1  VAL 123          HG11      VAL 123  19.022   0.978 -28.156
  912   2HG1  VAL 123          HG12      VAL 123  17.319   0.806 -27.731
  913   3HG1  VAL 123          HG13      VAL 123  18.421  -0.579 -27.554
  914   1HG2  VAL 123          HG21      VAL 123  19.925   0.087 -30.216
  915   2HG2  VAL 123          HG22      VAL 123  19.524  -1.528 -29.607
  916   3HG2  VAL 123          HG23      VAL 123  18.998  -1.033 -31.223
  917    H    ARG 124           H        ARG 124  14.723   0.417 -30.306
  918    HA   ARG 124           HA       ARG 124  13.729   0.708 -27.636
  919   1HB   ARG 124          HB2       ARG 124  12.003   2.031 -28.508
  920   2HB   ARG 124          HB3       ARG 124  13.375   2.282 -29.562
  921   1HG   ARG 124          HG2       ARG 124  11.894   2.056 -31.224
  922   2HG   ARG 124          HG3       ARG 124  12.164   0.369 -30.990
  923   1HD   ARG 124          HD2       ARG 124  10.031   1.288 -29.232
  924   2HD   ARG 124          HD3       ARG 124   9.747   1.837 -30.863
  925    HE   ARG 124           HE       ARG 124   9.893  -0.992 -29.965
  926   1HH1  ARG 124          HH21      ARG 124   9.321   1.293 -32.585
  927   2HH1  ARG 124          HH22      ARG 124   8.323   0.240 -33.524
  928   1HH2  ARG 124          HH11      ARG 124   8.743  -2.550 -31.312
  929   2HH2  ARG 124          HH12      ARG 124   8.120  -2.011 -32.830
  930    H    ASP 125           H        ASP 125  12.817  -1.506 -30.295
  931    HA   ASP 125           HA       ASP 125  10.593  -2.627 -28.925
  932   1HB   ASP 125          HB2       ASP 125  11.159  -2.761 -31.399
  933   2HB   ASP 125          HB3       ASP 125  12.377  -3.974 -30.998
  934    H    GLU 126           H        GLU 126  14.051  -3.656 -29.055
  935    HA   GLU 126           HA       GLU 126  13.639  -5.983 -27.470
  936   1HB   GLU 126          HB2       GLU 126  15.542  -5.629 -28.962
  937   2HB   GLU 126          HB3       GLU 126  16.158  -4.334 -27.916
  938   1HG   GLU 126          HG2       GLU 126  16.526  -5.917 -26.094
  939   2HG   GLU 126          HG3       GLU 126  15.684  -7.196 -26.972
  940    H    ILE 127           H        ILE 127  14.521  -2.601 -26.612
  941    HA   ILE 127           HA       ILE 127  14.843  -3.023 -23.811
  942    HB   ILE 127           HB       ILE 127  14.079  -0.617 -25.506
  943   1HG1  ILE 127          HG12      ILE 127  16.521  -1.259 -23.793
  944   2HG1  ILE 127          HG13      ILE 127  16.452  -1.500 -25.531
  945   1HG2  ILE 127          HG21      ILE 127  14.525  -0.556 -22.491
  946   2HG2  ILE 127          HG22      ILE 127  14.256   0.834 -23.573
  947   3HG2  ILE 127          HG23      ILE 127  12.960  -0.309 -23.293
  948   1HD1  ILE 127          HD11      ILE 127  15.989   1.009 -25.752
  949   2HD1  ILE 127          HD12      ILE 127  16.434   1.146 -24.033
  950   3HD1  ILE 127          HD13      ILE 127  17.612   0.547 -25.201
  951    H    GLY 128           H        GLY 128  11.918  -1.993 -25.705
  952   1HA   GLY 128          HA1       GLY 128  10.073  -1.968 -23.656
  953   2HA   GLY 128          HA2       GLY 128   9.714  -2.452 -25.328
  954    H    ASN 129           H        ASN 129  11.086  -4.848 -25.577
  955    HA   ASN 129           HA       ASN 129   9.335  -6.669 -24.277
  956   1HB   ASN 129          HB2       ASN 129  11.906  -7.021 -25.851
  957   2HB   ASN 129          HB3       ASN 129  11.215  -8.380 -24.983
  958   1HD2  ASN 129          HD22      ASN 129  10.598  -6.084 -27.642
  959   2HD2  ASN 129          HD21      ASN 129   9.352  -7.057 -28.391
  960    H    ARG 130           H        ARG 130  12.766  -5.852 -23.528
  961    HA   ARG 130           HA       ARG 130  12.797  -7.762 -21.388
  962   1HB   ARG 130          HB2       ARG 130  14.789  -6.980 -22.701
  963   2HB   ARG 130          HB3       ARG 130  14.687  -5.418 -21.899
  964   1HG   ARG 130          HG2       ARG 130  16.422  -7.052 -21.000
  965   2HG   ARG 130          HG3       ARG 130  15.346  -6.350 -19.807
  966   1HD   ARG 130          HD2       ARG 130  15.720  -8.722 -19.351
  967   2HD   ARG 130          HD3       ARG 130  14.024  -8.324 -19.647
  968    HE   ARG 130           HE       ARG 130  15.465  -9.258 -22.014
  969   1HH1  ARG 130          HH12      ARG 130  13.647 -10.290 -19.107
  970   2HH1  ARG 130          HH11      ARG 130  12.760 -11.511 -20.021
  971   1HH2  ARG 130          HH22      ARG 130  14.288 -11.037 -23.080
  972   2HH2  ARG 130          HH21      ARG 130  13.117 -11.918 -22.127
  973    H    LEU 131           H        LEU 131  11.872  -4.329 -21.573
  974    HA   LEU 131           HA       LEU 131  11.830  -3.933 -18.734
  975   1HB   LEU 131          HB2       LEU 131  11.455  -2.264 -20.940
  976   2HB   LEU 131          HB3       LEU 131   9.852  -2.389 -20.273
  977    HG   LEU 131           HG       LEU 131  10.869  -0.517 -19.289
  978   1HD1  LEU 131          HD11      LEU 131  10.923  -0.956 -16.884
  979   2HD1  LEU 131          HD12      LEU 131   9.613  -1.887 -17.644
  980   3HD1  LEU 131          HD13      LEU 131  11.125  -2.675 -17.174
  981   1HD2  LEU 131          HD21      LEU 131  13.223  -1.167 -19.869
  982   2HD2  LEU 131          HD22      LEU 131  13.015  -0.364 -18.319
  983   3HD2  LEU 131          HD23      LEU 131  13.259  -2.114 -18.363
  984    H    LYS 132           H        LYS 132   9.390  -5.021 -21.155
  985    HA   LYS 132           HA       LYS 132   7.211  -5.249 -19.396
  986   1HB   LYS 132          HB2       LYS 132   7.104  -5.481 -21.884
  987   2HB   LYS 132          HB3       LYS 132   7.894  -7.051 -21.765
  988   1HG   LYS 132          HG2       LYS 132   6.030  -7.942 -20.430
  989   2HG   LYS 132          HG3       LYS 132   5.238  -6.351 -20.446
  990   1HD   LYS 132          HD2       LYS 132   5.074  -6.461 -22.926
  991   2HD   LYS 132          HD3       LYS 132   5.861  -8.055 -22.902
  992   1HE   LYS 132          HE2       LYS 132   4.010  -8.941 -21.492
  993   2HE   LYS 132          HE3       LYS 132   3.226  -7.355 -21.520
  994   1HZ   LYS 132          HZ1       LYS 132   3.712  -9.060 -23.898
  995   2HZ   LYS 132          HZ2       LYS 132   2.275  -8.843 -23.163
  996   3HZ   LYS 132          HZ3       LYS 132   2.985  -7.593 -23.926
  997    H    GLU 133           H        GLU 133   9.645  -7.728 -20.277
  998    HA   GLU 133           HA       GLU 133   8.541  -9.587 -18.427
  999   1HB   GLU 133          HB2       GLU 133  11.321  -9.589 -19.601
 1000   2HB   GLU 133          HB3       GLU 133  10.532 -10.934 -18.738
 1001   1HG   GLU 133          HG2       GLU 133   8.645 -10.592 -20.556
 1002   2HG   GLU 133          HG3       GLU 133   9.925  -9.798 -21.471
 1003    H    PHE 134           H        PHE 134  11.079  -7.124 -17.989
 1004    HA   PHE 134           HA       PHE 134  11.862  -8.001 -15.412
 1005   1HB   PHE 134          HB2       PHE 134  13.207  -6.386 -16.527
 1006   2HB   PHE 134          HB3       PHE 134  11.840  -5.311 -16.789
 1007    HD1  PHE 134           HD1      PHE 134  11.286  -3.604 -15.264
 1008    HD2  PHE 134           HD2      PHE 134  14.026  -6.707 -14.065
 1009    HE1  PHE 134           HE1      PHE 134  11.841  -2.305 -13.239
 1010    HE2  PHE 134           HE2      PHE 134  14.521  -5.446 -11.983
 1011    HZ   PHE 134           HZ       PHE 134  13.423  -3.253 -11.558
 1012    H    ALA 135           H        ALA 135   9.094  -6.054 -16.475
 1013    HA   ALA 135           HA       ALA 135   8.334  -5.339 -13.777
 1014   1HB   ALA 135          HB1       ALA 135   6.340  -4.380 -14.884
 1015   2HB   ALA 135          HB2       ALA 135   7.804  -3.929 -15.788
 1016   3HB   ALA 135          HB3       ALA 135   6.746  -5.220 -16.392
 1017    H    GLU 136           H        GLU 136   7.349  -7.766 -16.163
 1018    HA   GLU 136           HA       GLU 136   5.095  -8.647 -14.569
 1019   1HB   GLU 136          HB2       GLU 136   4.889  -8.451 -16.968
 1020   2HB   GLU 136          HB3       GLU 136   6.256  -9.542 -17.235
 1021   1HG   GLU 136          HG2       GLU 136   5.027 -11.427 -16.310
 1022   2HG   GLU 136          HG3       GLU 136   3.691 -10.377 -15.830
 1023    H    THR 137           H        THR 137   8.260  -9.953 -15.498
 1024    HA   THR 137           HA       THR 137   7.693 -12.419 -13.946
 1025    HB   THR 137           HB       THR 137   9.009 -13.641 -15.472
 1026    HG1  THR 137           HG1      THR 137   9.752 -11.113 -16.500
 1027   1HG2  THR 137          HG21      THR 137   7.857 -13.392 -17.576
 1028   2HG2  THR 137          HG22      THR 137   6.702 -13.093 -16.265
 1029   3HG2  THR 137          HG23      THR 137   7.381 -11.727 -17.194
 1030    H    GLY 138           H        GLY 138   9.831  -9.661 -14.179
 1031   1HA   GLY 138          HA1       GLY 138  11.455  -8.996 -12.654
 1032   2HA   GLY 138          HA2       GLY 138  11.453 -10.597 -11.912
 1033    H    LYS 139           H        LYS 139  11.687 -10.750 -15.390
 1034    HA   LYS 139           HA       LYS 139  14.439 -11.665 -15.094
 1035   1HB   LYS 139          HB2       LYS 139  12.479 -11.981 -17.379
 1036   2HB   LYS 139          HB3       LYS 139  14.114 -12.644 -17.337
 1037   1HG   LYS 139          HG2       LYS 139  11.893 -13.300 -15.372
 1038   2HG   LYS 139          HG3       LYS 139  12.374 -14.301 -16.750
 1039   1HD   LYS 139          HD2       LYS 139  14.634 -14.570 -15.686
 1040   2HD   LYS 139          HD3       LYS 139  14.043 -13.637 -14.284
 1041   1HE   LYS 139          HE2       LYS 139  12.233 -15.270 -13.934
 1042   2HE   LYS 139          HE3       LYS 139  12.798 -16.217 -15.317
 1043   1HZ   LYS 139          HZ1       LYS 139  14.875 -16.607 -14.119
 1044   2HZ   LYS 139          HZ2       LYS 139  14.351 -15.736 -12.837
 1045   3HZ   LYS 139          HZ3       LYS 139  13.609 -17.129 -13.237
  Start of MODEL   15
    1   1H    MET   1           H1       MET   1   0.508   4.510   1.044
    2   2H    MET   1           H2       MET   1   1.831   5.381   0.646
    3   3H    MET   1           H3       MET   1   1.434   4.063  -0.233
    4    HA   MET   1           HA       MET   1   2.245   4.121   2.576
    5   1HB   MET   1          HB2       MET   1   2.311   1.710   2.619
    6   2HB   MET   1          HB3       MET   1   0.713   2.344   2.309
    7   1HG   MET   1          HG2       MET   1   0.707   0.575   0.912
    8   2HG   MET   1          HG3       MET   1   1.232   1.811  -0.217
    9   1HE   MET   1          HE1       MET   1   2.034   0.006  -1.947
   10   2HE   MET   1          HE2       MET   1   3.048  -1.393  -1.528
   11   3HE   MET   1          HE3       MET   1   1.408  -1.253  -0.856
   12    H    GLU   2           H        GLU   2   3.475   2.711  -0.596
   13    HA   GLU   2           HA       GLU   2   5.997   4.117  -0.191
   14   1HB   GLU   2          HB2       GLU   2   6.172   1.937   1.102
   15   2HB   GLU   2          HB3       GLU   2   5.866   1.067  -0.404
   16   1HG   GLU   2          HG2       GLU   2   7.934   1.981  -1.378
   17   2HG   GLU   2          HG3       GLU   2   8.198   2.981   0.055
   18    H    ASN   3           H        ASN   3   7.248   3.999  -2.263
   19    HA   ASN   3           HA       ASN   3   5.911   2.877  -4.624
   20   1HB   ASN   3          HB2       ASN   3   5.207   5.371  -4.166
   21   2HB   ASN   3          HB3       ASN   3   6.870   5.773  -4.592
   22   1HD2  ASN   3          HD21      ASN   3   7.602   5.080  -6.852
   23   2HD2  ASN   3          HD22      ASN   3   6.333   5.073  -8.089
   24    H    LYS   4           H        LYS   4   7.592   2.225  -6.102
   25    HA   LYS   4           HA       LYS   4  10.320   2.190  -4.958
   26   1HB   LYS   4          HB2       LYS   4   9.013   0.983  -7.442
   27   2HB   LYS   4          HB3       LYS   4  10.751   0.966  -7.219
   28   1HG   LYS   4          HG2       LYS   4   9.958  -1.137  -6.607
   29   2HG   LYS   4          HG3       LYS   4  10.497  -0.350  -5.135
   30   1HD   LYS   4          HD2       LYS   4   7.566  -0.180  -5.877
   31   2HD   LYS   4          HD3       LYS   4   8.177  -1.741  -5.366
   32   1HE   LYS   4          HE2       LYS   4   8.545   0.785  -3.704
   33   2HE   LYS   4          HE3       LYS   4   7.152  -0.292  -3.549
   34   1HZ   LYS   4          HZ1       LYS   4   9.963  -1.115  -3.102
   35   2HZ   LYS   4          HZ2       LYS   4   8.863  -0.812  -1.931
   36   3HZ   LYS   4          HZ3       LYS   4   8.649  -2.079  -2.942
   37    H    ILE   5           H        ILE   5  12.093   2.607  -6.693
   38    HA   ILE   5           HA       ILE   5  11.606   4.951  -8.380
   39    HB   ILE   5           HB       ILE   5  13.841   4.811  -6.332
   40   1HG1  ILE   5          HG12      ILE   5  12.630   7.077  -5.537
   41   2HG1  ILE   5          HG13      ILE   5  11.205   6.177  -6.037
   42   1HG2  ILE   5          HG21      ILE   5  14.451   6.052  -8.401
   43   2HG2  ILE   5          HG22      ILE   5  13.031   7.088  -8.179
   44   3HG2  ILE   5          HG23      ILE   5  14.369   7.129  -7.012
   45   1HD1  ILE   5          HD11      ILE   5  13.361   5.301  -4.060
   46   2HD1  ILE   5          HD12      ILE   5  11.716   5.827  -3.649
   47   3HD1  ILE   5          HD13      ILE   5  11.980   4.293  -4.502
   48    H    ILE   6           H        ILE   6  13.147   4.824 -10.202
   49    HA   ILE   6           HA       ILE   6  15.210   2.754 -10.116
   50    HB   ILE   6           HB       ILE   6  13.338   1.384 -10.668
   51   1HG1  ILE   6          HG12      ILE   6  14.884   1.897 -13.246
   52   2HG1  ILE   6          HG13      ILE   6  15.494   0.985 -11.860
   53   1HG2  ILE   6          HG21      ILE   6  12.712   3.122 -13.072
   54   2HG2  ILE   6          HG22      ILE   6  11.812   1.706 -12.505
   55   3HG2  ILE   6          HG23      ILE   6  11.789   3.176 -11.548
   56   1HD1  ILE   6          HD11      ILE   6  13.613  -0.623 -12.125
   57   2HD1  ILE   6          HD12      ILE   6  13.115   0.243 -13.601
   58   3HD1  ILE   6          HD13      ILE   6  14.694  -0.549 -13.536
   59    H    TYR   7           H        TYR   7  16.777   3.021 -11.849
   60    HA   TYR   7           HA       TYR   7  16.568   5.628 -13.270
   61   1HB   TYR   7          HB2       TYR   7  17.739   5.548 -10.952
   62   2HB   TYR   7          HB3       TYR   7  18.994   4.626 -11.739
   63    HD1  TYR   7           HD1      TYR   7  20.475   6.330 -10.753
   64    HD2  TYR   7           HD2      TYR   7  17.528   7.430 -13.708
   65    HE1  TYR   7           HE1      TYR   7  21.428   8.618 -10.875
   66    HE2  TYR   7           HE2      TYR   7  18.456   9.698 -13.803
   67    HH   TYR   7           HH       TYR   7  19.952  11.208 -12.839
   68    H    PHE   8           H        PHE   8  17.189   5.464 -15.357
   69    HA   PHE   8           HA       PHE   8  18.785   3.089 -16.258
   70   1HB   PHE   8          HB2       PHE   8  16.931   4.903 -17.857
   71   2HB   PHE   8          HB3       PHE   8  17.782   3.487 -18.460
   72    HD1  PHE   8           HD1      PHE   8  14.797   4.693 -16.812
   73    HD2  PHE   8           HD2      PHE   8  17.203   1.181 -17.480
   74    HE1  PHE   8           HE1      PHE   8  12.924   3.251 -16.077
   75    HE2  PHE   8           HE2      PHE   8  15.347  -0.249 -16.693
   76    HZ   PHE   8           HZ       PHE   8  13.207   0.786 -15.956
   77    H    LEU   9           H        LEU   9  20.795   3.467 -17.107
   78    HA   LEU   9           HA       LEU   9  21.604   6.305 -17.570
   79   1HB   LEU   9          HB2       LEU   9  23.090   4.050 -16.183
   80   2HB   LEU   9          HB3       LEU   9  23.744   5.651 -16.510
   81    HG   LEU   9           HG       LEU   9  21.473   4.973 -14.590
   82   1HD1  LEU   9          HD11      LEU   9  23.071   5.710 -12.877
   83   2HD1  LEU   9          HD12      LEU   9  23.751   4.374 -13.821
   84   3HD1  LEU   9          HD13      LEU   9  24.296   6.037 -14.119
   85   1HD2  LEU   9          HD21      LEU   9  22.645   7.650 -15.430
   86   2HD2  LEU   9          HD22      LEU   9  20.948   7.143 -15.482
   87   3HD2  LEU   9          HD23      LEU   9  21.718   7.411 -13.926
   88    H    CYS  10           H        CYS  10  22.848   6.708 -19.378
   89    HA   CYS  10           HA       CYS  10  24.570   4.553 -20.335
   90   1HB   CYS  10          HB2       CYS  10  23.909   4.632 -22.701
   91   2HB   CYS  10          HB3       CYS  10  22.678   3.965 -21.647
   92    HG   CYS  10           HG       CYS  10  22.776   7.053 -22.926
   93    H    THR  11           H        THR  11  25.638   5.637 -22.634
   94    HA   THR  11           HA       THR  11  27.509   7.315 -21.360
   95    HB   THR  11           HB       THR  11  28.492   7.372 -23.717
   96    HG1  THR  11           HG1      THR  11  26.797   7.066 -25.050
   97   1HG2  THR  11          HG21      THR  11  28.959   5.543 -22.006
   98   2HG2  THR  11          HG22      THR  11  27.681   4.578 -22.764
   99   3HG2  THR  11          HG23      THR  11  29.110   5.032 -23.703
  100    H    GLY  12           H        GLY  12  24.562   8.159 -23.011
  101   1HA   GLY  12          HA1       GLY  12  24.889  10.889 -22.138
  102   2HA   GLY  12          HA2       GLY  12  24.725  10.724 -23.902
  103    H    ASN  13           H        ASN  13  22.797  11.733 -21.725
  104    HA   ASN  13           HA       ASN  13  20.756   9.709 -21.505
  105   1HB   ASN  13          HB2       ASN  13  21.260  11.464 -19.750
  106   2HB   ASN  13          HB3       ASN  13  20.541  12.663 -20.829
  107   1HD2  ASN  13          HD22      ASN  13  19.146   9.274 -20.420
  108   2HD2  ASN  13          HD21      ASN  13  17.703   9.889 -19.644
  109    H    SER  14           H        SER  14  21.007   9.842 -24.172
  110    HA   SER  14           HA       SER  14  18.779  11.611 -25.104
  111   1HB   SER  14          HB2       SER  14  21.377  10.978 -26.540
  112   2HB   SER  14          HB3       SER  14  20.099  12.076 -27.095
  113    HG   SER  14           HG       SER  14  20.477  13.381 -25.330
  114    H    CYS  15           H        CYS  15  19.813   8.346 -25.007
  115    HA   CYS  15           HA       CYS  15  17.953   7.651 -27.231
  116   1HB   CYS  15          HB2       CYS  15  19.791   5.979 -27.877
  117   2HB   CYS  15          HB3       CYS  15  20.103   7.684 -28.247
  118    HG   CYS  15           HG       CYS  15  22.351   6.619 -27.492
  119    H    ARG  16           H        ARG  16  20.031   5.329 -25.787
  120    HA   ARG  16           HA       ARG  16  18.042   3.425 -25.320
  121   1HB   ARG  16          HB2       ARG  16  20.789   3.827 -24.035
  122   2HB   ARG  16          HB3       ARG  16  19.840   2.369 -23.834
  123   1HG   ARG  16          HG2       ARG  16  20.042   1.714 -26.074
  124   2HG   ARG  16          HG3       ARG  16  20.546   3.312 -26.625
  125   1HD   ARG  16          HD2       ARG  16  22.207   1.630 -24.706
  126   2HD   ARG  16          HD3       ARG  16  22.393   1.559 -26.463
  127    HE   ARG  16           HE       ARG  16  22.562   4.257 -25.924
  128   1HH1  ARG  16          HH21      ARG  16  24.334   1.495 -24.534
  129   2HH1  ARG  16          HH22      ARG  16  25.886   2.316 -24.695
  130   1HH2  ARG  16          HH11      ARG  16  24.586   5.293 -26.000
  131   2HH2  ARG  16          HH12      ARG  16  25.903   4.662 -25.089
  132    H    SER  17           H        SER  17  19.486   5.717 -22.973
  133    HA   SER  17           HA       SER  17  18.106   4.586 -20.715
  134   1HB   SER  17          HB2       SER  17  18.895   6.671 -19.568
  135   2HB   SER  17          HB3       SER  17  20.150   5.781 -20.396
  136    HG   SER  17           HG       SER  17  20.510   7.440 -21.597
  137    H    GLN  18           H        GLN  18  17.409   7.355 -22.829
  138    HA   GLN  18           HA       GLN  18  15.066   8.307 -21.519
  139   1HB   GLN  18          HB2       GLN  18  16.114   8.486 -24.381
  140   2HB   GLN  18          HB3       GLN  18  14.608   9.234 -23.902
  141   1HG   GLN  18          HG2       GLN  18  17.234   9.806 -22.469
  142   2HG   GLN  18          HG3       GLN  18  16.698  10.714 -23.878
  143   1HE2  GLN  18          HE22      GLN  18  17.014  11.561 -20.906
  144   2HE2  GLN  18          HE21      GLN  18  15.489  12.375 -20.656
  145    H    MET  19           H        MET  19  15.453   6.087 -24.294
  146    HA   MET  19           HA       MET  19  12.683   5.531 -24.641
  147   1HB   MET  19          HB2       MET  19  15.087   3.767 -25.303
  148   2HB   MET  19          HB3       MET  19  13.426   3.489 -25.834
  149   1HG   MET  19          HG2       MET  19  13.591   5.931 -26.796
  150   2HG   MET  19          HG3       MET  19  15.332   5.662 -26.704
  151   1HE   MET  19          HE1       MET  19  15.862   2.678 -29.195
  152   2HE   MET  19          HE2       MET  19  16.638   3.797 -28.049
  153   3HE   MET  19          HE3       MET  19  15.562   2.508 -27.453
  154    H    ALA  20           H        ALA  20  15.153   3.863 -22.592
  155    HA   ALA  20           HA       ALA  20  13.420   1.777 -21.738
  156   1HB   ALA  20          HB1       ALA  20  15.859   1.695 -21.483
  157   2HB   ALA  20          HB2       ALA  20  15.809   3.035 -20.312
  158   3HB   ALA  20          HB3       ALA  20  15.057   1.474 -19.914
  159    H    GLU  21           H        GLU  21  14.114   4.971 -20.211
  160    HA   GLU  21           HA       GLU  21  12.292   4.745 -18.066
  161   1HB   GLU  21          HB2       GLU  21  13.596   6.593 -17.872
  162   2HB   GLU  21          HB3       GLU  21  13.550   6.991 -19.592
  163   1HG   GLU  21          HG2       GLU  21  11.418   8.015 -19.433
  164   2HG   GLU  21          HG3       GLU  21  11.099   7.360 -17.852
  165    H    GLY  22           H        GLY  22  11.671   5.708 -21.467
  166   1HA   GLY  22          HA1       GLY  22   8.954   6.436 -21.189
  167   2HA   GLY  22          HA2       GLY  22   9.721   5.798 -22.671
  168    H    TRP  23           H        TRP  23  10.350   3.242 -22.115
  169    HA   TRP  23           HA       TRP  23   7.813   1.878 -22.157
  170   1HB   TRP  23          HB2       TRP  23  10.678   0.917 -21.768
  171   2HB   TRP  23          HB3       TRP  23   9.301  -0.173 -21.790
  172    HD1  TRP  23           HD1      TRP  23  11.686   1.456 -24.081
  173    HE1  TRP  23           HE1      TRP  23  11.087   0.974 -26.499
  174    HE3  TRP  23           HE3      TRP  23   6.946  -0.337 -23.379
  175    HZ2  TRP  23           HZ2      TRP  23   8.767  -0.006 -27.999
  176    HZ3  TRP  23           HZ3      TRP  23   5.617  -1.153 -25.299
  177    HH2  TRP  23           HH2      TRP  23   6.535  -1.035 -27.601
  178    H    ALA  24           H        ALA  24  10.294   2.269 -19.603
  179    HA   ALA  24           HA       ALA  24   9.163   0.474 -17.774
  180   1HB   ALA  24          HB1       ALA  24  11.477   1.377 -17.658
  181   2HB   ALA  24          HB2       ALA  24  10.836   2.975 -17.247
  182   3HB   ALA  24          HB3       ALA  24  10.631   1.600 -16.124
  183    H    LYS  25           H        LYS  25   8.652   4.025 -18.065
  184    HA   LYS  25           HA       LYS  25   7.008   4.245 -15.803
  185   1HB   LYS  25          HB2       LYS  25   8.027   6.077 -17.287
  186   2HB   LYS  25          HB3       LYS  25   6.628   5.863 -18.350
  187   1HG   LYS  25          HG2       LYS  25   5.125   6.435 -16.433
  188   2HG   LYS  25          HG3       LYS  25   6.546   6.579 -15.375
  189   1HD   LYS  25          HD2       LYS  25   7.420   8.411 -16.878
  190   2HD   LYS  25          HD3       LYS  25   5.952   8.264 -17.846
  191   1HE   LYS  25          HE2       LYS  25   5.603  10.119 -16.423
  192   2HE   LYS  25          HE3       LYS  25   4.594   8.819 -15.786
  193   1HZ   LYS  25          HZ1       LYS  25   7.254   9.559 -14.692
  194   2HZ   LYS  25          HZ2       LYS  25   5.832  10.061 -14.081
  195   3HZ   LYS  25          HZ3       LYS  25   6.206   8.479 -14.015
  196    H    GLN  26           H        GLN  26   6.161   3.124 -19.078
  197    HA   GLN  26           HA       GLN  26   3.343   3.011 -18.521
  198   1HB   GLN  26          HB2       GLN  26   4.657   1.187 -20.544
  199   2HB   GLN  26          HB3       GLN  26   3.017   1.808 -20.498
  200   1HG   GLN  26          HG2       GLN  26   5.552   3.136 -21.368
  201   2HG   GLN  26          HG3       GLN  26   4.053   2.945 -22.248
  202   1HE2  GLN  26          HE22      GLN  26   5.955   5.235 -20.869
  203   2HE2  GLN  26          HE21      GLN  26   4.741   6.446 -20.473
  204    H    TYR  27           H        TYR  27   5.783   0.374 -18.746
  205    HA   TYR  27           HA       TYR  27   3.943  -1.637 -17.958
  206   1HB   TYR  27          HB2       TYR  27   6.982  -1.598 -17.811
  207   2HB   TYR  27          HB3       TYR  27   6.006  -3.021 -17.499
  208    HD1  TYR  27           HD1      TYR  27   4.179  -3.574 -19.427
  209    HD2  TYR  27           HD2      TYR  27   7.887  -1.448 -19.965
  210    HE1  TYR  27           HE1      TYR  27   4.207  -4.247 -21.805
  211    HE2  TYR  27           HE2      TYR  27   7.996  -2.228 -22.319
  212    HH   TYR  27           HH       TYR  27   5.375  -4.175 -23.823
  213    H    LEU  28           H        LEU  28   6.302   0.207 -16.028
  214    HA   LEU  28           HA       LEU  28   5.678  -1.197 -13.557
  215   1HB   LEU  28          HB2       LEU  28   7.234   1.378 -14.033
  216   2HB   LEU  28          HB3       LEU  28   7.223   0.440 -12.571
  217    HG   LEU  28           HG       LEU  28   8.312  -0.555 -15.233
  218   1HD1  LEU  28          HD11      LEU  28   9.635   1.257 -14.109
  219   2HD1  LEU  28          HD12      LEU  28   9.842   0.172 -12.715
  220   3HD1  LEU  28          HD13      LEU  28  10.500  -0.279 -14.300
  221   1HD2  LEU  28          HD21      LEU  28   7.468  -2.434 -13.872
  222   2HD2  LEU  28          HD22      LEU  28   9.227  -2.443 -13.944
  223   3HD2  LEU  28          HD23      LEU  28   8.409  -1.860 -12.481
  224    H    GLY  29           H        GLY  29   3.849   1.024 -15.259
  225   1HA   GLY  29          HA1       GLY  29   2.045   2.271 -14.758
  226   2HA   GLY  29          HA2       GLY  29   1.888   1.240 -13.325
  227    H    ASP  30           H        ASP  30   4.646   3.335 -13.787
  228    HA   ASP  30           HA       ASP  30   5.666   4.818 -12.501
  229   1HB   ASP  30          HB2       ASP  30   3.855   6.189 -13.560
  230   2HB   ASP  30          HB3       ASP  30   2.981   6.119 -12.026
  231    H    GLU  31           H        GLU  31   4.078   2.438 -11.114
  232    HA   GLU  31           HA       GLU  31   4.033   3.165  -8.326
  233   1HB   GLU  31          HB2       GLU  31   4.486   0.367  -9.427
  234   2HB   GLU  31          HB3       GLU  31   3.868   0.838  -7.848
  235   1HG   GLU  31          HG2       GLU  31   1.875   1.866  -9.112
  236   2HG   GLU  31          HG3       GLU  31   2.494   1.012 -10.539
  237    H    TRP  32           H        TRP  32   6.446   3.023 -10.540
  238    HA   TRP  32           HA       TRP  32   8.609   2.864  -8.576
  239   1HB   TRP  32          HB2       TRP  32   8.775   1.865 -11.444
  240   2HB   TRP  32          HB3       TRP  32  10.039   1.800 -10.232
  241    HD1  TRP  32           HD1      TRP  32   6.415   0.372 -10.429
  242    HE1  TRP  32           HE1      TRP  32   6.397  -2.046  -9.734
  243    HE3  TRP  32           HE3      TRP  32  11.441  -0.231  -9.604
  244    HZ2  TRP  32           HZ2      TRP  32   8.329  -4.101  -9.200
  245    HZ3  TRP  32           HZ3      TRP  32  12.328  -2.484  -9.074
  246    HH2  TRP  32           HH2      TRP  32  10.792  -4.444  -8.936
  247    H    LYS  33           H        LYS  33   9.254   4.995  -8.541
  248    HA   LYS  33           HA       LYS  33   8.600   6.921 -10.572
  249   1HB   LYS  33          HB2       LYS  33  10.538   6.994  -8.196
  250   2HB   LYS  33          HB3       LYS  33  10.118   8.393  -9.189
  251   1HG   LYS  33          HG2       LYS  33   8.454   6.898  -7.172
  252   2HG   LYS  33          HG3       LYS  33   8.912   8.580  -7.170
  253   1HD   LYS  33          HD2       LYS  33   6.867   7.302  -9.045
  254   2HD   LYS  33          HD3       LYS  33   6.530   8.297  -7.628
  255   1HE   LYS  33          HE2       LYS  33   7.790  10.196  -8.720
  256   2HE   LYS  33          HE3       LYS  33   7.937   9.201 -10.178
  257   1HZ   LYS  33          HZ1       LYS  33   6.043  10.660 -10.343
  258   2HZ   LYS  33          HZ2       LYS  33   5.483   9.117 -10.256
  259   3HZ   LYS  33          HZ3       LYS  33   5.398  10.108  -8.953
  260    H    VAL  34           H        VAL  34   9.457   6.041 -12.518
  261    HA   VAL  34           HA       VAL  34  12.205   5.303 -12.628
  262    HB   VAL  34           HB       VAL  34  11.810   4.520 -14.668
  263   1HG1  VAL  34          HG11      VAL  34   9.948   3.605 -13.284
  264   2HG1  VAL  34          HG12      VAL  34   8.873   4.849 -13.961
  265   3HG1  VAL  34          HG13      VAL  34   9.603   3.632 -15.016
  266   1HG2  VAL  34          HG21      VAL  34  11.636   6.550 -15.862
  267   2HG2  VAL  34          HG22      VAL  34  10.356   5.462 -16.410
  268   3HG2  VAL  34          HG23      VAL  34   9.951   6.811 -15.319
  269    H    TYR  35           H        TYR  35  13.836   6.338 -13.826
  270    HA   TYR  35           HA       TYR  35  13.600   9.151 -14.663
  271   1HB   TYR  35          HB2       TYR  35  15.503   8.113 -12.505
  272   2HB   TYR  35          HB3       TYR  35  15.745   9.625 -13.357
  273    HD1  TYR  35           HD1      TYR  35  13.880   7.941 -10.694
  274    HD2  TYR  35           HD2      TYR  35  14.243  11.569 -13.003
  275    HE1  TYR  35           HE1      TYR  35  12.558   9.153  -8.990
  276    HE2  TYR  35           HE2      TYR  35  12.922  12.792 -11.301
  277    HH   TYR  35           HH       TYR  35  11.647  11.202  -8.338
  278    H    SER  36           H        SER  36  15.651   9.722 -15.915
  279    HA   SER  36           HA       SER  36  17.456   7.487 -16.380
  280   1HB   SER  36          HB2       SER  36  17.418   7.711 -18.783
  281   2HB   SER  36          HB3       SER  36  15.814   7.266 -18.208
  282    HG   SER  36           HG       SER  36  15.096   9.297 -18.599
  283    H    ALA  37           H        ALA  37  19.535   8.173 -17.188
  284    HA   ALA  37           HA       ALA  37  20.096  10.981 -17.583
  285   1HB   ALA  37          HB1       ALA  37  20.012  10.999 -15.143
  286   2HB   ALA  37          HB2       ALA  37  21.189   9.670 -15.068
  287   3HB   ALA  37          HB3       ALA  37  21.646  11.261 -15.714
  288    H    GLY  38           H        GLY  38  22.830  11.008 -17.306
  289   1HA   GLY  38          HA1       GLY  38  24.150   8.622 -18.097
  290   2HA   GLY  38          HA2       GLY  38  23.844   9.644 -19.516
  291    H    ILE  39           H        ILE  39  26.342   9.288 -19.170
  292    HA   ILE  39           HA       ILE  39  27.845  10.949 -17.434
  293    HB   ILE  39           HB       ILE  39  28.216   9.415 -19.971
  294   1HG1  ILE  39          HG12      ILE  39  29.984   9.580 -17.504
  295   2HG1  ILE  39          HG13      ILE  39  28.517   8.614 -17.553
  296   1HG2  ILE  39          HG21      ILE  39  29.340  11.447 -20.668
  297   2HG2  ILE  39          HG22      ILE  39  30.292  11.468 -19.158
  298   3HG2  ILE  39          HG23      ILE  39  30.514  10.178 -20.364
  299   1HD1  ILE  39          HD11      ILE  39  30.431   7.193 -18.032
  300   2HD1  ILE  39          HD12      ILE  39  29.416   7.316 -19.483
  301   3HD1  ILE  39          HD13      ILE  39  30.937   8.235 -19.363
  302    H    GLU  40           H        GLU  40  25.906  11.799 -20.236
  303    HA   GLU  40           HA       GLU  40  26.360  14.575 -19.663
  304   1HB   GLU  40          HB2       GLU  40  26.696  15.267 -21.965
  305   2HB   GLU  40          HB3       GLU  40  28.060  14.326 -21.376
  306   1HG   GLU  40          HG2       GLU  40  27.455  12.404 -22.667
  307   2HG   GLU  40          HG3       GLU  40  25.834  13.018 -22.995
  308    H    ALA  41           H        ALA  41  24.695  15.875 -21.019
  309    HA   ALA  41           HA       ALA  41  22.533  14.363 -22.222
  310   1HB   ALA  41          HB1       ALA  41  20.798  15.493 -20.824
  311   2HB   ALA  41          HB2       ALA  41  21.807  14.385 -19.867
  312   3HB   ALA  41          HB3       ALA  41  22.071  16.142 -19.773
  313    H    HIS  42           H        HIS  42  21.798  15.569 -23.900
  314    HA   HIS  42           HA       HIS  42  22.087  18.519 -23.896
  315   1HB   HIS  42          HB2       HIS  42  23.172  16.589 -25.995
  316   2HB   HIS  42          HB3       HIS  42  22.888  18.297 -26.316
  317    HD1  HIS  42           HD1      HIS  42  25.633  16.117 -24.944
  318    HD2  HIS  42           HD2      HIS  42  24.239  20.099 -24.640
  319    HE1  HIS  42           HE1      HIS  42  27.536  17.478 -23.990
  320    H    GLY  43           H        GLY  43  19.905  16.342 -23.630
  321   1HA   GLY  43          HA1       GLY  43  17.571  16.829 -24.186
  322   2HA   GLY  43          HA2       GLY  43  18.088  17.280 -25.818
  323    H    LEU  44           H        LEU  44  16.321  15.517 -26.123
  324    HA   LEU  44           HA       LEU  44  17.568  12.832 -26.147
  325   1HB   LEU  44          HB2       LEU  44  15.499  11.798 -25.917
  326   2HB   LEU  44          HB3       LEU  44  15.615  13.009 -24.645
  327    HG   LEU  44           HG       LEU  44  13.955  13.116 -27.184
  328   1HD1  LEU  44          HD11      LEU  44  12.068  12.872 -25.733
  329   2HD1  LEU  44          HD12      LEU  44  13.233  11.638 -25.237
  330   3HD1  LEU  44          HD13      LEU  44  13.036  13.101 -24.264
  331   1HD2  LEU  44          HD21      LEU  44  14.177  15.242 -25.009
  332   2HD2  LEU  44          HD22      LEU  44  14.507  15.436 -26.754
  333   3HD2  LEU  44          HD23      LEU  44  12.861  15.159 -26.201
  334    H    ASN  45           H        ASN  45  17.378  11.540 -27.971
  335    HA   ASN  45           HA       ASN  45  17.941  13.079 -30.307
  336   1HB   ASN  45          HB2       ASN  45  19.052  10.964 -29.582
  337   2HB   ASN  45          HB3       ASN  45  17.586  10.072 -29.967
  338   1HD2  ASN  45          HD22      ASN  45  20.581  10.674 -31.146
  339   2HD2  ASN  45          HD21      ASN  45  20.250  10.578 -32.858
  340    HA   PRO  46           HA       PRO  46  13.776  13.293 -32.033
  341   1HB   PRO  46          HB2       PRO  46  15.289  13.126 -34.648
  342   2HB   PRO  46          HB3       PRO  46  13.923  14.199 -34.206
  343   1HG   PRO  46          HG2       PRO  46  16.459  15.146 -34.165
  344   2HG   PRO  46          HG3       PRO  46  15.335  15.548 -32.826
  345   1HD   PRO  46          HD2       PRO  46  17.525  13.467 -32.881
  346   2HD   PRO  46          HD3       PRO  46  17.063  14.603 -31.575
  347    H    ASN  47           H        ASN  47  16.079  10.742 -33.104
  348    HA   ASN  47           HA       ASN  47  13.930   9.155 -34.338
  349   1HB   ASN  47          HB2       ASN  47  16.869   8.642 -33.798
  350   2HB   ASN  47          HB3       ASN  47  15.779   7.380 -34.359
  351   1HD2  ASN  47          HD22      ASN  47  18.174   8.722 -35.692
  352   2HD2  ASN  47          HD21      ASN  47  17.546   9.181 -37.253
  353    H    ALA  48           H        ALA  48  15.508   9.466 -31.184
  354    HA   ALA  48           HA       ALA  48  14.490   7.025 -30.066
  355   1HB   ALA  48          HB1       ALA  48  15.004   7.982 -27.918
  356   2HB   ALA  48          HB2       ALA  48  16.304   8.514 -29.000
  357   3HB   ALA  48          HB3       ALA  48  15.017   9.632 -28.550
  358    H    VAL  49           H        VAL  49  13.357  10.445 -30.145
  359    HA   VAL  49           HA       VAL  49  10.860  10.036 -28.929
  360    HB   VAL  49           HB       VAL  49  11.662  12.055 -31.068
  361   1HG1  VAL  49          HG11      VAL  49   9.753  13.414 -30.196
  362   2HG1  VAL  49          HG12      VAL  49   9.225  11.951 -31.029
  363   3HG1  VAL  49          HG13      VAL  49   9.216  12.009 -29.252
  364   1HG2  VAL  49          HG21      VAL  49  12.998  12.203 -29.006
  365   2HG2  VAL  49          HG22      VAL  49  11.924  13.593 -29.171
  366   3HG2  VAL  49          HG23      VAL  49  11.507  12.291 -28.040
  367    H    LYS  50           H        LYS  50  11.644   9.944 -32.494
  368    HA   LYS  50           HA       LYS  50   9.041   9.257 -33.267
  369   1HB   LYS  50          HB2       LYS  50  11.019  10.026 -34.734
  370   2HB   LYS  50          HB3       LYS  50  11.583   8.356 -34.695
  371   1HG   LYS  50          HG2       LYS  50  10.415   8.677 -36.736
  372   2HG   LYS  50          HG3       LYS  50   9.388   7.654 -35.730
  373   1HD   LYS  50          HD2       LYS  50   7.981   9.604 -35.145
  374   2HD   LYS  50          HD3       LYS  50   9.014  10.665 -36.108
  375   1HE   LYS  50          HE2       LYS  50   7.440   8.273 -37.181
  376   2HE   LYS  50          HE3       LYS  50   6.871   9.941 -37.219
  377   1HZ   LYS  50          HZ1       LYS  50   7.855   9.331 -39.315
  378   2HZ   LYS  50          HZ2       LYS  50   8.758  10.501 -38.634
  379   3HZ   LYS  50          HZ3       LYS  50   9.280   8.949 -38.627
  380    H    ALA  51           H        ALA  51  11.717   7.094 -32.266
  381    HA   ALA  51           HA       ALA  51  10.437   4.654 -32.959
  382   1HB   ALA  51          HB1       ALA  51  12.082   3.655 -31.389
  383   2HB   ALA  51          HB2       ALA  51  12.858   4.875 -32.405
  384   3HB   ALA  51          HB3       ALA  51  12.448   5.257 -30.725
  385    H    MET  52           H        MET  52  10.393   6.567 -29.885
  386    HA   MET  52           HA       MET  52   8.641   4.693 -28.571
  387   1HB   MET  52          HB2       MET  52   9.196   7.625 -27.981
  388   2HB   MET  52          HB3       MET  52   8.304   6.530 -26.929
  389   1HG   MET  52          HG2       MET  52  11.234   6.397 -27.681
  390   2HG   MET  52          HG3       MET  52  10.527   6.665 -26.102
  391   1HE   MET  52          HE1       MET  52   9.171   3.092 -25.182
  392   2HE   MET  52          HE2       MET  52   9.038   4.833 -24.902
  393   3HE   MET  52          HE3       MET  52   8.251   4.082 -26.323
  394    H    LYS  53           H        LYS  53   8.023   7.660 -30.508
  395    HA   LYS  53           HA       LYS  53   5.221   7.686 -30.088
  396   1HB   LYS  53          HB2       LYS  53   6.911   8.577 -32.431
  397   2HB   LYS  53          HB3       LYS  53   5.193   8.928 -32.304
  398   1HG   LYS  53          HG2       LYS  53   6.874   9.696 -29.922
  399   2HG   LYS  53          HG3       LYS  53   7.164  10.588 -31.414
  400   1HD   LYS  53          HD2       LYS  53   5.610  11.792 -30.059
  401   2HD   LYS  53          HD3       LYS  53   4.786  11.229 -31.520
  402   1HE   LYS  53          HE2       LYS  53   3.689   9.436 -30.267
  403   2HE   LYS  53          HE3       LYS  53   4.636   9.819 -28.819
  404   1HZ   LYS  53          HZ1       LYS  53   2.404  10.779 -28.727
  405   2HZ   LYS  53          HZ2       LYS  53   3.537  11.969 -28.717
  406   3HZ   LYS  53          HZ3       LYS  53   2.670  11.650 -30.078
  407    H    GLU  54           H        GLU  54   7.214   5.563 -32.102
  408    HA   GLU  54           HA       GLU  54   5.067   4.702 -33.767
  409   1HB   GLU  54          HB2       GLU  54   7.477   4.582 -34.357
  410   2HB   GLU  54          HB3       GLU  54   7.661   3.264 -33.205
  411   1HG   GLU  54          HG2       GLU  54   6.103   1.870 -34.480
  412   2HG   GLU  54          HG3       GLU  54   5.668   3.231 -35.517
  413    H    VAL  55           H        VAL  55   5.852   4.043 -30.458
  414    HA   VAL  55           HA       VAL  55   3.960   1.726 -30.467
  415    HB   VAL  55           HB       VAL  55   5.062   1.032 -28.386
  416   1HG1  VAL  55          HG11      VAL  55   6.944   1.392 -30.771
  417   2HG1  VAL  55          HG12      VAL  55   7.104   0.182 -29.495
  418   3HG1  VAL  55          HG13      VAL  55   5.722   0.120 -30.588
  419   1HG2  VAL  55          HG21      VAL  55   7.199   3.114 -28.976
  420   2HG2  VAL  55          HG22      VAL  55   5.940   3.350 -27.738
  421   3HG2  VAL  55          HG23      VAL  55   7.100   2.036 -27.584
  422    H    GLY  56           H        GLY  56   4.012   5.006 -29.814
  423   1HA   GLY  56          HA1       GLY  56   2.090   6.167 -29.191
  424   2HA   GLY  56          HA2       GLY  56   1.440   4.727 -28.389
  425    H    ILE  57           H        ILE  57   4.754   6.025 -27.939
  426    HA   ILE  57           HA       ILE  57   4.085   6.911 -25.184
  427    HB   ILE  57           HB       ILE  57   6.456   5.270 -26.157
  428   1HG1  ILE  57          HG12      ILE  57   4.326   4.560 -24.092
  429   2HG1  ILE  57          HG13      ILE  57   4.345   3.961 -25.745
  430   1HG2  ILE  57          HG21      ILE  57   5.915   6.501 -23.419
  431   2HG2  ILE  57          HG22      ILE  57   7.203   5.334 -23.743
  432   3HG2  ILE  57          HG23      ILE  57   7.254   6.898 -24.528
  433   1HD1  ILE  57          HD11      ILE  57   6.521   2.835 -25.341
  434   2HD1  ILE  57          HD12      ILE  57   6.419   3.303 -23.630
  435   3HD1  ILE  57          HD13      ILE  57   5.198   2.238 -24.336
  436    H    ASP  58           H        ASP  58   5.568   8.673 -24.546
  437    HA   ASP  58           HA       ASP  58   6.709  10.173 -26.841
  438   1HB   ASP  58          HB2       ASP  58   4.222  10.635 -26.592
  439   2HB   ASP  58          HB3       ASP  58   4.605  11.470 -25.089
  440    H    ILE  59           H        ILE  59   8.614   9.555 -25.708
  441    HA   ILE  59           HA       ILE  59   9.242  10.356 -23.073
  442    HB   ILE  59           HB       ILE  59  11.632  10.039 -23.843
  443   1HG1  ILE  59          HG12      ILE  59  10.370   9.091 -26.449
  444   2HG1  ILE  59          HG13      ILE  59  11.227  10.617 -26.271
  445   1HG2  ILE  59          HG21      ILE  59   9.602   7.809 -24.372
  446   2HG2  ILE  59          HG22      ILE  59  11.306   7.591 -23.926
  447   3HG2  ILE  59          HG23      ILE  59  10.186   8.319 -22.782
  448   1HD1  ILE  59          HD11      ILE  59  13.293   9.418 -25.651
  449   2HD1  ILE  59          HD12      ILE  59  12.459   7.859 -25.801
  450   3HD1  ILE  59          HD13      ILE  59  12.681   8.894 -27.215
  451    H    SER  60           H        SER  60   8.871  12.449 -25.827
  452    HA   SER  60           HA       SER  60  10.604  14.553 -25.155
  453   1HB   SER  60          HB2       SER  60   7.801  15.153 -26.036
  454   2HB   SER  60          HB3       SER  60   9.335  15.835 -26.593
  455    HG   SER  60           HG       SER  60   7.940  13.533 -27.298
  456    H    ASN  61           H        ASN  61   7.726  13.393 -23.517
  457    HA   ASN  61           HA       ASN  61   7.018  15.629 -21.997
  458   1HB   ASN  61          HB2       ASN  61   5.771  14.195 -20.667
  459   2HB   ASN  61          HB3       ASN  61   5.866  13.280 -22.164
  460   1HD2  ASN  61          HD22      ASN  61   7.458  11.449 -22.216
  461   2HD2  ASN  61          HD21      ASN  61   8.224  10.845 -20.746
  462    H    GLN  62           H        GLN  62  10.004  13.757 -21.666
  463    HA   GLN  62           HA       GLN  62  10.219  14.730 -18.836
  464   1HB   GLN  62          HB2       GLN  62  11.470  12.813 -18.311
  465   2HB   GLN  62          HB3       GLN  62  10.001  12.318 -19.118
  466   1HG   GLN  62          HG2       GLN  62  12.004  12.558 -21.171
  467   2HG   GLN  62          HG3       GLN  62  12.811  11.855 -19.801
  468   1HE2  GLN  62          HE22      GLN  62  13.039  10.193 -21.544
  469   2HE2  GLN  62          HE21      GLN  62  11.887   8.862 -21.517
  470    H    THR  63           H        THR  63  11.785  14.965 -21.945
  471    HA   THR  63           HA       THR  63  13.806  15.657 -22.636
  472    HB   THR  63           HB       THR  63  14.685  17.767 -21.644
  473    HG1  THR  63           HG1      THR  63  13.102  17.036 -19.601
  474   1HG2  THR  63          HG21      THR  63  11.688  17.758 -22.197
  475   2HG2  THR  63          HG22      THR  63  12.790  19.147 -22.315
  476   3HG2  THR  63          HG23      THR  63  12.974  17.779 -23.422
  477    H    SER  64           H        SER  64  16.221  16.549 -21.260
  478    HA   SER  64           HA       SER  64  16.972  13.976 -20.000
  479   1HB   SER  64          HB2       SER  64  18.470  15.612 -22.083
  480   2HB   SER  64          HB3       SER  64  18.969  14.062 -21.403
  481    HG   SER  64           HG       SER  64  17.933  13.231 -22.950
  482    H    ASP  65           H        ASP  65  18.909  14.020 -18.710
  483    HA   ASP  65           HA       ASP  65  20.135  16.561 -17.994
  484   1HB   ASP  65          HB2       ASP  65  18.041  16.490 -16.575
  485   2HB   ASP  65          HB3       ASP  65  18.622  14.981 -15.868
  486    H    ILE  66           H        ILE  66  21.970  16.194 -16.542
  487    HA   ILE  66           HA       ILE  66  23.331  13.635 -16.998
  488    HB   ILE  66           HB       ILE  66  25.011  14.895 -15.355
  489   1HG1  ILE  66          HG12      ILE  66  23.406  16.920 -15.117
  490   2HG1  ILE  66          HG13      ILE  66  25.126  17.162 -15.336
  491   1HG2  ILE  66          HG21      ILE  66  24.691  15.440 -18.303
  492   2HG2  ILE  66          HG22      ILE  66  26.176  15.718 -17.352
  493   3HG2  ILE  66          HG23      ILE  66  25.534  14.079 -17.527
  494   1HD1  ILE  66          HD11      ILE  66  24.853  17.776 -17.685
  495   2HD1  ILE  66          HD12      ILE  66  23.116  17.434 -17.616
  496   3HD1  ILE  66          HD13      ILE  66  23.798  18.765 -16.664
  497    H    ILE  67           H        ILE  67  24.347  12.589 -15.110
  498    HA   ILE  67           HA       ILE  67  22.402  11.548 -13.399
  499    HB   ILE  67           HB       ILE  67  25.432  11.434 -13.479
  500   1HG1  ILE  67          HG12      ILE  67  23.283   9.325 -13.962
  501   2HG1  ILE  67          HG13      ILE  67  23.918  10.343 -15.246
  502   1HG2  ILE  67          HG21      ILE  67  23.626   9.857 -11.598
  503   2HG2  ILE  67          HG22      ILE  67  25.361   9.561 -11.865
  504   3HG2  ILE  67          HG23      ILE  67  24.845  11.056 -11.106
  505   1HD1  ILE  67          HD11      ILE  67  25.007   8.249 -15.376
  506   2HD1  ILE  67          HD12      ILE  67  26.202   9.441 -14.824
  507   3HD1  ILE  67          HD13      ILE  67  25.488   8.278 -13.675
  508    H    ASP  68           H        ASP  68  21.993  11.739 -11.231
  509    HA   ASP  68           HA       ASP  68  23.345  13.864  -9.673
  510   1HB   ASP  68          HB2       ASP  68  21.214  14.776 -10.730
  511   2HB   ASP  68          HB3       ASP  68  20.317  13.617  -9.743
  512    H    SER  69           H        SER  69  23.690  13.292  -7.592
  513    HA   SER  69           HA       SER  69  23.607  10.693  -6.690
  514   1HB   SER  69          HB2       SER  69  23.568  13.186  -4.971
  515   2HB   SER  69          HB3       SER  69  24.296  11.615  -4.587
  516    HG   SER  69           HG       SER  69  25.843  13.154  -5.320
  517    H    ASP  70           H        ASP  70  21.036  13.089  -6.567
  518    HA   ASP  70           HA       ASP  70  19.611  12.021  -4.321
  519   1HB   ASP  70          HB2       ASP  70  19.464  14.371  -5.117
  520   2HB   ASP  70          HB3       ASP  70  18.653  13.808  -6.584
  521    H    ILE  71           H        ILE  71  19.989  10.825  -7.470
  522    HA   ILE  71           HA       ILE  71  17.548   9.135  -7.205
  523    HB   ILE  71           HB       ILE  71  19.003   9.899  -9.744
  524   1HG1  ILE  71          HG12      ILE  71  16.156  10.783  -9.221
  525   2HG1  ILE  71          HG13      ILE  71  17.440  11.736  -8.498
  526   1HG2  ILE  71          HG21      ILE  71  17.935   7.686  -9.780
  527   2HG2  ILE  71          HG22      ILE  71  16.395   8.376  -9.239
  528   3HG2  ILE  71          HG23      ILE  71  17.054   8.797 -10.836
  529   1HD1  ILE  71          HD11      ILE  71  17.281  11.115 -11.461
  530   2HD1  ILE  71          HD12      ILE  71  16.831  12.643 -10.672
  531   3HD1  ILE  71          HD13      ILE  71  18.519  12.098 -10.630
  532    H    LEU  72           H        LEU  72  21.025   9.288  -8.184
  533    HA   LEU  72           HA       LEU  72  21.615   6.620  -8.580
  534   1HB   LEU  72          HB2       LEU  72  23.197   8.668  -6.977
  535   2HB   LEU  72          HB3       LEU  72  23.813   7.072  -7.306
  536    HG   LEU  72           HG       LEU  72  23.154   9.110  -9.435
  537   1HD1  LEU  72          HD11      LEU  72  25.686   9.192  -9.609
  538   2HD1  LEU  72          HD12      LEU  72  25.044   9.818  -8.088
  539   3HD1  LEU  72          HD13      LEU  72  25.771   8.204  -8.147
  540   1HD2  LEU  72          HD21      LEU  72  24.468   6.347  -9.563
  541   2HD2  LEU  72          HD22      LEU  72  22.940   6.818 -10.323
  542   3HD2  LEU  72          HD23      LEU  72  24.456   7.505 -10.904
  543    H    ASN  73           H        ASN  73  21.786   8.167  -5.379
  544    HA   ASN  73           HA       ASN  73  22.109   5.585  -4.108
  545   1HB   ASN  73          HB2       ASN  73  22.957   6.677  -2.327
  546   2HB   ASN  73          HB3       ASN  73  23.197   7.961  -3.496
  547   1HD2  ASN  73          HD22      ASN  73  21.171   9.603  -3.600
  548   2HD2  ASN  73          HD21      ASN  73  20.462   9.975  -2.048
  549    H    ASN  74           H        ASN  74  19.383   6.918  -5.200
  550    HA   ASN  74           HA       ASN  74  17.673   6.378  -2.800
  551   1HB   ASN  74          HB2       ASN  74  17.919   8.741  -3.501
  552   2HB   ASN  74          HB3       ASN  74  17.447   8.295  -5.136
  553   1HD2  ASN  74          HD22      ASN  74  15.888  10.000  -4.894
  554   2HD2  ASN  74          HD21      ASN  74  14.340   9.664  -4.127
  555    H    ALA  75           H        ALA  75  18.127   5.861  -6.271
  556    HA   ALA  75           HA       ALA  75  15.690   4.601  -6.929
  557   1HB   ALA  75          HB1       ALA  75  16.876   3.778  -8.842
  558   2HB   ALA  75          HB2       ALA  75  17.272   5.474  -8.566
  559   3HB   ALA  75          HB3       ALA  75  18.441   4.213  -8.104
  560    H    ASP  76           H        ASP  76  14.905   2.632  -6.503
  561    HA   ASP  76           HA       ASP  76  16.146   0.826  -4.653
  562   1HB   ASP  76          HB2       ASP  76  13.705   0.841  -5.017
  563   2HB   ASP  76          HB3       ASP  76  13.938   0.328  -6.693
  564    H    LEU  77           H        LEU  77  16.234   1.275  -8.137
  565    HA   LEU  77           HA       LEU  77  18.389  -0.736  -8.383
  566   1HB   LEU  77          HB2       LEU  77  16.342  -1.993  -8.955
  567   2HB   LEU  77          HB3       LEU  77  15.824  -0.702 -10.036
  568    HG   LEU  77           HG       LEU  77  17.766  -1.150 -11.528
  569   1HD1  LEU  77          HD11      LEU  77  19.106  -3.166 -11.274
  570   2HD1  LEU  77          HD12      LEU  77  19.329  -2.166  -9.850
  571   3HD1  LEU  77          HD13      LEU  77  18.268  -3.592  -9.768
  572   1HD2  LEU  77          HD21      LEU  77  16.936  -3.270 -12.443
  573   2HD2  LEU  77          HD22      LEU  77  16.055  -3.588 -10.931
  574   3HD2  LEU  77          HD23      LEU  77  15.605  -2.213 -11.963
  575    H    VAL  78           H        VAL  78  19.935  -0.083  -9.813
  576    HA   VAL  78           HA       VAL  78  19.310   2.184 -11.649
  577    HB   VAL  78           HB       VAL  78  21.986   1.441 -10.386
  578   1HG1  VAL  78          HG11      VAL  78  22.324   2.447 -12.585
  579   2HG1  VAL  78          HG12      VAL  78  21.160   3.742 -12.222
  580   3HG1  VAL  78          HG13      VAL  78  22.701   3.652 -11.350
  581   1HG2  VAL  78          HG21      VAL  78  21.762   3.625  -9.176
  582   2HG2  VAL  78          HG22      VAL  78  20.107   3.781  -9.803
  583   3HG2  VAL  78          HG23      VAL  78  20.534   2.466  -8.693
  584    H    VAL  79           H        VAL  79  19.925   1.817 -13.838
  585    HA   VAL  79           HA       VAL  79  20.890  -0.924 -14.506
  586    HB   VAL  79           HB       VAL  79  18.696   0.624 -15.941
  587   1HG1  VAL  79          HG11      VAL  79  19.520  -2.316 -16.088
  588   2HG1  VAL  79          HG12      VAL  79  18.254  -1.529 -17.049
  589   3HG1  VAL  79          HG13      VAL  79  19.947  -1.083 -17.284
  590   1HG2  VAL  79          HG21      VAL  79  18.338  -1.577 -13.876
  591   2HG2  VAL  79          HG22      VAL  79  17.719   0.087 -13.801
  592   3HG2  VAL  79          HG23      VAL  79  17.077  -1.032 -15.000
  593    H    THR  80           H        THR  80  22.744  -0.722 -15.700
  594    HA   THR  80           HA       THR  80  23.148   1.805 -17.241
  595    HB   THR  80           HB       THR  80  25.507   0.732 -17.528
  596    HG1  THR  80           HG1      THR  80  24.805  -1.251 -16.392
  597   1HG2  THR  80          HG21      THR  80  25.034   2.806 -16.330
  598   2HG2  THR  80          HG22      THR  80  24.576   1.890 -14.872
  599   3HG2  THR  80          HG23      THR  80  26.252   1.864 -15.473
  600    H    LEU  81           H        LEU  81  23.116   1.796 -19.393
  601    HA   LEU  81           HA       LEU  81  22.393  -0.772 -20.732
  602   1HB   LEU  81          HB2       LEU  81  21.621   2.100 -21.363
  603   2HB   LEU  81          HB3       LEU  81  21.299   0.730 -22.410
  604    HG   LEU  81           HG       LEU  81  19.912  -0.327 -20.620
  605   1HD1  LEU  81          HD11      LEU  81  20.285   2.374 -19.234
  606   2HD1  LEU  81          HD12      LEU  81  18.973   1.237 -18.859
  607   3HD1  LEU  81          HD13      LEU  81  20.626   0.762 -18.565
  608   1HD2  LEU  81          HD21      LEU  81  17.974   1.165 -20.910
  609   2HD2  LEU  81          HD22      LEU  81  19.035   2.459 -21.485
  610   3HD2  LEU  81          HD23      LEU  81  18.840   0.955 -22.422
  611    H    CYS  82           H        CYS  82  25.174   0.354 -20.224
  612    HA   CYS  82           HA       CYS  82  26.244   1.223 -22.748
  613   1HB   CYS  82          HB2       CYS  82  28.415   0.846 -21.590
  614   2HB   CYS  82          HB3       CYS  82  27.340   1.995 -20.807
  615    H    GLY  83           H        GLY  83  26.425  -0.143 -24.468
  616   1HA   GLY  83          HA1       GLY  83  28.036  -2.525 -24.214
  617   2HA   GLY  83          HA2       GLY  83  26.376  -2.888 -24.698
  618    H    ASP  84           H        ASP  84  27.758   0.169 -25.527
  619    HA   ASP  84           HA       ASP  84  27.747  -0.249 -28.429
  620   1HB   ASP  84          HB2       ASP  84  27.786   2.242 -28.375
  621   2HB   ASP  84          HB3       ASP  84  26.480   1.619 -27.364
  622    H    ALA  85           H        ALA  85  29.591   1.435 -29.369
  623    HA   ALA  85           HA       ALA  85  32.016  -0.033 -28.859
  624   1HB   ALA  85          HB1       ALA  85  32.986   1.375 -30.605
  625   2HB   ALA  85          HB2       ALA  85  31.392   0.782 -31.103
  626   3HB   ALA  85          HB3       ALA  85  31.592   2.467 -30.538
  627    H    ALA  86           H        ALA  86  30.768   2.927 -27.414
  628    HA   ALA  86           HA       ALA  86  33.474   3.884 -26.685
  629   1HB   ALA  86          HB1       ALA  86  31.723   5.503 -27.444
  630   2HB   ALA  86          HB2       ALA  86  30.745   5.071 -26.026
  631   3HB   ALA  86          HB3       ALA  86  32.334   5.826 -25.806
  632    H    ASP  87           H        ASP  87  30.472   2.644 -25.266
  633    HA   ASP  87           HA       ASP  87  29.962   1.605 -23.320
  634   1HB   ASP  87          HB2       ASP  87  31.099  -0.065 -24.634
  635   2HB   ASP  87          HB3       ASP  87  32.652   0.326 -23.890
  636    H    LYS  88           H        LYS  88  30.943   4.145 -22.720
  637    HA   LYS  88           HA       LYS  88  33.034   4.103 -20.813
  638   1HB   LYS  88          HB2       LYS  88  30.881   6.227 -21.127
  639   2HB   LYS  88          HB3       LYS  88  32.427   6.401 -20.299
  640   1HG   LYS  88          HG2       LYS  88  33.620   5.974 -22.459
  641   2HG   LYS  88          HG3       LYS  88  32.062   5.850 -23.276
  642   1HD   LYS  88          HD2       LYS  88  32.914   8.052 -23.686
  643   2HD   LYS  88          HD3       LYS  88  31.509   8.173 -22.637
  644   1HE   LYS  88          HE2       LYS  88  33.159   9.729 -21.856
  645   2HE   LYS  88          HE3       LYS  88  33.022   8.446 -20.656
  646   1HZ   LYS  88          HZ1       LYS  88  35.072   7.485 -21.568
  647   2HZ   LYS  88          HZ2       LYS  88  35.171   8.669 -22.693
  648   3HZ   LYS  88          HZ3       LYS  88  35.326   9.027 -21.115
  649    H    CYS  89           H        CYS  89  29.863   3.031 -20.393
  650    HA   CYS  89           HA       CYS  89  28.439   2.688 -18.656
  651   1HB   CYS  89          HB2       CYS  89  31.013   1.481 -17.667
  652   2HB   CYS  89          HB3       CYS  89  29.428   1.165 -16.979
  653    HA   PRO  90           HA       PRO  90  29.132   6.511 -16.276
  654   1HB   PRO  90          HB2       PRO  90  26.245   5.926 -15.679
  655   2HB   PRO  90          HB3       PRO  90  27.039   7.482 -16.097
  656   1HG   PRO  90          HG2       PRO  90  25.606   6.081 -17.947
  657   2HG   PRO  90          HG3       PRO  90  27.110   6.945 -18.392
  658   1HD   PRO  90          HD2       PRO  90  26.687   4.020 -17.923
  659   2HD   PRO  90          HD3       PRO  90  27.747   4.853 -19.103
  660    H    MET  91           H        MET  91  29.555   6.885 -14.146
  661    HA   MET  91           HA       MET  91  30.022   4.720 -12.414
  662   1HB   MET  91          HB2       MET  91  31.331   6.768 -12.436
  663   2HB   MET  91          HB3       MET  91  29.942   7.737 -11.942
  664   1HG   MET  91          HG2       MET  91  31.012   5.489 -10.208
  665   2HG   MET  91          HG3       MET  91  31.743   7.091 -10.206
  666   1HE   MET  91          HE1       MET  91  30.694   5.633  -7.600
  667   2HE   MET  91          HE2       MET  91  31.439   7.249  -7.576
  668   3HE   MET  91          HE3       MET  91  29.885   6.973  -6.757
  669    H    THR  92           H        THR  92  28.840   3.795 -10.837
  670    HA   THR  92           HA       THR  92  26.447   5.135  -9.747
  671    HB   THR  92           HB       THR  92  25.658   2.783  -9.384
  672    HG1  THR  92           HG1      THR  92  27.594   1.665  -9.479
  673   1HG2  THR  92          HG21      THR  92  25.034   4.137 -11.455
  674   2HG2  THR  92          HG22      THR  92  26.308   3.255 -12.319
  675   3HG2  THR  92          HG23      THR  92  24.917   2.377 -11.648
  676    HA   PRO  93           HA       PRO  93  28.657   4.525  -5.853
  677   1HB   PRO  93          HB2       PRO  93  26.611   4.262  -4.037
  678   2HB   PRO  93          HB3       PRO  93  27.060   5.822  -4.790
  679   1HG   PRO  93          HG2       PRO  93  24.846   3.926  -5.602
  680   2HG   PRO  93          HG3       PRO  93  24.761   5.702  -5.400
  681   1HD   PRO  93          HD2       PRO  93  25.095   4.510  -7.846
  682   2HD   PRO  93          HD3       PRO  93  25.870   6.074  -7.449
  683    HA   PRO  94           HA       PRO  94  28.755   0.100  -5.707
  684   1HB   PRO  94          HB2       PRO  94  29.977  -0.469  -3.330
  685   2HB   PRO  94          HB3       PRO  94  30.819   0.332  -4.691
  686   1HG   PRO  94          HG2       PRO  94  29.557   1.625  -2.261
  687   2HG   PRO  94          HG3       PRO  94  31.180   1.927  -2.957
  688   1HD   PRO  94          HD2       PRO  94  29.000   3.514  -3.500
  689   2HD   PRO  94          HD3       PRO  94  30.283   3.211  -4.717
  690    H    HIS  95           H        HIS  95  27.101   1.829  -3.120
  691    HA   HIS  95           HA       HIS  95  26.064  -0.466  -1.775
  692   1HB   HIS  95          HB2       HIS  95  25.082   2.414  -1.695
  693   2HB   HIS  95          HB3       HIS  95  24.793   1.168  -0.484
  694    HD1  HIS  95           HD1      HIS  95  26.953   4.044  -0.873
  695    HD2  HIS  95           HD2      HIS  95  27.425   0.067   0.434
  696    HE1  HIS  95           HE1      HIS  95  29.085   3.994   0.512
  697    H    VAL  96           H        VAL  96  24.899   1.294  -4.614
  698    HA   VAL  96           HA       VAL  96  22.135   0.509  -4.098
  699    HB   VAL  96           HB       VAL  96  22.820   2.701  -5.190
  700   1HG1  VAL  96          HG11      VAL  96  23.171   2.862  -7.518
  701   2HG1  VAL  96          HG12      VAL  96  24.389   1.736  -6.909
  702   3HG1  VAL  96          HG13      VAL  96  22.967   1.113  -7.766
  703   1HG2  VAL  96          HG21      VAL  96  20.719   1.059  -6.626
  704   2HG2  VAL  96          HG22      VAL  96  20.521   1.838  -5.038
  705   3HG2  VAL  96          HG23      VAL  96  20.809   2.824  -6.463
  706    H    LYS  97           H        LYS  97  20.963  -0.997  -5.241
  707    HA   LYS  97           HA       LYS  97  22.286  -3.326  -6.340
  708   1HB   LYS  97          HB2       LYS  97  20.103  -3.351  -5.120
  709   2HB   LYS  97          HB3       LYS  97  19.405  -2.342  -6.394
  710   1HG   LYS  97          HG2       LYS  97  19.710  -4.173  -8.029
  711   2HG   LYS  97          HG3       LYS  97  20.508  -5.156  -6.798
  712   1HD   LYS  97          HD2       LYS  97  18.160  -5.841  -7.105
  713   2HD   LYS  97          HD3       LYS  97  18.462  -5.240  -5.463
  714   1HE   LYS  97          HE2       LYS  97  17.493  -3.058  -6.060
  715   2HE   LYS  97          HE3       LYS  97  17.202  -3.602  -7.714
  716   1HZ   LYS  97          HZ1       LYS  97  15.252  -3.655  -6.261
  717   2HZ   LYS  97          HZ2       LYS  97  15.585  -5.160  -6.853
  718   3HZ   LYS  97          HZ3       LYS  97  15.950  -4.780  -5.301
  719    H    ARG  98           H        ARG  98  22.669  -3.707  -8.524
  720    HA   ARG  98           HA       ARG  98  21.838  -1.634 -10.458
  721   1HB   ARG  98          HB2       ARG  98  24.051  -1.020  -9.634
  722   2HB   ARG  98          HB3       ARG  98  24.680  -2.619 -10.057
  723   1HG   ARG  98          HG2       ARG  98  24.345  -2.182 -12.433
  724   2HG   ARG  98          HG3       ARG  98  23.534  -0.635 -12.083
  725   1HD   ARG  98          HD2       ARG  98  25.566   0.306 -11.220
  726   2HD   ARG  98          HD3       ARG  98  26.386  -1.262 -11.245
  727    HE   ARG  98           HE       ARG  98  25.483  -0.625 -13.886
  728   1HH1  ARG  98          HH21      ARG  98  27.861   0.738 -11.658
  729   2HH1  ARG  98          HH22      ARG  98  29.183   0.644 -12.772
  730   1HH2  ARG  98          HH11      ARG  98  27.095  -0.544 -15.403
  731   2HH2  ARG  98          HH12      ARG  98  28.734  -0.091 -15.007
  732    H    GLU  99           H        GLU  99  21.729  -2.298 -12.601
  733    HA   GLU  99           HA       GLU  99  22.120  -5.172 -13.278
  734   1HB   GLU  99          HB2       GLU  99  19.772  -3.309 -13.705
  735   2HB   GLU  99          HB3       GLU  99  20.154  -4.449 -14.980
  736   1HG   GLU  99          HG2       GLU  99  19.742  -5.350 -12.106
  737   2HG   GLU  99          HG3       GLU  99  18.414  -5.162 -13.250
  738    H    HIS 100           H        HIS 100  22.598  -5.435 -15.589
  739    HA   HIS 100           HA       HIS 100  23.681  -3.044 -16.967
  740   1HB   HIS 100          HB2       HIS 100  25.592  -3.969 -15.865
  741   2HB   HIS 100          HB3       HIS 100  25.133  -5.620 -16.291
  742    HD1  HIS 100           HD1      HIS 100  26.652  -2.474 -17.951
  743    HD2  HIS 100           HD2      HIS 100  25.869  -6.553 -18.647
  744    HE1  HIS 100           HE1      HIS 100  27.893  -3.089 -20.080
  745    H    TRP 101           H        TRP 101  22.545  -2.946 -18.755
  746    HA   TRP 101           HA       TRP 101  21.623  -5.416 -20.175
  747   1HB   TRP 101          HB2       TRP 101  20.195  -2.759 -19.739
  748   2HB   TRP 101          HB3       TRP 101  19.687  -3.982 -20.887
  749    HD1  TRP 101           HD1      TRP 101  20.592  -5.559 -17.592
  750    HE1  TRP 101           HE1      TRP 101  18.534  -6.159 -16.282
  751    HE3  TRP 101           HE3      TRP 101  17.139  -3.173 -20.521
  752    HZ2  TRP 101           HZ2      TRP 101  15.654  -5.662 -16.470
  753    HZ3  TRP 101           HZ3      TRP 101  14.724  -3.331 -19.976
  754    HH2  TRP 101           HH2      TRP 101  13.980  -4.539 -17.931
  755    H    GLY 102           H        GLY 102  23.998  -4.869 -21.019
  756   1HA   GLY 102          HA1       GLY 102  24.333  -2.467 -22.543
  757   2HA   GLY 102          HA2       GLY 102  25.397  -3.876 -22.531
  758    H    PHE 103           H        PHE 103  23.911  -2.019 -24.602
  759    HA   PHE 103           HA       PHE 103  24.101  -3.941 -26.714
  760   1HB   PHE 103          HB2       PHE 103  21.789  -2.980 -27.646
  761   2HB   PHE 103          HB3       PHE 103  21.895  -4.458 -26.719
  762    HD1  PHE 103           HD1      PHE 103  21.461  -0.760 -26.066
  763    HD2  PHE 103           HD2      PHE 103  20.330  -4.794 -25.032
  764    HE1  PHE 103           HE1      PHE 103  19.939   0.100 -24.307
  765    HE2  PHE 103           HE2      PHE 103  18.789  -3.919 -23.298
  766    HZ   PHE 103           HZ       PHE 103  18.653  -1.472 -22.879
  767    H    ASP 104           H        ASP 104  24.073  -2.692 -28.805
  768    HA   ASP 104           HA       ASP 104  25.737  -0.431 -28.458
  769   1HB   ASP 104          HB2       ASP 104  25.884  -2.054 -30.356
  770   2HB   ASP 104          HB3       ASP 104  24.391  -1.364 -31.006
  771    H    ASP 105           H        ASP 105  25.462   1.656 -29.183
  772    HA   ASP 105           HA       ASP 105  22.933   2.851 -28.364
  773   1HB   ASP 105          HB2       ASP 105  25.217   3.810 -27.903
  774   2HB   ASP 105          HB3       ASP 105  25.348   4.217 -29.597
  775    HA   PRO 106           HA       PRO 106  21.509   2.437 -32.611
  776   1HB   PRO 106          HB2       PRO 106  19.159   3.847 -32.455
  777   2HB   PRO 106          HB3       PRO 106  19.365   2.174 -31.878
  778   1HG   PRO 106          HG2       PRO 106  19.439   4.702 -30.228
  779   2HG   PRO 106          HG3       PRO 106  18.599   3.160 -29.869
  780   1HD   PRO 106          HD2       PRO 106  21.032   3.796 -28.818
  781   2HD   PRO 106          HD3       PRO 106  20.644   2.112 -29.280
  782    H    ALA 107           H        ALA 107  21.995   5.546 -30.973
  783    HA   ALA 107           HA       ALA 107  21.869   7.125 -33.393
  784   1HB   ALA 107          HB1       ALA 107  21.438   8.067 -31.120
  785   2HB   ALA 107          HB2       ALA 107  23.145   7.785 -30.707
  786   3HB   ALA 107          HB3       ALA 107  22.722   8.929 -31.992
  787    H    ARG 108           H        ARG 108  24.098   4.789 -32.395
  788    HA   ARG 108           HA       ARG 108  26.439   6.142 -33.650
  789   1HB   ARG 108          HB2       ARG 108  26.386   5.641 -31.104
  790   2HB   ARG 108          HB3       ARG 108  26.395   3.941 -31.567
  791   1HG   ARG 108          HG2       ARG 108  28.594   4.888 -32.952
  792   2HG   ARG 108          HG3       ARG 108  28.565   5.985 -31.581
  793   1HD   ARG 108          HD2       ARG 108  29.963   4.089 -30.990
  794   2HD   ARG 108          HD3       ARG 108  28.489   3.991 -30.034
  795    HE   ARG 108           HE       ARG 108  27.834   2.057 -31.153
  796   1HH1  ARG 108          HH21      ARG 108  30.653   3.410 -32.870
  797   2HH1  ARG 108          HH22      ARG 108  30.757   2.098 -33.981
  798   1HH2  ARG 108          HH11      ARG 108  27.827   0.488 -32.736
  799   2HH2  ARG 108          HH12      ARG 108  29.132   0.353 -33.879
  800    H    ALA 109           H        ALA 109  24.055   3.896 -34.212
  801    HA   ALA 109           HA       ALA 109  25.384   1.604 -35.174
  802   1HB   ALA 109          HB1       ALA 109  23.264   1.188 -36.377
  803   2HB   ALA 109          HB2       ALA 109  22.994   1.665 -34.683
  804   3HB   ALA 109          HB3       ALA 109  22.719   2.827 -35.997
  805    H    GLN 110           H        GLN 110  27.164   2.199 -36.336
  806    HA   GLN 110           HA       GLN 110  27.407   4.061 -38.375
  807   1HB   GLN 110          HB2       GLN 110  28.834   1.367 -38.202
  808   2HB   GLN 110          HB3       GLN 110  29.366   2.757 -39.143
  809   1HG   GLN 110          HG2       GLN 110  29.178   2.610 -36.102
  810   2HG   GLN 110          HG3       GLN 110  30.644   2.520 -37.060
  811   1HE2  GLN 110          HE22      GLN 110  28.506   4.643 -35.431
  812   2HE2  GLN 110          HE21      GLN 110  29.200   6.153 -36.002
  813    H    GLY 111           H        GLY 111  26.530   4.260 -40.333
  814   1HA   GLY 111          HA1       GLY 111  26.638   2.448 -42.397
  815   2HA   GLY 111          HA2       GLY 111  25.034   2.179 -41.690
  816    H    THR 112           H        THR 112  23.679   4.176 -41.315
  817    HA   THR 112           HA       THR 112  24.182   6.634 -42.600
  818    HB   THR 112           HB       THR 112  23.874   5.310 -44.682
  819    HG1  THR 112           HG1      THR 112  23.126   7.286 -44.963
  820   1HG2  THR 112          HG21      THR 112  21.111   4.602 -43.634
  821   2HG2  THR 112          HG22      THR 112  21.738   4.275 -45.258
  822   3HG2  THR 112          HG23      THR 112  22.460   3.468 -43.861
  823    H    GLU 113           H        GLU 113  22.008   7.935 -42.567
  824    HA   GLU 113           HA       GLU 113  21.051   7.777 -39.894
  825   1HB   GLU 113          HB2       GLU 113  19.544   9.580 -40.497
  826   2HB   GLU 113          HB3       GLU 113  21.174   9.878 -41.101
  827   1HG   GLU 113          HG2       GLU 113  20.446   9.126 -43.380
  828   2HG   GLU 113          HG3       GLU 113  18.810   8.891 -42.762
  829    H    GLU 114           H        GLU 114  19.803   6.403 -42.908
  830    HA   GLU 114           HA       GLU 114  17.256   5.661 -41.843
  831   1HB   GLU 114          HB2       GLU 114  17.800   5.828 -44.271
  832   2HB   GLU 114          HB3       GLU 114  18.811   4.381 -44.126
  833   1HG   GLU 114          HG2       GLU 114  16.848   3.050 -43.458
  834   2HG   GLU 114          HG3       GLU 114  15.834   4.496 -43.474
  835    H    GLU 115           H        GLU 115  20.463   4.105 -41.850
  836    HA   GLU 115           HA       GLU 115  19.465   1.616 -40.766
  837   1HB   GLU 115          HB2       GLU 115  21.462   1.494 -42.072
  838   2HB   GLU 115          HB3       GLU 115  22.250   2.747 -41.120
  839   1HG   GLU 115          HG2       GLU 115  23.132   0.515 -40.628
  840   2HG   GLU 115          HG3       GLU 115  22.477   1.319 -39.213
  841    H    LYS 116           H        LYS 116  20.937   4.635 -39.439
  842    HA   LYS 116           HA       LYS 116  20.916   3.812 -36.718
  843   1HB   LYS 116          HB2       LYS 116  20.642   6.546 -38.028
  844   2HB   LYS 116          HB3       LYS 116  20.674   6.311 -36.269
  845   1HG   LYS 116          HG2       LYS 116  22.872   5.145 -36.497
  846   2HG   LYS 116          HG3       LYS 116  22.866   5.518 -38.232
  847   1HD   LYS 116          HD2       LYS 116  22.786   7.952 -37.681
  848   2HD   LYS 116          HD3       LYS 116  22.800   7.536 -35.951
  849   1HE   LYS 116          HE2       LYS 116  24.974   6.237 -36.450
  850   2HE   LYS 116          HE3       LYS 116  24.978   7.038 -38.025
  851   1HZ   LYS 116          HZ1       LYS 116  24.990   9.180 -36.799
  852   2HZ   LYS 116          HZ2       LYS 116  25.070   8.366 -35.371
  853   3HZ   LYS 116          HZ3       LYS 116  26.303   8.282 -36.446
  854    H    TRP 117           H        TRP 117  18.327   5.434 -38.644
  855    HA   TRP 117           HA       TRP 117  16.386   5.451 -36.596
  856   1HB   TRP 117          HB2       TRP 117  16.056   6.746 -38.563
  857   2HB   TRP 117          HB3       TRP 117  16.269   5.358 -39.617
  858    HD1  TRP 117           HD1      TRP 117  14.129   4.994 -40.839
  859    HE1  TRP 117           HE1      TRP 117  11.665   4.741 -40.276
  860    HE3  TRP 117           HE3      TRP 117  14.348   6.068 -35.833
  861    HZ2  TRP 117           HZ2      TRP 117   9.970   4.935 -37.911
  862    HZ3  TRP 117           HZ3      TRP 117  12.331   5.933 -34.447
  863    HH2  TRP 117           HH2      TRP 117  10.124   5.349 -35.460
  864    H    ALA 118           H        ALA 118  17.236   2.837 -38.931
  865    HA   ALA 118           HA       ALA 118  15.156   1.104 -38.051
  866   1HB   ALA 118          HB1       ALA 118  17.775   0.421 -39.424
  867   2HB   ALA 118          HB2       ALA 118  16.319  -0.602 -39.317
  868   3HB   ALA 118          HB3       ALA 118  16.266   0.913 -40.234
  869    H    PHE 119           H        PHE 119  18.551   1.518 -37.012
  870    HA   PHE 119           HA       PHE 119  18.538  -0.637 -35.163
  871   1HB   PHE 119          HB2       PHE 119  20.483   0.935 -36.138
  872   2HB   PHE 119          HB3       PHE 119  20.232   1.784 -34.629
  873    HD1  PHE 119           HD1      PHE 119  21.861  -0.942 -36.282
  874    HD2  PHE 119           HD2      PHE 119  20.370   0.292 -32.437
  875    HE1  PHE 119           HE1      PHE 119  23.282  -2.647 -35.184
  876    HE2  PHE 119           HE2      PHE 119  21.815  -1.390 -31.335
  877    HZ   PHE 119           HZ       PHE 119  23.261  -2.880 -32.707
  878    H    PHE 120           H        PHE 120  17.536   2.764 -34.878
  879    HA   PHE 120           HA       PHE 120  17.074   2.815 -32.082
  880   1HB   PHE 120          HB2       PHE 120  16.206   4.429 -34.440
  881   2HB   PHE 120          HB3       PHE 120  15.087   4.448 -33.099
  882    HD1  PHE 120           HD1      PHE 120  15.973   4.975 -30.750
  883    HD2  PHE 120           HD2      PHE 120  18.143   5.875 -34.365
  884    HE1  PHE 120           HE1      PHE 120  17.312   6.661 -29.533
  885    HE2  PHE 120           HE2      PHE 120  19.434   7.611 -33.155
  886    HZ   PHE 120           HZ       PHE 120  18.977   8.058 -30.759
  887    H    GLN 121           H        GLN 121  14.695   1.987 -34.682
  888    HA   GLN 121           HA       GLN 121  12.729   1.297 -32.718
  889   1HB   GLN 121          HB2       GLN 121  11.451   0.309 -34.564
  890   2HB   GLN 121          HB3       GLN 121  12.014   1.953 -34.855
  891   1HG   GLN 121          HG2       GLN 121  13.982   0.802 -36.120
  892   2HG   GLN 121          HG3       GLN 121  12.937  -0.619 -36.166
  893   1HE2  GLN 121          HE22      GLN 121  13.384   2.793 -37.099
  894   2HE2  GLN 121          HE21      GLN 121  12.190   2.825 -38.369
  895    H    ARG 122           H        ARG 122  15.339  -0.680 -34.181
  896    HA   ARG 122           HA       ARG 122  14.426  -3.176 -33.073
  897   1HB   ARG 122          HB2       ARG 122  17.247  -2.169 -33.638
  898   2HB   ARG 122          HB3       ARG 122  16.874  -3.816 -33.151
  899   1HG   ARG 122          HG2       ARG 122  15.687  -4.270 -35.209
  900   2HG   ARG 122          HG3       ARG 122  15.740  -2.578 -35.683
  901   1HD   ARG 122          HD2       ARG 122  18.389  -2.968 -35.343
  902   2HD   ARG 122          HD3       ARG 122  17.941  -4.636 -35.689
  903    HE   ARG 122           HE       ARG 122  16.781  -3.523 -37.771
  904   1HH1  ARG 122          HH21      ARG 122  19.971  -2.675 -36.426
  905   2HH1  ARG 122          HH22      ARG 122  20.536  -1.945 -37.909
  906   1HH2  ARG 122          HH11      ARG 122  17.661  -2.642 -39.769
  907   2HH2  ARG 122          HH12      ARG 122  19.216  -1.857 -39.750
  908    H    VAL 123           H        VAL 123  16.754  -0.705 -31.723
  909    HA   VAL 123           HA       VAL 123  17.085  -2.168 -29.290
  910    HB   VAL 123           HB       VAL 123  17.651   0.705 -30.107
  911   1HG1  VAL 123          HG11      VAL 123  19.089   0.876 -28.082
  912   2HG1  VAL 123          HG12      VAL 123  17.374   0.790 -27.683
  913   3HG1  VAL 123          HG13      VAL 123  18.402  -0.645 -27.475
  914   1HG2  VAL 123          HG21      VAL 123  19.487  -1.671 -29.515
  915   2HG2  VAL 123          HG22      VAL 123  19.017  -1.139 -31.138
  916   3HG2  VAL 123          HG23      VAL 123  19.985  -0.076 -30.102
  917    H    ARG 124           H        ARG 124  14.748   0.386 -30.266
  918    HA   ARG 124           HA       ARG 124  13.536   0.857 -27.763
  919   1HB   ARG 124          HB2       ARG 124  13.051   2.172 -29.777
  920   2HB   ARG 124          HB3       ARG 124  12.495   0.744 -30.614
  921   1HG   ARG 124          HG2       ARG 124  10.745   0.797 -28.464
  922   2HG   ARG 124          HG3       ARG 124  11.067   2.505 -28.712
  923   1HD   ARG 124          HD2       ARG 124   9.108   1.832 -29.998
  924   2HD   ARG 124          HD3       ARG 124  10.439   2.266 -31.077
  925    HE   ARG 124           HE       ARG 124  10.267  -0.594 -30.524
  926   1HH1  ARG 124          HH21      ARG 124   9.020   2.038 -32.502
  927   2HH1  ARG 124          HH22      ARG 124   8.860   1.105 -33.962
  928   1HH2  ARG 124          HH11      ARG 124   9.996  -1.911 -32.459
  929   2HH2  ARG 124          HH12      ARG 124   9.261  -1.218 -33.856
  930    H    ASP 125           H        ASP 125  12.728  -1.619 -30.292
  931    HA   ASP 125           HA       ASP 125  10.567  -2.692 -28.798
  932   1HB   ASP 125          HB2       ASP 125  10.783  -3.068 -31.198
  933   2HB   ASP 125          HB3       ASP 125  12.309  -3.928 -30.975
  934    H    GLU 126           H        GLU 126  14.037  -3.709 -29.007
  935    HA   GLU 126           HA       GLU 126  13.710  -5.999 -27.351
  936   1HB   GLU 126          HB2       GLU 126  16.135  -4.293 -28.004
  937   2HB   GLU 126          HB3       GLU 126  16.201  -5.775 -27.031
  938   1HG   GLU 126          HG2       GLU 126  15.223  -7.070 -28.898
  939   2HG   GLU 126          HG3       GLU 126  15.190  -5.625 -29.903
  940    H    ILE 127           H        ILE 127  14.538  -2.590 -26.524
  941    HA   ILE 127           HA       ILE 127  14.914  -3.016 -23.725
  942    HB   ILE 127           HB       ILE 127  14.104  -0.624 -25.416
  943   1HG1  ILE 127          HG12      ILE 127  16.565  -1.220 -23.712
  944   2HG1  ILE 127          HG13      ILE 127  16.488  -1.489 -25.446
  945   1HG2  ILE 127          HG21      ILE 127  14.273   0.832 -23.495
  946   2HG2  ILE 127          HG22      ILE 127  12.997  -0.328 -23.193
  947   3HG2  ILE 127          HG23      ILE 127  14.573  -0.547 -22.405
  948   1HD1  ILE 127          HD11      ILE 127  17.625   0.581 -25.143
  949   2HD1  ILE 127          HD12      ILE 127  15.997   1.005 -25.711
  950   3HD1  ILE 127          HD13      ILE 127  16.428   1.183 -23.994
  951    H    GLY 128           H        GLY 128  11.956  -2.082 -25.604
  952   1HA   GLY 128          HA1       GLY 128  10.105  -2.075 -23.540
  953   2HA   GLY 128          HA2       GLY 128   9.756  -2.581 -25.206
  954    H    ASN 129           H        ASN 129  11.204  -4.932 -25.447
  955    HA   ASN 129           HA       ASN 129   9.551  -6.823 -24.136
  956   1HB   ASN 129          HB2       ASN 129  12.192  -7.101 -25.615
  957   2HB   ASN 129          HB3       ASN 129  11.489  -8.468 -24.770
  958   1HD2  ASN 129          HD22      ASN 129  10.962  -6.200 -27.460
  959   2HD2  ASN 129          HD21      ASN 129   9.793  -7.202 -28.281
  960    H    ARG 130           H        ARG 130  12.931  -5.838 -23.342
  961    HA   ARG 130           HA       ARG 130  12.924  -7.716 -21.143
  962   1HB   ARG 130          HB2       ARG 130  14.835  -5.560 -22.066
  963   2HB   ARG 130          HB3       ARG 130  15.005  -6.197 -20.429
  964   1HG   ARG 130          HG2       ARG 130  14.914  -7.980 -22.879
  965   2HG   ARG 130          HG3       ARG 130  16.408  -7.380 -22.159
  966   1HD   ARG 130          HD2       ARG 130  14.352  -9.039 -20.593
  967   2HD   ARG 130          HD3       ARG 130  15.707  -9.716 -21.469
  968    HE   ARG 130           HE       ARG 130  17.252  -8.723 -20.013
  969   1HH1  ARG 130          HH21      ARG 130  13.969  -7.898 -18.806
  970   2HH1  ARG 130          HH22      ARG 130  14.428  -8.154 -17.147
  971   1HH2  ARG 130          HH11      ARG 130  17.798  -8.859 -17.795
  972   2HH2  ARG 130          HH12      ARG 130  16.573  -8.709 -16.574
  973    H    LEU 131           H        LEU 131  11.944  -4.317 -21.392
  974    HA   LEU 131           HA       LEU 131  11.798  -3.951 -18.552
  975   1HB   LEU 131          HB2       LEU 131  11.462  -2.282 -20.765
  976   2HB   LEU 131          HB3       LEU 131   9.837  -2.441 -20.146
  977    HG   LEU 131           HG       LEU 131  10.841  -0.542 -19.149
  978   1HD1  LEU 131          HD11      LEU 131  10.901  -2.701 -17.022
  979   2HD1  LEU 131          HD12      LEU 131  10.732  -0.970 -16.747
  980   3HD1  LEU 131          HD13      LEU 131   9.451  -1.867 -17.589
  981   1HD2  LEU 131          HD21      LEU 131  13.209  -1.170 -19.555
  982   2HD2  LEU 131          HD22      LEU 131  12.924  -0.492 -17.955
  983   3HD2  LEU 131          HD23      LEU 131  13.148  -2.236 -18.132
  984    H    LYS 132           H        LYS 132   9.467  -5.137 -21.036
  985    HA   LYS 132           HA       LYS 132   7.283  -5.546 -19.298
  986   1HB   LYS 132          HB2       LYS 132   7.061  -5.733 -21.705
  987   2HB   LYS 132          HB3       LYS 132   8.165  -7.099 -21.762
  988   1HG   LYS 132          HG2       LYS 132   6.610  -8.536 -20.598
  989   2HG   LYS 132          HG3       LYS 132   5.513  -7.173 -20.274
  990   1HD   LYS 132          HD2       LYS 132   5.020  -6.906 -22.631
  991   2HD   LYS 132          HD3       LYS 132   6.311  -8.011 -23.091
  992   1HE   LYS 132          HE2       LYS 132   4.123  -9.048 -23.362
  993   2HE   LYS 132          HE3       LYS 132   5.120  -9.929 -22.203
  994   1HZ   LYS 132          HZ1       LYS 132   3.800  -9.206 -20.440
  995   2HZ   LYS 132          HZ2       LYS 132   3.091  -7.977 -21.306
  996   3HZ   LYS 132          HZ3       LYS 132   2.727  -9.538 -21.604
  997    H    GLU 133           H        GLU 133   9.972  -7.781 -20.115
  998    HA   GLU 133           HA       GLU 133   9.100  -9.769 -18.300
  999   1HB   GLU 133          HB2       GLU 133  11.931  -9.288 -19.255
 1000   2HB   GLU 133          HB3       GLU 133  11.333 -10.718 -18.379
 1001   1HG   GLU 133          HG2       GLU 133   9.702 -11.159 -20.179
 1002   2HG   GLU 133          HG3       GLU 133  10.315  -9.786 -21.093
 1003    H    PHE 134           H        PHE 134  11.285  -7.005 -17.716
 1004    HA   PHE 134           HA       PHE 134  11.951  -7.717 -15.066
 1005   1HB   PHE 134          HB2       PHE 134  13.155  -6.001 -16.230
 1006   2HB   PHE 134          HB3       PHE 134  11.696  -5.049 -16.471
 1007    HD1  PHE 134           HD1      PHE 134  11.158  -3.310 -14.986
 1008    HD2  PHE 134           HD2      PHE 134  13.877  -6.402 -13.713
 1009    HE1  PHE 134           HE1      PHE 134  11.633  -2.022 -12.940
 1010    HE2  PHE 134           HE2      PHE 134  14.308  -5.144 -11.617
 1011    HZ   PHE 134           HZ       PHE 134  13.203  -2.949 -11.230
 1012    H    ALA 135           H        ALA 135   9.047  -6.148 -16.342
 1013    HA   ALA 135           HA       ALA 135   8.089  -5.484 -13.681
 1014   1HB   ALA 135          HB1       ALA 135   6.680  -5.405 -16.396
 1015   2HB   ALA 135          HB2       ALA 135   6.103  -4.643 -14.898
 1016   3HB   ALA 135          HB3       ALA 135   7.593  -4.063 -15.677
 1017    H    GLU 136           H        GLU 136   7.515  -7.968 -16.117
 1018    HA   GLU 136           HA       GLU 136   5.185  -9.063 -14.794
 1019   1HB   GLU 136          HB2       GLU 136   5.278  -8.828 -17.197
 1020   2HB   GLU 136          HB3       GLU 136   6.766  -9.782 -17.294
 1021   1HG   GLU 136          HG2       GLU 136   5.628 -11.793 -16.578
 1022   2HG   GLU 136          HG3       GLU 136   4.112 -10.902 -16.341
 1023    H    THR 137           H        THR 137   8.524 -10.056 -15.410
 1024    HA   THR 137           HA       THR 137   8.076 -12.601 -13.963
 1025    HB   THR 137           HB       THR 137   9.726 -13.607 -15.341
 1026    HG1  THR 137           HG1      THR 137  10.178 -10.971 -16.238
 1027   1HG2  THR 137          HG21      THR 137   7.982 -11.956 -17.202
 1028   2HG2  THR 137          HG22      THR 137   8.749 -13.523 -17.524
 1029   3HG2  THR 137          HG23      THR 137   7.437 -13.418 -16.331
 1030    H    GLY 138           H        GLY 138   9.941  -9.638 -13.958
 1031   1HA   GLY 138          HA1       GLY 138  11.185  -8.789 -12.181
 1032   2HA   GLY 138          HA2       GLY 138  11.243 -10.382 -11.426
 1033    H    LYS 139           H        LYS 139  12.087 -10.430 -14.816
 1034    HA   LYS 139           HA       LYS 139  14.727 -11.350 -14.163
 1035   1HB   LYS 139          HB2       LYS 139  13.196 -10.878 -16.751
 1036   2HB   LYS 139          HB3       LYS 139  14.824 -11.527 -16.720
 1037   1HG   LYS 139          HG2       LYS 139  12.437 -12.790 -15.278
 1038   2HG   LYS 139          HG3       LYS 139  12.990 -13.273 -16.880
 1039   1HD   LYS 139          HD2       LYS 139  14.497 -13.534 -14.243
 1040   2HD   LYS 139          HD3       LYS 139  13.711 -14.828 -15.160
 1041   1HE   LYS 139          HE2       LYS 139  15.190 -14.331 -17.102
 1042   2HE   LYS 139          HE3       LYS 139  16.020 -13.103 -16.132
 1043   1HZ   LYS 139          HZ1       LYS 139  17.232 -15.200 -16.121
 1044   2HZ   LYS 139          HZ2       LYS 139  16.719 -14.871 -14.611
 1045   3HZ   LYS 139          HZ3       LYS 139  15.956 -16.005 -15.509
  Start of MODEL   16
    1   1H    MET   1           H1       MET   1   0.670   3.052   2.895
    2   2H    MET   1           H2       MET   1   2.057   2.181   2.876
    3   3H    MET   1           H3       MET   1   2.104   3.760   3.279
    4    HA   MET   1           HA       MET   1   1.406   2.679   0.639
    5   1HB   MET   1          HB2       MET   1   1.635   5.577   1.573
    6   2HB   MET   1          HB3       MET   1   1.618   5.074  -0.117
    7   1HG   MET   1          HG2       MET   1  -0.614   4.041   0.192
    8   2HG   MET   1          HG3       MET   1  -0.614   4.558   1.878
    9   1HE   MET   1          HE1       MET   1   0.427   6.518  -1.506
   10   2HE   MET   1          HE2       MET   1  -1.036   5.566  -1.855
   11   3HE   MET   1          HE3       MET   1  -1.116   7.340  -1.799
   12    H    GLU   2           H        GLU   2   3.044   2.804  -0.966
   13    HA   GLU   2           HA       GLU   2   5.716   3.764  -0.288
   14   1HB   GLU   2          HB2       GLU   2   5.705   1.481   0.643
   15   2HB   GLU   2          HB3       GLU   2   5.096   0.828  -0.879
   16   1HG   GLU   2          HG2       GLU   2   7.185   1.339  -2.015
   17   2HG   GLU   2          HG3       GLU   2   7.768   2.263  -0.624
   18    H    ASN   3           H        ASN   3   6.975   3.962  -2.264
   19    HA   ASN   3           HA       ASN   3   5.826   3.124  -4.809
   20   1HB   ASN   3          HB2       ASN   3   5.081   5.595  -4.256
   21   2HB   ASN   3          HB3       ASN   3   6.783   6.003  -4.539
   22   1HD2  ASN   3          HD22      ASN   3   7.705   5.312  -6.738
   23   2HD2  ASN   3          HD21      ASN   3   6.547   5.302  -8.076
   24    H    LYS   4           H        LYS   4   7.585   2.488  -6.098
   25    HA   LYS   4           HA       LYS   4  10.215   2.509  -4.745
   26   1HB   LYS   4          HB2       LYS   4   9.189   1.092  -7.250
   27   2HB   LYS   4          HB3       LYS   4  10.818   0.927  -6.579
   28   1HG   LYS   4          HG2       LYS   4   9.664   0.260  -4.355
   29   2HG   LYS   4          HG3       LYS   4   8.168   0.140  -5.283
   30   1HD   LYS   4          HD2       LYS   4   9.157  -2.044  -5.002
   31   2HD   LYS   4          HD3       LYS   4   9.211  -1.600  -6.722
   32   1HE   LYS   4          HE2       LYS   4  11.573  -0.947  -6.514
   33   2HE   LYS   4          HE3       LYS   4  11.529  -1.201  -4.767
   34   1HZ   LYS   4          HZ1       LYS   4  11.266  -3.558  -5.166
   35   2HZ   LYS   4          HZ2       LYS   4  11.189  -3.332  -6.793
   36   3HZ   LYS   4          HZ3       LYS   4  12.577  -2.987  -5.983
   37    H    ILE   5           H        ILE   5  12.084   2.601  -6.644
   38    HA   ILE   5           HA       ILE   5  11.737   4.987  -8.314
   39    HB   ILE   5           HB       ILE   5  14.024   4.670  -6.351
   40   1HG1  ILE   5          HG12      ILE   5  13.012   6.916  -5.366
   41   2HG1  ILE   5          HG13      ILE   5  11.491   6.228  -5.905
   42   1HG2  ILE   5          HG21      ILE   5  13.224   7.021  -8.115
   43   2HG2  ILE   5          HG22      ILE   5  14.596   7.009  -6.988
   44   3HG2  ILE   5          HG23      ILE   5  14.605   5.948  -8.389
   45   1HD1  ILE   5          HD11      ILE   5  12.009   4.181  -4.474
   46   2HD1  ILE   5          HD12      ILE   5  13.552   4.916  -4.056
   47   3HD1  ILE   5          HD13      ILE   5  12.037   5.680  -3.532
   48    H    ILE   6           H        ILE   6  13.142   4.802 -10.164
   49    HA   ILE   6           HA       ILE   6  15.140   2.651 -10.197
   50    HB   ILE   6           HB       ILE   6  13.117   1.483 -10.840
   51   1HG1  ILE   6          HG12      ILE   6  14.808   1.938 -13.336
   52   2HG1  ILE   6          HG13      ILE   6  15.313   0.966 -11.949
   53   1HG2  ILE   6          HG21      ILE   6  11.780   3.430 -11.686
   54   2HG2  ILE   6          HG22      ILE   6  12.800   3.447 -13.145
   55   3HG2  ILE   6          HG23      ILE   6  11.759   2.061 -12.785
   56   1HD1  ILE   6          HD11      ILE   6  13.344  -0.515 -12.292
   57   2HD1  ILE   6          HD12      ILE   6  12.935   0.410 -13.760
   58   3HD1  ILE   6          HD13      ILE   6  14.457  -0.483 -13.679
   59    H    TYR   7           H        TYR   7  16.703   2.943 -11.898
   60    HA   TYR   7           HA       TYR   7  16.595   5.568 -13.269
   61   1HB   TYR   7          HB2       TYR   7  17.858   5.303 -10.931
   62   2HB   TYR   7          HB3       TYR   7  19.094   4.541 -11.898
   63    HD1  TYR   7           HD1      TYR   7  17.550   7.336 -13.708
   64    HD2  TYR   7           HD2      TYR   7  20.367   6.323 -10.597
   65    HE1  TYR   7           HE1      TYR   7  18.365   9.647 -13.706
   66    HE2  TYR   7           HE2      TYR   7  21.213   8.651 -10.625
   67    HH   TYR   7           HH       TYR   7  19.738  11.203 -12.658
   68    H    PHE   8           H        PHE   8  17.482   5.519 -15.314
   69    HA   PHE   8           HA       PHE   8  18.869   3.025 -16.228
   70   1HB   PHE   8          HB2       PHE   8  17.070   4.890 -17.824
   71   2HB   PHE   8          HB3       PHE   8  17.934   3.497 -18.455
   72    HD1  PHE   8           HD1      PHE   8  14.937   4.636 -16.734
   73    HD2  PHE   8           HD2      PHE   8  17.288   1.155 -17.689
   74    HE1  PHE   8           HE1      PHE   8  13.043   3.159 -16.135
   75    HE2  PHE   8           HE2      PHE   8  15.393  -0.307 -17.063
   76    HZ   PHE   8           HZ       PHE   8  13.282   0.693 -16.231
   77    H    LEU   9           H        LEU   9  20.914   3.367 -16.961
   78    HA   LEU   9           HA       LEU   9  21.876   6.184 -17.232
   79   1HB   LEU   9          HB2       LEU   9  22.866   3.748 -15.768
   80   2HB   LEU   9          HB3       LEU   9  24.042   4.829 -16.480
   81    HG   LEU   9           HG       LEU   9  23.375   6.678 -15.136
   82   1HD1  LEU   9          HD11      LEU   9  21.094   4.951 -14.109
   83   2HD1  LEU   9          HD12      LEU   9  21.643   6.461 -13.344
   84   3HD1  LEU   9          HD13      LEU   9  20.981   6.506 -14.968
   85   1HD2  LEU   9          HD21      LEU   9  24.927   5.110 -14.101
   86   2HD2  LEU   9          HD22      LEU   9  23.859   5.787 -12.872
   87   3HD2  LEU   9          HD23      LEU   9  23.585   4.141 -13.486
   88    H    CYS  10           H        CYS  10  23.292   6.640 -18.905
   89    HA   CYS  10           HA       CYS  10  24.422   4.413 -20.533
   90   1HB   CYS  10          HB2       CYS  10  22.736   6.752 -21.539
   91   2HB   CYS  10          HB3       CYS  10  23.810   5.845 -22.605
   92    HG   CYS  10           HG       CYS  10  21.940   4.117 -20.612
   93    H    THR  11           H        THR  11  25.931   5.394 -22.267
   94    HA   THR  11           HA       THR  11  27.914   7.077 -21.094
   95    HB   THR  11           HB       THR  11  28.731   6.967 -23.591
   96    HG1  THR  11           HG1      THR  11  27.851   5.085 -24.596
   97   1HG2  THR  11          HG21      THR  11  29.607   5.607 -21.708
   98   2HG2  THR  11          HG22      THR  11  28.315   4.405 -21.976
   99   3HG2  THR  11          HG23      THR  11  29.541   4.689 -23.228
  100    H    GLY  12           H        GLY  12  24.934   7.774 -22.766
  101   1HA   GLY  12          HA1       GLY  12  25.221  10.551 -22.104
  102   2HA   GLY  12          HA2       GLY  12  25.142  10.272 -23.856
  103    H    ASN  13           H        ASN  13  23.159  11.298 -21.651
  104    HA   ASN  13           HA       ASN  13  21.046   9.302 -21.604
  105   1HB   ASN  13          HB2       ASN  13  21.538  10.856 -19.703
  106   2HB   ASN  13          HB3       ASN  13  21.005  12.204 -20.707
  107   1HD2  ASN  13          HD22      ASN  13  19.428   8.865 -20.316
  108   2HD2  ASN  13          HD21      ASN  13  17.939   9.568 -19.709
  109    H    SER  14           H        SER  14  21.285   9.503 -24.218
  110    HA   SER  14           HA       SER  14  19.237  11.512 -25.107
  111   1HB   SER  14          HB2       SER  14  21.816  10.675 -26.460
  112   2HB   SER  14          HB3       SER  14  20.578  11.726 -27.178
  113    HG   SER  14           HG       SER  14  20.895  13.221 -25.639
  114    H    CYS  15           H        CYS  15  20.056   8.129 -25.185
  115    HA   CYS  15           HA       CYS  15  17.930   7.717 -27.242
  116   1HB   CYS  15          HB2       CYS  15  20.697   6.429 -27.260
  117   2HB   CYS  15          HB3       CYS  15  19.369   6.068 -28.371
  118    HG   CYS  15           HG       CYS  15  21.487   7.479 -29.265
  119    H    ARG  16           H        ARG  16  20.139   5.331 -25.817
  120    HA   ARG  16           HA       ARG  16  18.105   3.441 -25.450
  121   1HB   ARG  16          HB2       ARG  16  20.807   3.787 -24.133
  122   2HB   ARG  16          HB3       ARG  16  19.850   2.337 -23.910
  123   1HG   ARG  16          HG2       ARG  16  20.152   1.615 -26.107
  124   2HG   ARG  16          HG3       ARG  16  20.603   3.215 -26.707
  125   1HD   ARG  16          HD2       ARG  16  22.265   1.628 -24.704
  126   2HD   ARG  16          HD3       ARG  16  22.541   1.596 -26.452
  127    HE   ARG  16           HE       ARG  16  22.595   4.257 -26.037
  128   1HH1  ARG  16          HH21      ARG  16  24.301   1.729 -24.198
  129   2HH1  ARG  16          HH22      ARG  16  25.791   2.666 -24.190
  130   1HH2  ARG  16          HH11      ARG  16  24.280   5.492 -25.706
  131   2HH2  ARG  16          HH12      ARG  16  25.671   5.003 -24.752
  132    H    SER  17           H        SER  17  19.639   5.471 -22.828
  133    HA   SER  17           HA       SER  17  17.963   4.326 -20.824
  134   1HB   SER  17          HB2       SER  17  18.841   6.290 -19.474
  135   2HB   SER  17          HB3       SER  17  20.027   5.214 -20.165
  136    HG   SER  17           HG       SER  17  20.829   7.045 -20.854
  137    H    GLN  18           H        GLN  18  17.587   7.167 -22.897
  138    HA   GLN  18           HA       GLN  18  15.318   8.330 -21.612
  139   1HB   GLN  18          HB2       GLN  18  16.553   8.438 -24.384
  140   2HB   GLN  18          HB3       GLN  18  14.996   9.177 -24.109
  141   1HG   GLN  18          HG2       GLN  18  17.447   9.815 -22.411
  142   2HG   GLN  18          HG3       GLN  18  17.039  10.698 -23.880
  143   1HE2  GLN  18          HE22      GLN  18  17.070  11.680 -20.948
  144   2HE2  GLN  18          HE21      GLN  18  15.442  12.339 -20.784
  145    H    MET  19           H        MET  19  15.508   6.158 -24.456
  146    HA   MET  19           HA       MET  19  12.736   5.652 -24.695
  147   1HB   MET  19          HB2       MET  19  15.086   3.835 -25.403
  148   2HB   MET  19          HB3       MET  19  13.410   3.576 -25.893
  149   1HG   MET  19          HG2       MET  19  13.530   5.962 -26.907
  150   2HG   MET  19          HG3       MET  19  15.278   5.798 -26.765
  151   1HE   MET  19          HE1       MET  19  16.738   4.018 -28.074
  152   2HE   MET  19          HE2       MET  19  15.734   2.667 -27.491
  153   3HE   MET  19          HE3       MET  19  16.059   2.844 -29.227
  154    H    ALA  20           H        ALA  20  15.173   3.909 -22.674
  155    HA   ALA  20           HA       ALA  20  13.421   1.862 -21.800
  156   1HB   ALA  20          HB1       ALA  20  15.788   3.097 -20.321
  157   2HB   ALA  20          HB2       ALA  20  15.053   1.512 -20.005
  158   3HB   ALA  20          HB3       ALA  20  15.882   1.811 -21.546
  159    H    GLU  21           H        GLU  21  14.156   5.014 -20.247
  160    HA   GLU  21           HA       GLU  21  12.374   4.779 -18.088
  161   1HB   GLU  21          HB2       GLU  21  14.010   6.598 -18.415
  162   2HB   GLU  21          HB3       GLU  21  13.004   7.274 -19.696
  163   1HG   GLU  21          HG2       GLU  21  11.150   7.497 -17.937
  164   2HG   GLU  21          HG3       GLU  21  12.358   7.052 -16.738
  165    H    GLY  22           H        GLY  22  11.634   5.741 -21.487
  166   1HA   GLY  22          HA1       GLY  22   8.899   6.411 -21.128
  167   2HA   GLY  22          HA2       GLY  22   9.662   5.813 -22.629
  168    H    TRP  23           H        TRP  23  10.387   3.253 -22.063
  169    HA   TRP  23           HA       TRP  23   7.887   1.832 -22.145
  170   1HB   TRP  23          HB2       TRP  23  10.768   0.938 -21.723
  171   2HB   TRP  23          HB3       TRP  23   9.417  -0.185 -21.742
  172    HD1  TRP  23           HD1      TRP  23  11.746   1.536 -24.046
  173    HE1  TRP  23           HE1      TRP  23  11.143   1.065 -26.463
  174    HE3  TRP  23           HE3      TRP  23   7.087  -0.448 -23.321
  175    HZ2  TRP  23           HZ2      TRP  23   8.859  -0.038 -27.951
  176    HZ3  TRP  23           HZ3      TRP  23   5.770  -1.297 -25.237
  177    HH2  TRP  23           HH2      TRP  23   6.666  -1.136 -27.545
  178    H    ALA  24           H        ALA  24  10.292   2.333 -19.545
  179    HA   ALA  24           HA       ALA  24   9.138   0.548 -17.703
  180   1HB   ALA  24          HB1       ALA  24  10.557   1.761 -16.058
  181   2HB   ALA  24          HB2       ALA  24  11.431   1.427 -17.560
  182   3HB   ALA  24          HB3       ALA  24  10.810   3.045 -17.270
  183    H    LYS  25           H        LYS  25   8.563   4.088 -18.133
  184    HA   LYS  25           HA       LYS  25   6.706   4.441 -16.052
  185   1HB   LYS  25          HB2       LYS  25   6.899   5.641 -18.833
  186   2HB   LYS  25          HB3       LYS  25   5.620   6.124 -17.711
  187   1HG   LYS  25          HG2       LYS  25   7.188   6.918 -16.078
  188   2HG   LYS  25          HG3       LYS  25   8.562   6.231 -16.960
  189   1HD   LYS  25          HD2       LYS  25   8.180   7.747 -18.841
  190   2HD   LYS  25          HD3       LYS  25   6.768   8.465 -18.020
  191   1HE   LYS  25          HE2       LYS  25   8.135   9.362 -16.249
  192   2HE   LYS  25          HE3       LYS  25   9.501   8.336 -16.707
  193   1HZ   LYS  25          HZ1       LYS  25  10.052  10.374 -17.496
  194   2HZ   LYS  25          HZ2       LYS  25   9.593   9.583 -18.813
  195   3HZ   LYS  25          HZ3       LYS  25   8.558  10.712 -18.196
  196    H    GLN  26           H        GLN  26   6.158   2.916 -19.218
  197    HA   GLN  26           HA       GLN  26   3.314   2.755 -18.811
  198   1HB   GLN  26          HB2       GLN  26   4.823   0.861 -20.632
  199   2HB   GLN  26          HB3       GLN  26   3.150   1.386 -20.713
  200   1HG   GLN  26          HG2       GLN  26   5.654   2.845 -21.493
  201   2HG   GLN  26          HG3       GLN  26   4.235   2.488 -22.460
  202   1HE2  GLN  26          HE22      GLN  26   5.858   4.988 -21.042
  203   2HE2  GLN  26          HE21      GLN  26   4.526   6.111 -20.799
  204    H    TYR  27           H        TYR  27   5.812   0.177 -18.735
  205    HA   TYR  27           HA       TYR  27   3.949  -1.771 -17.812
  206   1HB   TYR  27          HB2       TYR  27   6.988  -1.807 -17.658
  207   2HB   TYR  27          HB3       TYR  27   5.934  -3.187 -17.397
  208    HD1  TYR  27           HD1      TYR  27   7.886  -1.544 -19.802
  209    HD2  TYR  27           HD2      TYR  27   4.198  -3.718 -19.362
  210    HE1  TYR  27           HE1      TYR  27   8.053  -2.277 -22.164
  211    HE2  TYR  27           HE2      TYR  27   4.265  -4.329 -21.762
  212    HH   TYR  27           HH       TYR  27   6.975  -3.383 -23.918
  213    H    LEU  28           H        LEU  28   6.346   0.198 -16.028
  214    HA   LEU  28           HA       LEU  28   5.763  -1.076 -13.475
  215   1HB   LEU  28          HB2       LEU  28   7.223   1.532 -14.034
  216   2HB   LEU  28          HB3       LEU  28   7.264   0.611 -12.562
  217    HG   LEU  28           HG       LEU  28   8.408  -0.309 -15.225
  218   1HD1  LEU  28          HD11      LEU  28   9.826   0.428 -12.641
  219   2HD1  LEU  28          HD12      LEU  28  10.560   0.027 -14.210
  220   3HD1  LEU  28          HD13      LEU  28   9.622   1.524 -14.023
  221   1HD2  LEU  28          HD21      LEU  28   8.550  -1.712 -12.527
  222   2HD2  LEU  28          HD22      LEU  28   7.598  -2.261 -13.920
  223   3HD2  LEU  28          HD23      LEU  28   9.350  -2.217 -14.031
  224    H    GLY  29           H        GLY  29   3.986   1.146 -15.295
  225   1HA   GLY  29          HA1       GLY  29   2.140   2.368 -14.859
  226   2HA   GLY  29          HA2       GLY  29   1.949   1.338 -13.428
  227    H    ASP  30           H        ASP  30   4.704   3.453 -13.783
  228    HA   ASP  30           HA       ASP  30   5.633   5.011 -12.504
  229   1HB   ASP  30          HB2       ASP  30   3.937   6.359 -13.635
  230   2HB   ASP  30          HB3       ASP  30   2.849   6.165 -12.259
  231    H    GLU  31           H        GLU  31   4.092   2.594 -11.136
  232    HA   GLU  31           HA       GLU  31   3.946   3.313  -8.360
  233   1HB   GLU  31          HB2       GLU  31   4.405   0.619  -9.686
  234   2HB   GLU  31          HB3       GLU  31   4.063   0.856  -7.980
  235   1HG   GLU  31          HG2       GLU  31   2.200   1.747 -10.212
  236   2HG   GLU  31          HG3       GLU  31   2.100   0.182  -9.412
  237    H    TRP  32           H        TRP  32   6.454   3.296 -10.494
  238    HA   TRP  32           HA       TRP  32   8.549   3.157  -8.443
  239   1HB   TRP  32          HB2       TRP  32   8.830   2.269 -11.342
  240   2HB   TRP  32          HB3       TRP  32  10.079   2.250 -10.115
  241    HD1  TRP  32           HD1      TRP  32   6.548   0.605 -10.408
  242    HE1  TRP  32           HE1      TRP  32   6.710  -1.855  -9.868
  243    HE3  TRP  32           HE3      TRP  32  11.581   0.324  -9.417
  244    HZ2  TRP  32           HZ2      TRP  32   8.779  -3.794  -9.488
  245    HZ3  TRP  32           HZ3      TRP  32  12.633  -1.892  -9.081
  246    HH2  TRP  32           HH2      TRP  32  11.251  -3.976  -9.217
  247    H    LYS  33           H        LYS  33   9.388   5.252  -8.412
  248    HA   LYS  33           HA       LYS  33   8.730   7.301 -10.324
  249   1HB   LYS  33          HB2       LYS  33  10.833   7.099  -8.122
  250   2HB   LYS  33          HB3       LYS  33  10.524   8.556  -9.062
  251   1HG   LYS  33          HG2       LYS  33   8.574   7.224  -7.138
  252   2HG   LYS  33          HG3       LYS  33   9.568   8.624  -6.827
  253   1HD   LYS  33          HD2       LYS  33   7.569   9.638  -7.286
  254   2HD   LYS  33          HD3       LYS  33   8.362   9.727  -8.860
  255   1HE   LYS  33          HE2       LYS  33   7.037   7.676  -9.559
  256   2HE   LYS  33          HE3       LYS  33   6.242   7.697  -7.985
  257   1HZ   LYS  33          HZ1       LYS  33   6.130   9.928  -9.925
  258   2HZ   LYS  33          HZ2       LYS  33   4.984   8.782  -9.795
  259   3HZ   LYS  33          HZ3       LYS  33   5.266   9.806  -8.536
  260    H    VAL  34           H        VAL  34   9.366   6.861 -12.373
  261    HA   VAL  34           HA       VAL  34  11.862   5.520 -12.885
  262    HB   VAL  34           HB       VAL  34  10.075   6.717 -15.012
  263   1HG1  VAL  34          HG11      VAL  34  12.289   5.358 -15.388
  264   2HG1  VAL  34          HG12      VAL  34  11.306   3.956 -14.941
  265   3HG1  VAL  34          HG13      VAL  34  10.838   4.971 -16.331
  266   1HG2  VAL  34          HG21      VAL  34   8.365   5.643 -13.691
  267   2HG2  VAL  34          HG22      VAL  34   8.739   4.578 -15.043
  268   3HG2  VAL  34          HG23      VAL  34   9.384   4.203 -13.438
  269    H    TYR  35           H        TYR  35  13.721   6.464 -13.694
  270    HA   TYR  35           HA       TYR  35  13.709   9.239 -14.730
  271   1HB   TYR  35          HB2       TYR  35  15.538   8.173 -12.531
  272   2HB   TYR  35          HB3       TYR  35  15.744   9.709 -13.350
  273    HD1  TYR  35           HD1      TYR  35  14.019  11.548 -13.047
  274    HD2  TYR  35           HD2      TYR  35  14.091   7.972 -10.633
  275    HE1  TYR  35           HE1      TYR  35  12.703  12.709 -11.300
  276    HE2  TYR  35           HE2      TYR  35  12.814   9.136  -8.863
  277    HH   TYR  35           HH       TYR  35  11.777  11.124  -8.207
  278    H    SER  36           H        SER  36  15.834   9.681 -15.877
  279    HA   SER  36           HA       SER  36  17.584   7.382 -16.247
  280   1HB   SER  36          HB2       SER  36  17.658   7.649 -18.671
  281   2HB   SER  36          HB3       SER  36  16.068   7.123 -18.129
  282    HG   SER  36           HG       SER  36  15.290   9.178 -18.450
  283    H    ALA  37           H        ALA  37  19.678   8.005 -17.138
  284    HA   ALA  37           HA       ALA  37  20.412  10.795 -17.348
  285   1HB   ALA  37          HB1       ALA  37  21.299   9.195 -14.900
  286   2HB   ALA  37          HB2       ALA  37  21.893  10.805 -15.379
  287   3HB   ALA  37          HB3       ALA  37  20.222  10.615 -14.901
  288    H    GLY  38           H        GLY  38  23.125  10.594 -16.909
  289   1HA   GLY  38          HA1       GLY  38  24.438   8.229 -17.636
  290   2HA   GLY  38          HA2       GLY  38  24.175   9.180 -19.119
  291    H    ILE  39           H        ILE  39  26.660   8.962 -18.804
  292    HA   ILE  39           HA       ILE  39  28.080  10.608 -17.010
  293    HB   ILE  39           HB       ILE  39  28.495   9.317 -19.725
  294   1HG1  ILE  39          HG12      ILE  39  29.960   9.030 -17.067
  295   2HG1  ILE  39          HG13      ILE  39  28.608   8.038 -17.616
  296   1HG2  ILE  39          HG21      ILE  39  30.609  11.117 -18.518
  297   2HG2  ILE  39          HG22      ILE  39  30.814  10.026 -19.914
  298   3HG2  ILE  39          HG23      ILE  39  29.717  11.377 -20.044
  299   1HD1  ILE  39          HD11      ILE  39  29.942   7.229 -19.530
  300   2HD1  ILE  39          HD12      ILE  39  31.349   8.137 -18.911
  301   3HD1  ILE  39          HD13      ILE  39  30.663   6.828 -17.957
  302    H    GLU  40           H        GLU  40  26.209  11.417 -19.884
  303    HA   GLU  40           HA       GLU  40  26.579  14.221 -19.378
  304   1HB   GLU  40          HB2       GLU  40  27.142  14.813 -21.679
  305   2HB   GLU  40          HB3       GLU  40  28.424  13.886 -20.906
  306   1HG   GLU  40          HG2       GLU  40  27.693  11.841 -22.077
  307   2HG   GLU  40          HG3       GLU  40  26.346  12.709 -22.815
  308    H    ALA  41           H        ALA  41  25.023  15.462 -20.859
  309    HA   ALA  41           HA       ALA  41  22.882  13.880 -22.085
  310   1HB   ALA  41          HB1       ALA  41  22.467  15.903 -19.824
  311   2HB   ALA  41          HB2       ALA  41  21.178  15.329 -20.891
  312   3HB   ALA  41          HB3       ALA  41  22.020  14.181 -19.823
  313    H    HIS  42           H        HIS  42  22.222  14.940 -23.919
  314    HA   HIS  42           HA       HIS  42  22.823  17.845 -24.245
  315   1HB   HIS  42          HB2       HIS  42  23.309  15.578 -26.223
  316   2HB   HIS  42          HB3       HIS  42  23.234  17.268 -26.694
  317    HD1  HIS  42           HD1      HIS  42  25.093  17.367 -23.550
  318    HD2  HIS  42           HD2      HIS  42  25.824  16.338 -27.567
  319    HE1  HIS  42           HE1      HIS  42  27.614  17.556 -23.892
  320    H    GLY  43           H        GLY  43  20.417  15.822 -23.650
  321   1HA   GLY  43          HA1       GLY  43  18.101  16.331 -23.976
  322   2HA   GLY  43          HA2       GLY  43  18.469  17.083 -25.533
  323    H    LEU  44           H        LEU  44  16.540  15.129 -25.384
  324    HA   LEU  44           HA       LEU  44  17.691  12.542 -26.012
  325   1HB   LEU  44          HB2       LEU  44  15.516  11.691 -26.084
  326   2HB   LEU  44          HB3       LEU  44  15.619  12.764 -24.695
  327    HG   LEU  44           HG       LEU  44  14.225  13.330 -27.357
  328   1HD1  LEU  44          HD11      LEU  44  13.209  12.824 -24.523
  329   2HD1  LEU  44          HD12      LEU  44  12.193  13.169 -25.936
  330   3HD1  LEU  44          HD13      LEU  44  13.161  11.682 -25.873
  331   1HD2  LEU  44          HD21      LEU  44  14.946  15.508 -26.496
  332   2HD2  LEU  44          HD22      LEU  44  13.228  15.316 -26.180
  333   3HD2  LEU  44          HD23      LEU  44  14.381  15.083 -24.853
  334    H    ASN  45           H        ASN  45  17.488  11.421 -27.946
  335    HA   ASN  45           HA       ASN  45  18.086  13.012 -30.253
  336   1HB   ASN  45          HB2       ASN  45  19.036  10.756 -29.585
  337   2HB   ASN  45          HB3       ASN  45  17.516  10.022 -30.074
  338   1HD2  ASN  45          HD22      ASN  45  20.582  10.805 -31.100
  339   2HD2  ASN  45          HD21      ASN  45  20.324  10.797 -32.831
  340    HA   PRO  46           HA       PRO  46  13.855  13.435 -31.820
  341   1HB   PRO  46          HB2       PRO  46  15.249  13.251 -34.499
  342   2HB   PRO  46          HB3       PRO  46  13.961  14.382 -33.977
  343   1HG   PRO  46          HG2       PRO  46  16.544  15.198 -34.046
  344   2HG   PRO  46          HG3       PRO  46  15.503  15.640 -32.653
  345   1HD   PRO  46          HD2       PRO  46  17.576  13.447 -32.831
  346   2HD   PRO  46          HD3       PRO  46  17.241  14.593 -31.496
  347    H    ASN  47           H        ASN  47  16.064  10.905 -33.104
  348    HA   ASN  47           HA       ASN  47  13.928   9.333 -34.311
  349   1HB   ASN  47          HB2       ASN  47  16.707   8.518 -33.430
  350   2HB   ASN  47          HB3       ASN  47  15.619   7.541 -34.401
  351   1HD2  ASN  47          HD22      ASN  47  18.063   9.920 -34.455
  352   2HD2  ASN  47          HD21      ASN  47  18.073  10.198 -36.190
  353    H    ALA  48           H        ALA  48  15.428   9.596 -31.107
  354    HA   ALA  48           HA       ALA  48  14.439   7.104 -30.079
  355   1HB   ALA  48          HB1       ALA  48  14.995   7.999 -27.892
  356   2HB   ALA  48          HB2       ALA  48  16.303   8.433 -29.008
  357   3HB   ALA  48          HB3       ALA  48  15.110   9.646 -28.518
  358    H    VAL  49           H        VAL  49  13.227  10.521 -30.095
  359    HA   VAL  49           HA       VAL  49  10.745   9.925 -28.849
  360    HB   VAL  49           HB       VAL  49  11.214  12.070 -30.968
  361   1HG1  VAL  49          HG11      VAL  49   9.137  11.819 -28.735
  362   2HG1  VAL  49          HG12      VAL  49   9.349  13.233 -29.786
  363   3HG1  VAL  49          HG13      VAL  49   8.809  11.700 -30.478
  364   1HG2  VAL  49          HG21      VAL  49  11.559  12.197 -27.948
  365   2HG2  VAL  49          HG22      VAL  49  12.856  12.348 -29.154
  366   3HG2  VAL  49          HG23      VAL  49  11.610  13.592 -29.041
  367    H    LYS  50           H        LYS  50  11.626   9.941 -32.392
  368    HA   LYS  50           HA       LYS  50   9.069   9.196 -33.258
  369   1HB   LYS  50          HB2       LYS  50  11.102   9.974 -34.656
  370   2HB   LYS  50          HB3       LYS  50  11.657   8.295 -34.619
  371   1HG   LYS  50          HG2       LYS  50  10.511   8.918 -36.698
  372   2HG   LYS  50          HG3       LYS  50   9.784   7.552 -35.885
  373   1HD   LYS  50          HD2       LYS  50   8.496  10.143 -35.207
  374   2HD   LYS  50          HD3       LYS  50   8.431   9.747 -36.913
  375   1HE   LYS  50          HE2       LYS  50   7.571   7.809 -34.720
  376   2HE   LYS  50          HE3       LYS  50   6.460   8.898 -35.554
  377   1HZ   LYS  50          HZ1       LYS  50   8.127   6.953 -37.023
  378   2HZ   LYS  50          HZ2       LYS  50   6.663   6.550 -36.465
  379   3HZ   LYS  50          HZ3       LYS  50   6.812   7.760 -37.571
  380    H    ALA  51           H        ALA  51  11.735   7.100 -32.146
  381    HA   ALA  51           HA       ALA  51  10.528   4.632 -32.829
  382   1HB   ALA  51          HB1       ALA  51  12.438   5.267 -30.534
  383   2HB   ALA  51          HB2       ALA  51  12.155   3.678 -31.278
  384   3HB   ALA  51          HB3       ALA  51  12.927   4.967 -32.208
  385    H    MET  52           H        MET  52  10.362   6.584 -29.783
  386    HA   MET  52           HA       MET  52   8.642   4.666 -28.482
  387   1HB   MET  52          HB2       MET  52   9.100   7.624 -27.902
  388   2HB   MET  52          HB3       MET  52   8.229   6.506 -26.858
  389   1HG   MET  52          HG2       MET  52  11.170   6.518 -27.539
  390   2HG   MET  52          HG3       MET  52  10.405   6.677 -25.970
  391   1HE   MET  52          HE1       MET  52   8.276   4.079 -26.307
  392   2HE   MET  52          HE2       MET  52   9.208   3.028 -25.234
  393   3HE   MET  52          HE3       MET  52   9.069   4.746 -24.844
  394    H    LYS  53           H        LYS  53   7.996   7.581 -30.446
  395    HA   LYS  53           HA       LYS  53   5.176   7.535 -30.087
  396   1HB   LYS  53          HB2       LYS  53   6.976   8.547 -32.298
  397   2HB   LYS  53          HB3       LYS  53   5.238   8.846 -32.286
  398   1HG   LYS  53          HG2       LYS  53   6.882   9.556 -29.830
  399   2HG   LYS  53          HG3       LYS  53   6.920  10.626 -31.238
  400   1HD   LYS  53          HD2       LYS  53   4.742  11.295 -30.990
  401   2HD   LYS  53          HD3       LYS  53   4.230   9.773 -30.234
  402   1HE   LYS  53          HE2       LYS  53   4.088  11.350 -28.506
  403   2HE   LYS  53          HE3       LYS  53   5.549  10.416 -28.189
  404   1HZ   LYS  53          HZ1       LYS  53   5.381  13.166 -29.284
  405   2HZ   LYS  53          HZ2       LYS  53   6.042  12.692 -27.857
  406   3HZ   LYS  53          HZ3       LYS  53   6.782  12.314 -29.261
  407    H    GLU  54           H        GLU  54   7.303   5.518 -32.061
  408    HA   GLU  54           HA       GLU  54   5.280   4.604 -33.846
  409   1HB   GLU  54          HB2       GLU  54   7.853   4.507 -34.097
  410   2HB   GLU  54          HB3       GLU  54   7.769   3.071 -33.082
  411   1HG   GLU  54          HG2       GLU  54   7.831   2.491 -35.451
  412   2HG   GLU  54          HG3       GLU  54   6.320   1.968 -34.714
  413    H    VAL  55           H        VAL  55   5.923   3.948 -30.493
  414    HA   VAL  55           HA       VAL  55   4.057   1.609 -30.602
  415    HB   VAL  55           HB       VAL  55   5.094   0.914 -28.466
  416   1HG1  VAL  55          HG11      VAL  55   7.150   0.039 -29.511
  417   2HG1  VAL  55          HG12      VAL  55   5.791  -0.036 -30.635
  418   3HG1  VAL  55          HG13      VAL  55   7.019   1.232 -30.814
  419   1HG2  VAL  55          HG21      VAL  55   7.241   2.998 -29.047
  420   2HG2  VAL  55          HG22      VAL  55   5.981   3.196 -27.803
  421   3HG2  VAL  55          HG23      VAL  55   7.158   1.895 -27.673
  422    H    GLY  56           H        GLY  56   4.046   4.873 -29.942
  423   1HA   GLY  56          HA1       GLY  56   2.131   6.037 -29.345
  424   2HA   GLY  56          HA2       GLY  56   1.425   4.573 -28.637
  425    H    ILE  57           H        ILE  57   4.717   5.838 -27.964
  426    HA   ILE  57           HA       ILE  57   3.904   6.535 -25.185
  427    HB   ILE  57           HB       ILE  57   6.384   5.132 -26.245
  428   1HG1  ILE  57          HG12      ILE  57   4.360   4.257 -24.144
  429   2HG1  ILE  57          HG13      ILE  57   4.359   3.710 -25.815
  430   1HG2  ILE  57          HG21      ILE  57   7.187   5.173 -23.822
  431   2HG2  ILE  57          HG22      ILE  57   7.205   6.730 -24.626
  432   3HG2  ILE  57          HG23      ILE  57   5.899   6.334 -23.487
  433   1HD1  ILE  57          HD11      ILE  57   6.620   2.698 -25.493
  434   2HD1  ILE  57          HD12      ILE  57   6.514   3.091 -23.766
  435   3HD1  ILE  57          HD13      ILE  57   5.348   1.985 -24.502
  436    H    ASP  58           H        ASP  58   5.328   8.233 -24.335
  437    HA   ASP  58           HA       ASP  58   6.601   9.953 -26.386
  438   1HB   ASP  58          HB2       ASP  58   4.497  11.084 -25.868
  439   2HB   ASP  58          HB3       ASP  58   4.788  10.899 -24.125
  440    H    ILE  59           H        ILE  59   8.478  10.826 -25.730
  441    HA   ILE  59           HA       ILE  59   9.309  10.589 -22.909
  442    HB   ILE  59           HB       ILE  59  11.652  10.079 -23.703
  443   1HG1  ILE  59          HG12      ILE  59  10.315   9.116 -26.271
  444   2HG1  ILE  59          HG13      ILE  59  11.172  10.644 -26.154
  445   1HG2  ILE  59          HG21      ILE  59   9.555   7.925 -24.230
  446   2HG2  ILE  59          HG22      ILE  59  11.242   7.675 -23.734
  447   3HG2  ILE  59          HG23      ILE  59  10.103   8.438 -22.630
  448   1HD1  ILE  59          HD11      ILE  59  12.664   8.956 -27.056
  449   2HD1  ILE  59          HD12      ILE  59  13.237   9.421 -25.451
  450   3HD1  ILE  59          HD13      ILE  59  12.387   7.883 -25.677
  451    H    SER  60           H        SER  60   8.415  12.681 -25.255
  452    HA   SER  60           HA       SER  60  10.474  14.672 -25.142
  453   1HB   SER  60          HB2       SER  60   7.524  15.283 -25.391
  454   2HB   SER  60          HB3       SER  60   8.907  16.133 -26.107
  455    HG   SER  60           HG       SER  60   7.710  13.673 -26.768
  456    H    ASN  61           H        ASN  61   7.876  13.701 -22.995
  457    HA   ASN  61           HA       ASN  61   7.841  15.839 -21.160
  458   1HB   ASN  61          HB2       ASN  61   6.711  14.279 -19.668
  459   2HB   ASN  61          HB3       ASN  61   6.121  14.058 -21.305
  460   1HD2  ASN  61          HD22      ASN  61   6.659  12.130 -22.449
  461   2HD2  ASN  61          HD21      ASN  61   7.267  10.703 -21.642
  462    H    GLN  62           H        GLN  62  10.616  13.907 -21.675
  463    HA   GLN  62           HA       GLN  62  11.509  14.290 -18.868
  464   1HB   GLN  62          HB2       GLN  62  12.444  11.929 -18.963
  465   2HB   GLN  62          HB3       GLN  62  10.687  12.055 -18.845
  466   1HG   GLN  62          HG2       GLN  62  10.375  11.549 -21.157
  467   2HG   GLN  62          HG3       GLN  62  12.097  11.782 -21.503
  468   1HE2  GLN  62          HE22      GLN  62  13.350  10.094 -21.636
  469   2HE2  GLN  62          HE21      GLN  62  12.869   8.441 -21.241
  470    H    THR  63           H        THR  63  12.245  16.081 -20.634
  471    HA   THR  63           HA       THR  63  14.418  15.664 -22.290
  472    HB   THR  63           HB       THR  63  14.946  18.122 -21.595
  473    HG1  THR  63           HG1      THR  63  13.900  18.088 -19.566
  474   1HG2  THR  63          HG21      THR  63  13.587  17.490 -23.577
  475   2HG2  THR  63          HG22      THR  63  12.140  17.383 -22.549
  476   3HG2  THR  63          HG23      THR  63  12.953  18.947 -22.795
  477    H    SER  64           H        SER  64  16.520  15.249 -22.084
  478    HA   SER  64           HA       SER  64  17.405  13.805 -20.052
  479   1HB   SER  64          HB2       SER  64  19.128  15.407 -21.968
  480   2HB   SER  64          HB3       SER  64  19.488  13.815 -21.283
  481    HG   SER  64           HG       SER  64  18.510  13.027 -22.903
  482    H    ASP  65           H        ASP  65  19.174  13.861 -18.656
  483    HA   ASP  65           HA       ASP  65  20.462  16.355 -17.912
  484   1HB   ASP  65          HB2       ASP  65  18.331  16.365 -16.550
  485   2HB   ASP  65          HB3       ASP  65  18.841  14.841 -15.819
  486    H    ILE  66           H        ILE  66  22.234  15.890 -16.373
  487    HA   ILE  66           HA       ILE  66  23.499  13.271 -16.784
  488    HB   ILE  66           HB       ILE  66  25.166  14.474 -15.081
  489   1HG1  ILE  66          HG12      ILE  66  23.635  16.565 -14.908
  490   2HG1  ILE  66          HG13      ILE  66  25.370  16.736 -15.065
  491   1HG2  ILE  66          HG21      ILE  66  25.726  13.632 -17.227
  492   2HG2  ILE  66          HG22      ILE  66  24.960  15.016 -18.038
  493   3HG2  ILE  66          HG23      ILE  66  26.426  15.243 -17.041
  494   1HD1  ILE  66          HD11      ILE  66  24.154  18.383 -16.449
  495   2HD1  ILE  66          HD12      ILE  66  25.212  17.351 -17.422
  496   3HD1  ILE  66          HD13      ILE  66  23.465  17.075 -17.426
  497    H    ILE  67           H        ILE  67  24.460  12.260 -14.735
  498    HA   ILE  67           HA       ILE  67  22.351  11.314 -13.132
  499    HB   ILE  67           HB       ILE  67  25.369  11.188 -12.873
  500   1HG1  ILE  67          HG12      ILE  67  23.328   9.007 -13.533
  501   2HG1  ILE  67          HG13      ILE  67  24.088  10.004 -14.768
  502   1HG2  ILE  67          HG21      ILE  67  23.290   9.785 -11.126
  503   2HG2  ILE  67          HG22      ILE  67  25.022   9.379 -11.163
  504   3HG2  ILE  67          HG23      ILE  67  24.508  10.961 -10.596
  505   1HD1  ILE  67          HD11      ILE  67  26.330   9.213 -14.047
  506   2HD1  ILE  67          HD12      ILE  67  25.529   8.075 -12.929
  507   3HD1  ILE  67          HD13      ILE  67  25.256   7.951 -14.674
  508    H    ASP  68           H        ASP  68  21.675  11.747 -11.104
  509    HA   ASP  68           HA       ASP  68  22.725  14.156  -9.690
  510   1HB   ASP  68          HB2       ASP  68  20.674  14.745 -10.946
  511   2HB   ASP  68          HB3       ASP  68  19.801  13.453 -10.113
  512    H    SER  69           H        SER  69  22.984  13.918  -7.569
  513    HA   SER  69           HA       SER  69  23.301  11.450  -6.449
  514   1HB   SER  69          HB2       SER  69  22.804  14.036  -4.942
  515   2HB   SER  69          HB3       SER  69  23.798  12.662  -4.423
  516    HG   SER  69           HG       SER  69  25.052  14.383  -5.297
  517    H    ASP  70           H        ASP  70  20.304  13.319  -6.506
  518    HA   ASP  70           HA       ASP  70  19.346  12.002  -4.106
  519   1HB   ASP  70          HB2       ASP  70  18.821  14.390  -4.669
  520   2HB   ASP  70          HB3       ASP  70  17.883  13.835  -6.058
  521    H    ILE  71           H        ILE  71  19.556  11.060  -7.318
  522    HA   ILE  71           HA       ILE  71  17.311   9.125  -7.042
  523    HB   ILE  71           HB       ILE  71  18.778  10.043  -9.531
  524   1HG1  ILE  71          HG12      ILE  71  15.847  10.637  -8.962
  525   2HG1  ILE  71          HG13      ILE  71  17.086  11.745  -8.384
  526   1HG2  ILE  71          HG21      ILE  71  17.937   7.719  -9.620
  527   2HG2  ILE  71          HG22      ILE  71  16.314   8.266  -9.163
  528   3HG2  ILE  71          HG23      ILE  71  17.024   8.750 -10.718
  529   1HD1  ILE  71          HD11      ILE  71  16.759  10.947 -11.288
  530   2HD1  ILE  71          HD12      ILE  71  16.273  12.483 -10.539
  531   3HD1  ILE  71          HD13      ILE  71  17.993  12.038 -10.609
  532    H    LEU  72           H        LEU  72  20.813   9.573  -7.940
  533    HA   LEU  72           HA       LEU  72  21.270   6.831  -8.321
  534   1HB   LEU  72          HB2       LEU  72  23.528   7.236  -8.449
  535   2HB   LEU  72          HB3       LEU  72  22.776   8.756  -8.933
  536    HG   LEU  72           HG       LEU  72  23.203   9.403  -6.416
  537   1HD1  LEU  72          HD11      LEU  72  25.367   8.587  -5.570
  538   2HD1  LEU  72          HD12      LEU  72  24.202   7.278  -5.644
  539   3HD1  LEU  72          HD13      LEU  72  25.462   7.417  -6.894
  540   1HD2  LEU  72          HD21      LEU  72  24.141  10.560  -8.388
  541   2HD2  LEU  72          HD22      LEU  72  25.382  10.397  -7.142
  542   3HD2  LEU  72          HD23      LEU  72  25.392   9.313  -8.550
  543    H    ASN  73           H        ASN  73  21.445   8.665  -5.255
  544    HA   ASN  73           HA       ASN  73  22.209   6.280  -3.777
  545   1HB   ASN  73          HB2       ASN  73  21.268   9.017  -2.784
  546   2HB   ASN  73          HB3       ASN  73  21.948   7.765  -1.766
  547   1HD2  ASN  73          HD22      ASN  73  22.676  10.455  -3.712
  548   2HD2  ASN  73          HD21      ASN  73  24.432  10.342  -3.573
  549    H    ASN  74           H        ASN  74  19.322   6.955  -5.139
  550    HA   ASN  74           HA       ASN  74  17.648   6.177  -2.770
  551   1HB   ASN  74          HB2       ASN  74  17.636   8.572  -3.458
  552   2HB   ASN  74          HB3       ASN  74  17.195   8.082  -5.086
  553   1HD2  ASN  74          HD22      ASN  74  15.514   9.656  -4.739
  554   2HD2  ASN  74          HD21      ASN  74  14.009   9.155  -3.981
  555    H    ALA  75           H        ALA  75  18.329   5.689  -6.193
  556    HA   ALA  75           HA       ALA  75  15.895   4.433  -6.948
  557   1HB   ALA  75          HB1       ALA  75  18.653   4.236  -8.166
  558   2HB   ALA  75          HB2       ALA  75  17.105   3.785  -8.936
  559   3HB   ALA  75          HB3       ALA  75  17.428   5.477  -8.516
  560    H    ASP  76           H        ASP  76  15.083   2.514  -6.493
  561    HA   ASP  76           HA       ASP  76  16.426   0.635  -4.796
  562   1HB   ASP  76          HB2       ASP  76  13.966   0.798  -4.871
  563   2HB   ASP  76          HB3       ASP  76  13.970   0.270  -6.559
  564    H    LEU  77           H        LEU  77  16.251   1.104  -8.248
  565    HA   LEU  77           HA       LEU  77  18.241  -1.032  -8.643
  566   1HB   LEU  77          HB2       LEU  77  16.138  -2.169  -9.223
  567   2HB   LEU  77          HB3       LEU  77  15.641  -0.801 -10.217
  568    HG   LEU  77           HG       LEU  77  17.521  -1.239 -11.792
  569   1HD1  LEU  77          HD11      LEU  77  18.774  -3.343 -11.692
  570   2HD1  LEU  77          HD12      LEU  77  19.109  -2.402 -10.248
  571   3HD1  LEU  77          HD13      LEU  77  17.987  -3.779 -10.162
  572   1HD2  LEU  77          HD21      LEU  77  16.594  -3.270 -12.795
  573   2HD2  LEU  77          HD22      LEU  77  15.762  -3.653 -11.273
  574   3HD2  LEU  77          HD23      LEU  77  15.311  -2.209 -12.206
  575    H    VAL  78           H        VAL  78  19.753  -0.421 -10.079
  576    HA   VAL  78           HA       VAL  78  19.243   1.944 -11.814
  577    HB   VAL  78           HB       VAL  78  21.847   1.052 -10.487
  578   1HG1  VAL  78          HG11      VAL  78  22.308   2.038 -12.678
  579   2HG1  VAL  78          HG12      VAL  78  21.221   3.404 -12.331
  580   3HG1  VAL  78          HG13      VAL  78  22.727   3.206 -11.420
  581   1HG2  VAL  78          HG21      VAL  78  21.683   3.279  -9.316
  582   2HG2  VAL  78          HG22      VAL  78  20.050   3.472  -9.978
  583   3HG2  VAL  78          HG23      VAL  78  20.406   2.159  -8.838
  584    H    VAL  79           H        VAL  79  19.796   1.571 -14.013
  585    HA   VAL  79           HA       VAL  79  20.810  -1.158 -14.696
  586    HB   VAL  79           HB       VAL  79  18.668   0.393 -16.184
  587   1HG1  VAL  79          HG11      VAL  79  18.267  -1.728 -17.349
  588   2HG1  VAL  79          HG12      VAL  79  19.964  -1.268 -17.518
  589   3HG1  VAL  79          HG13      VAL  79  19.506  -2.532 -16.367
  590   1HG2  VAL  79          HG21      VAL  79  17.018  -1.296 -15.332
  591   2HG2  VAL  79          HG22      VAL  79  18.237  -1.826 -14.154
  592   3HG2  VAL  79          HG23      VAL  79  17.596  -0.170 -14.106
  593    H    THR  80           H        THR  80  22.671  -0.943 -15.888
  594    HA   THR  80           HA       THR  80  23.092   1.642 -17.334
  595    HB   THR  80           HB       THR  80  25.473   0.558 -17.559
  596    HG1  THR  80           HG1      THR  80  24.776  -1.390 -16.383
  597   1HG2  THR  80          HG21      THR  80  26.141   1.778 -15.516
  598   2HG2  THR  80          HG22      THR  80  24.958   2.663 -16.474
  599   3HG2  THR  80          HG23      THR  80  24.439   1.818 -14.990
  600    H    LEU  81           H        LEU  81  22.901   1.666 -19.464
  601    HA   LEU  81           HA       LEU  81  22.377  -0.938 -20.818
  602   1HB   LEU  81          HB2       LEU  81  21.570   1.876 -21.597
  603   2HB   LEU  81          HB3       LEU  81  21.268   0.437 -22.543
  604    HG   LEU  81           HG       LEU  81  19.845  -0.485 -20.721
  605   1HD1  LEU  81          HD11      LEU  81  18.904   1.227 -19.077
  606   2HD1  LEU  81          HD12      LEU  81  20.524   0.688 -18.709
  607   3HD1  LEU  81          HD13      LEU  81  20.273   2.277 -19.471
  608   1HD2  LEU  81          HD21      LEU  81  18.818   0.740 -22.611
  609   2HD2  LEU  81          HD22      LEU  81  17.910   0.934 -21.119
  610   3HD2  LEU  81          HD23      LEU  81  18.940   2.256 -21.681
  611    H    CYS  82           H        CYS  82  25.084   0.139 -20.205
  612    HA   CYS  82           HA       CYS  82  26.192   1.297 -22.582
  613   1HB   CYS  82          HB2       CYS  82  28.279   1.251 -21.329
  614   2HB   CYS  82          HB3       CYS  82  26.959   2.005 -20.453
  615    H    GLY  83           H        GLY  83  26.312   0.028 -24.377
  616   1HA   GLY  83          HA1       GLY  83  28.258  -2.137 -24.331
  617   2HA   GLY  83          HA2       GLY  83  26.642  -2.612 -24.873
  618    H    ASP  84           H        ASP  84  27.699   0.655 -25.310
  619    HA   ASP  84           HA       ASP  84  27.587   0.625 -28.218
  620   1HB   ASP  84          HB2       ASP  84  27.529   3.090 -27.831
  621   2HB   ASP  84          HB3       ASP  84  26.297   2.257 -26.884
  622    H    ALA  85           H        ALA  85  29.113   2.300 -29.235
  623    HA   ALA  85           HA       ALA  85  31.676   1.094 -29.156
  624   1HB   ALA  85          HB1       ALA  85  32.275   2.769 -30.847
  625   2HB   ALA  85          HB2       ALA  85  30.668   2.098 -31.183
  626   3HB   ALA  85          HB3       ALA  85  30.829   3.714 -30.450
  627    H    ALA  86           H        ALA  86  30.441   3.785 -27.239
  628    HA   ALA  86           HA       ALA  86  33.165   4.795 -26.687
  629   1HB   ALA  86          HB1       ALA  86  31.256   6.390 -26.891
  630   2HB   ALA  86          HB2       ALA  86  30.511   5.656 -25.461
  631   3HB   ALA  86          HB3       ALA  86  32.080   6.462 -25.321
  632    H    ASP  87           H        ASP  87  30.427   3.260 -25.004
  633    HA   ASP  87           HA       ASP  87  30.219   2.165 -23.041
  634   1HB   ASP  87          HB2       ASP  87  30.935   0.410 -24.501
  635   2HB   ASP  87          HB3       ASP  87  32.641   0.718 -24.137
  636    H    LYS  88           H        LYS  88  31.651   4.645 -22.705
  637    HA   LYS  88           HA       LYS  88  33.718   4.396 -20.775
  638   1HB   LYS  88          HB2       LYS  88  31.682   6.625 -21.194
  639   2HB   LYS  88          HB3       LYS  88  33.100   6.730 -20.142
  640   1HG   LYS  88          HG2       LYS  88  34.609   6.411 -22.046
  641   2HG   LYS  88          HG3       LYS  88  33.247   6.140 -23.132
  642   1HD   LYS  88          HD2       LYS  88  34.055   8.359 -23.480
  643   2HD   LYS  88          HD3       LYS  88  32.447   8.449 -22.748
  644   1HE   LYS  88          HE2       LYS  88  33.467   8.911 -20.533
  645   2HE   LYS  88          HE3       LYS  88  35.084   8.720 -21.223
  646   1HZ   LYS  88          HZ1       LYS  88  33.158  10.840 -21.992
  647   2HZ   LYS  88          HZ2       LYS  88  34.464  11.045 -21.038
  648   3HZ   LYS  88          HZ3       LYS  88  34.663  10.661 -22.606
  649    H    CYS  89           H        CYS  89  30.276   4.084 -20.520
  650    HA   CYS  89           HA       CYS  89  28.790   3.695 -19.045
  651   1HB   CYS  89          HB2       CYS  89  30.074   1.540 -19.446
  652   2HB   CYS  89          HB3       CYS  89  30.639   1.705 -17.780
  653    HA   PRO  90           HA       PRO  90  29.589   6.464 -15.581
  654   1HB   PRO  90          HB2       PRO  90  27.037   6.402 -14.483
  655   2HB   PRO  90          HB3       PRO  90  27.590   7.504 -15.770
  656   1HG   PRO  90          HG2       PRO  90  26.145   4.873 -16.010
  657   2HG   PRO  90          HG3       PRO  90  25.822   6.393 -16.920
  658   1HD   PRO  90          HD2       PRO  90  27.151   4.321 -17.990
  659   2HD   PRO  90          HD3       PRO  90  27.705   5.992 -18.323
  660    H    MET  91           H        MET  91  30.067   6.149 -13.388
  661    HA   MET  91           HA       MET  91  29.934   3.494 -12.249
  662   1HB   MET  91          HB2       MET  91  30.801   6.188 -11.112
  663   2HB   MET  91          HB3       MET  91  30.921   4.647 -10.252
  664   1HG   MET  91          HG2       MET  91  32.363   3.749 -12.063
  665   2HG   MET  91          HG3       MET  91  32.337   5.319 -12.863
  666   1HE   MET  91          HE1       MET  91  34.444   7.595 -10.501
  667   2HE   MET  91          HE2       MET  91  33.573   7.459 -12.043
  668   3HE   MET  91          HE3       MET  91  32.675   7.461 -10.506
  669    H    THR  92           H        THR  92  28.785   3.013 -10.306
  670    HA   THR  92           HA       THR  92  26.428   4.664  -9.606
  671    HB   THR  92           HB       THR  92  25.367   2.382  -9.314
  672    HG1  THR  92           HG1      THR  92  27.133   1.061  -9.150
  673   1HG2  THR  92          HG21      THR  92  26.439   2.793 -12.140
  674   2HG2  THR  92          HG22      THR  92  24.927   1.990 -11.669
  675   3HG2  THR  92          HG23      THR  92  25.108   3.742 -11.454
  676    HA   PRO  93           HA       PRO  93  28.033   4.039  -5.465
  677   1HB   PRO  93          HB2       PRO  93  25.858   3.916  -3.829
  678   2HB   PRO  93          HB3       PRO  93  26.306   5.410  -4.709
  679   1HG   PRO  93          HG2       PRO  93  24.258   3.334  -5.462
  680   2HG   PRO  93          HG3       PRO  93  24.073   5.103  -5.462
  681   1HD   PRO  93          HD2       PRO  93  24.652   3.630  -7.710
  682   2HD   PRO  93          HD3       PRO  93  25.207   5.316  -7.505
  683    HA   PRO  94           HA       PRO  94  28.061  -0.363  -4.916
  684   1HB   PRO  94          HB2       PRO  94  28.872  -0.756  -2.345
  685   2HB   PRO  94          HB3       PRO  94  29.925  -0.006  -3.584
  686   1HG   PRO  94          HG2       PRO  94  28.242   1.378  -1.482
  687   2HG   PRO  94          HG3       PRO  94  29.954   1.689  -1.910
  688   1HD   PRO  94          HD2       PRO  94  27.847   3.167  -2.902
  689   2HD   PRO  94          HD3       PRO  94  29.347   2.879  -3.843
  690    H    HIS  95           H        HIS  95  25.983   1.524  -2.783
  691    HA   HIS  95           HA       HIS  95  24.827  -0.658  -1.377
  692   1HB   HIS  95          HB2       HIS  95  23.722   2.152  -1.773
  693   2HB   HIS  95          HB3       HIS  95  23.306   1.031  -0.480
  694    HD1  HIS  95           HD1      HIS  95  25.846   0.272   0.941
  695    HD2  HIS  95           HD2      HIS  95  25.337   4.000  -0.952
  696    HE1  HIS  95           HE1      HIS  95  27.567   1.838   1.969
  697    H    VAL  96           H        VAL  96  23.929   0.881  -4.454
  698    HA   VAL  96           HA       VAL  96  21.186  -0.040  -4.292
  699    HB   VAL  96           HB       VAL  96  20.950   0.962  -6.497
  700   1HG1  VAL  96          HG11      VAL  96  22.344   2.788  -4.510
  701   2HG1  VAL  96          HG12      VAL  96  21.255   3.264  -5.834
  702   3HG1  VAL  96          HG13      VAL  96  20.642   2.304  -4.491
  703   1HG2  VAL  96          HG21      VAL  96  23.929   1.404  -6.442
  704   2HG2  VAL  96          HG22      VAL  96  22.952   0.570  -7.651
  705   3HG2  VAL  96          HG23      VAL  96  22.805   2.320  -7.473
  706    H    LYS  97           H        LYS  97  20.198  -1.470  -5.753
  707    HA   LYS  97           HA       LYS  97  21.732  -3.805  -6.599
  708   1HB   LYS  97          HB2       LYS  97  19.372  -3.821  -5.693
  709   2HB   LYS  97          HB3       LYS  97  18.864  -2.912  -7.132
  710   1HG   LYS  97          HG2       LYS  97  19.359  -4.773  -8.579
  711   2HG   LYS  97          HG3       LYS  97  20.164  -5.643  -7.269
  712   1HD   LYS  97          HD2       LYS  97  17.956  -6.559  -7.684
  713   2HD   LYS  97          HD3       LYS  97  18.079  -5.912  -6.055
  714   1HE   LYS  97          HE2       LYS  97  16.796  -4.319  -8.321
  715   2HE   LYS  97          HE3       LYS  97  15.908  -5.556  -7.436
  716   1HZ   LYS  97          HZ1       LYS  97  15.471  -3.460  -6.406
  717   2HZ   LYS  97          HZ2       LYS  97  16.391  -4.320  -5.371
  718   3HZ   LYS  97          HZ3       LYS  97  17.025  -3.078  -6.256
  719    H    ARG  98           H        ARG  98  22.246  -4.202  -8.820
  720    HA   ARG  98           HA       ARG  98  21.659  -2.030 -10.726
  721   1HB   ARG  98          HB2       ARG  98  23.854  -1.559  -9.730
  722   2HB   ARG  98          HB3       ARG  98  24.442  -3.142 -10.263
  723   1HG   ARG  98          HG2       ARG  98  24.189  -2.499 -12.609
  724   2HG   ARG  98          HG3       ARG  98  23.409  -0.962 -12.151
  725   1HD   ARG  98          HD2       ARG  98  25.429  -0.162 -11.144
  726   2HD   ARG  98          HD3       ARG  98  26.228  -1.733 -11.324
  727    HE   ARG  98           HE       ARG  98  25.395  -0.851 -13.899
  728   1HH1  ARG  98          HH21      ARG  98  27.672   0.369 -11.475
  729   2HH1  ARG  98          HH22      ARG  98  29.002   0.484 -12.582
  730   1HH2  ARG  98          HH11      ARG  98  27.004  -0.478 -15.365
  731   2HH2  ARG  98          HH12      ARG  98  28.584   0.096 -14.904
  732    H    GLU  99           H        GLU  99  21.591  -2.624 -12.876
  733    HA   GLU  99           HA       GLU  99  21.956  -5.481 -13.641
  734   1HB   GLU  99          HB2       GLU  99  19.668  -3.555 -14.086
  735   2HB   GLU  99          HB3       GLU  99  20.085  -4.645 -15.392
  736   1HG   GLU  99          HG2       GLU  99  19.559  -5.706 -12.602
  737   2HG   GLU  99          HG3       GLU  99  18.248  -5.351 -13.726
  738    H    HIS 100           H        HIS 100  22.576  -5.680 -15.915
  739    HA   HIS 100           HA       HIS 100  23.751  -3.250 -17.154
  740   1HB   HIS 100          HB2       HIS 100  25.579  -4.313 -15.994
  741   2HB   HIS 100          HB3       HIS 100  25.108  -5.907 -16.587
  742    HD1  HIS 100           HD1      HIS 100  26.656  -2.623 -17.966
  743    HD2  HIS 100           HD2      HIS 100  25.997  -6.667 -18.942
  744    HE1  HIS 100           HE1      HIS 100  27.957  -3.066 -20.105
  745    H    TRP 101           H        TRP 101  22.734  -3.046 -19.012
  746    HA   TRP 101           HA       TRP 101  21.796  -5.430 -20.562
  747   1HB   TRP 101          HB2       TRP 101  20.466  -2.717 -20.176
  748   2HB   TRP 101          HB3       TRP 101  19.931  -3.952 -21.296
  749    HD1  TRP 101           HD1      TRP 101  20.654  -5.567 -18.014
  750    HE1  TRP 101           HE1      TRP 101  18.549  -5.949 -16.689
  751    HE3  TRP 101           HE3      TRP 101  17.413  -2.882 -20.935
  752    HZ2  TRP 101           HZ2      TRP 101  15.757  -5.155 -16.824
  753    HZ3  TRP 101           HZ3      TRP 101  14.998  -2.818 -20.362
  754    HH2  TRP 101           HH2      TRP 101  14.175  -3.923 -18.282
  755    H    GLY 102           H        GLY 102  24.316  -4.802 -21.204
  756   1HA   GLY 102          HA1       GLY 102  24.679  -2.416 -22.692
  757   2HA   GLY 102          HA2       GLY 102  25.751  -3.822 -22.671
  758    H    PHE 103           H        PHE 103  24.041  -1.917 -24.684
  759    HA   PHE 103           HA       PHE 103  24.433  -3.710 -26.898
  760   1HB   PHE 103          HB2       PHE 103  22.062  -2.964 -27.810
  761   2HB   PHE 103          HB3       PHE 103  22.274  -4.424 -26.874
  762    HD1  PHE 103           HD1      PHE 103  21.578  -0.764 -26.193
  763    HD2  PHE 103           HD2      PHE 103  20.665  -4.880 -25.267
  764    HE1  PHE 103           HE1      PHE 103  19.978  -0.033 -24.450
  765    HE2  PHE 103           HE2      PHE 103  19.043  -4.134 -23.551
  766    HZ   PHE 103           HZ       PHE 103  18.778  -1.710 -23.063
  767    H    ASP 104           H        ASP 104  24.238  -2.366 -28.942
  768    HA   ASP 104           HA       ASP 104  25.799  -0.072 -28.470
  769   1HB   ASP 104          HB2       ASP 104  26.058  -1.558 -30.442
  770   2HB   ASP 104          HB3       ASP 104  24.515  -0.960 -31.066
  771    H    ASP 105           H        ASP 105  25.458   2.067 -29.047
  772    HA   ASP 105           HA       ASP 105  22.797   3.052 -28.348
  773   1HB   ASP 105          HB2       ASP 105  24.966   4.228 -27.710
  774   2HB   ASP 105          HB3       ASP 105  25.084   4.754 -29.387
  775    HA   PRO 106           HA       PRO 106  21.607   2.773 -32.624
  776   1HB   PRO 106          HB2       PRO 106  19.258   4.230 -32.591
  777   2HB   PRO 106          HB3       PRO 106  19.413   2.536 -32.058
  778   1HG   PRO 106          HG2       PRO 106  19.402   5.023 -30.356
  779   2HG   PRO 106          HG3       PRO 106  18.571   3.469 -30.045
  780   1HD   PRO 106          HD2       PRO 106  20.942   4.150 -28.878
  781   2HD   PRO 106          HD3       PRO 106  20.607   2.461 -29.355
  782    H    ALA 107           H        ALA 107  22.108   5.919 -31.069
  783    HA   ALA 107           HA       ALA 107  22.027   7.433 -33.517
  784   1HB   ALA 107          HB1       ALA 107  23.500   8.045 -30.923
  785   2HB   ALA 107          HB2       ALA 107  23.165   9.183 -32.240
  786   3HB   ALA 107          HB3       ALA 107  21.823   8.509 -31.303
  787    H    ARG 108           H        ARG 108  24.258   5.077 -32.334
  788    HA   ARG 108           HA       ARG 108  26.489   6.190 -33.980
  789   1HB   ARG 108          HB2       ARG 108  26.589   4.158 -31.709
  790   2HB   ARG 108          HB3       ARG 108  27.963   4.792 -32.619
  791   1HG   ARG 108          HG2       ARG 108  27.334   7.122 -31.805
  792   2HG   ARG 108          HG3       ARG 108  26.115   6.367 -30.777
  793   1HD   ARG 108          HD2       ARG 108  27.984   6.723 -29.377
  794   2HD   ARG 108          HD3       ARG 108  27.987   4.998 -29.714
  795    HE   ARG 108           HE       ARG 108  29.697   5.477 -31.494
  796   1HH1  ARG 108          HH21      ARG 108  29.411   7.758 -28.780
  797   2HH1  ARG 108          HH22      ARG 108  31.037   8.318 -28.907
  798   1HH2  ARG 108          HH11      ARG 108  31.865   6.209 -31.635
  799   2HH2  ARG 108          HH12      ARG 108  32.456   7.401 -30.546
  800    H    ALA 109           H        ALA 109  23.983   4.087 -34.348
  801    HA   ALA 109           HA       ALA 109  25.239   1.843 -35.611
  802   1HB   ALA 109          HB1       ALA 109  22.380   2.896 -35.734
  803   2HB   ALA 109          HB2       ALA 109  22.926   1.299 -36.273
  804   3HB   ALA 109          HB3       ALA 109  23.023   1.733 -34.553
  805    H    GLN 110           H        GLN 110  26.619   3.702 -36.724
  806    HA   GLN 110           HA       GLN 110  25.611   5.306 -38.773
  807   1HB   GLN 110          HB2       GLN 110  27.994   5.684 -39.287
  808   2HB   GLN 110          HB3       GLN 110  27.644   5.755 -37.567
  809   1HG   GLN 110          HG2       GLN 110  28.415   3.154 -37.674
  810   2HG   GLN 110          HG3       GLN 110  29.255   3.729 -39.107
  811   1HE2  GLN 110          HE22      GLN 110  28.835   4.219 -35.565
  812   2HE2  GLN 110          HE21      GLN 110  30.401   4.962 -35.312
  813    H    GLY 111           H        GLY 111  25.764   5.256 -40.937
  814   1HA   GLY 111          HA1       GLY 111  26.758   3.555 -42.794
  815   2HA   GLY 111          HA2       GLY 111  25.271   2.718 -42.281
  816    H    THR 112           H        THR 112  23.444   4.569 -41.801
  817    HA   THR 112           HA       THR 112  23.460   6.951 -43.289
  818    HB   THR 112           HB       THR 112  23.104   5.660 -45.285
  819    HG1  THR 112           HG1      THR 112  21.263   6.531 -45.962
  820   1HG2  THR 112          HG21      THR 112  22.403   3.488 -44.424
  821   2HG2  THR 112          HG22      THR 112  20.871   4.179 -43.854
  822   3HG2  THR 112          HG23      THR 112  21.217   4.079 -45.590
  823    H    GLU 113           H        GLU 113  21.237   8.007 -43.049
  824    HA   GLU 113           HA       GLU 113  20.463   7.848 -40.300
  825   1HB   GLU 113          HB2       GLU 113  18.769   9.493 -40.875
  826   2HB   GLU 113          HB3       GLU 113  20.331   9.920 -41.570
  827   1HG   GLU 113          HG2       GLU 113  19.566   9.026 -43.786
  828   2HG   GLU 113          HG3       GLU 113  17.989   8.670 -43.077
  829    H    GLU 114           H        GLU 114  19.276   6.266 -43.229
  830    HA   GLU 114           HA       GLU 114  16.823   5.289 -42.136
  831   1HB   GLU 114          HB2       GLU 114  17.476   5.414 -44.582
  832   2HB   GLU 114          HB3       GLU 114  18.572   4.063 -44.302
  833   1HG   GLU 114          HG2       GLU 114  16.650   3.087 -45.216
  834   2HG   GLU 114          HG3       GLU 114  16.536   2.728 -43.500
  835    H    GLU 115           H        GLU 115  20.163   4.068 -42.153
  836    HA   GLU 115           HA       GLU 115  19.569   1.492 -41.038
  837   1HB   GLU 115          HB2       GLU 115  21.622   2.067 -42.392
  838   2HB   GLU 115          HB3       GLU 115  22.192   3.050 -41.047
  839   1HG   GLU 115          HG2       GLU 115  23.330   0.984 -40.914
  840   2HG   GLU 115          HG3       GLU 115  22.171   0.993 -39.592
  841    H    LYS 116           H        LYS 116  20.810   4.611 -39.725
  842    HA   LYS 116           HA       LYS 116  20.870   3.892 -36.998
  843   1HB   LYS 116          HB2       LYS 116  20.366   6.544 -38.409
  844   2HB   LYS 116          HB3       LYS 116  20.408   6.393 -36.639
  845   1HG   LYS 116          HG2       LYS 116  22.707   5.358 -36.865
  846   2HG   LYS 116          HG3       LYS 116  22.659   5.773 -38.594
  847   1HD   LYS 116          HD2       LYS 116  22.305   8.187 -37.927
  848   2HD   LYS 116          HD3       LYS 116  22.476   7.690 -36.228
  849   1HE   LYS 116          HE2       LYS 116  24.743   6.669 -36.929
  850   2HE   LYS 116          HE3       LYS 116  24.553   7.560 -38.450
  851   1HZ   LYS 116          HZ1       LYS 116  24.735   8.687 -35.717
  852   2HZ   LYS 116          HZ2       LYS 116  25.838   8.856 -36.909
  853   3HZ   LYS 116          HZ3       LYS 116  24.395   9.606 -37.047
  854    H    TRP 117           H        TRP 117  18.120   5.345 -38.853
  855    HA   TRP 117           HA       TRP 117  16.303   5.368 -36.717
  856   1HB   TRP 117          HB2       TRP 117  15.870   6.623 -38.695
  857   2HB   TRP 117          HB3       TRP 117  15.987   5.197 -39.718
  858    HD1  TRP 117           HD1      TRP 117  13.778   4.764 -40.747
  859    HE1  TRP 117           HE1      TRP 117  11.389   4.423 -39.964
  860    HE3  TRP 117           HE3      TRP 117  14.344   6.102 -35.836
  861    HZ2  TRP 117           HZ2      TRP 117   9.863   4.727 -37.515
  862    HZ3  TRP 117           HZ3      TRP 117  12.454   5.923 -34.283
  863    HH2  TRP 117           HH2      TRP 117  10.200   5.208 -35.095
  864    H    ALA 118           H        ALA 118  17.049   2.674 -39.008
  865    HA   ALA 118           HA       ALA 118  14.977   0.972 -38.010
  866   1HB   ALA 118          HB1       ALA 118  16.037   0.622 -40.188
  867   2HB   ALA 118          HB2       ALA 118  17.596   0.278 -39.397
  868   3HB   ALA 118          HB3       ALA 118  16.215  -0.815 -39.159
  869    H    PHE 119           H        PHE 119  18.396   1.453 -37.102
  870    HA   PHE 119           HA       PHE 119  18.429  -0.579 -35.126
  871   1HB   PHE 119          HB2       PHE 119  20.357   0.882 -36.264
  872   2HB   PHE 119          HB3       PHE 119  20.175   1.834 -34.802
  873    HD1  PHE 119           HD1      PHE 119  21.324  -1.316 -36.288
  874    HD2  PHE 119           HD2      PHE 119  20.630   0.717 -32.551
  875    HE1  PHE 119           HE1      PHE 119  22.751  -2.972 -35.114
  876    HE2  PHE 119           HE2      PHE 119  22.061  -0.928 -31.384
  877    HZ   PHE 119           HZ       PHE 119  23.128  -2.781 -32.661
  878    H    PHE 120           H        PHE 120  17.447   2.849 -34.960
  879    HA   PHE 120           HA       PHE 120  17.049   2.975 -32.132
  880   1HB   PHE 120          HB2       PHE 120  15.846   4.461 -34.483
  881   2HB   PHE 120          HB3       PHE 120  15.063   4.575 -32.927
  882    HD1  PHE 120           HD1      PHE 120  17.931   5.696 -34.890
  883    HD2  PHE 120           HD2      PHE 120  16.201   5.536 -30.945
  884    HE1  PHE 120           HE1      PHE 120  19.566   7.378 -34.117
  885    HE2  PHE 120           HE2      PHE 120  17.803   7.278 -30.194
  886    HZ   PHE 120           HZ       PHE 120  19.486   8.187 -31.768
  887    H    GLN 121           H        GLN 121  14.774   1.892 -34.720
  888    HA   GLN 121           HA       GLN 121  12.698   1.206 -32.858
  889   1HB   GLN 121          HB2       GLN 121  13.339   0.301 -35.689
  890   2HB   GLN 121          HB3       GLN 121  11.909  -0.262 -34.816
  891   1HG   GLN 121          HG2       GLN 121  10.910   1.860 -34.777
  892   2HG   GLN 121          HG3       GLN 121  12.436   2.712 -35.029
  893   1HE2  GLN 121          HE22      GLN 121  13.391   2.807 -37.080
  894   2HE2  GLN 121          HE21      GLN 121  12.482   2.474 -38.532
  895    H    ARG 122           H        ARG 122  15.462  -0.727 -34.161
  896    HA   ARG 122           HA       ARG 122  14.679  -3.161 -32.881
  897   1HB   ARG 122          HB2       ARG 122  17.368  -2.029 -33.762
  898   2HB   ARG 122          HB3       ARG 122  17.275  -3.567 -32.938
  899   1HG   ARG 122          HG2       ARG 122  15.782  -2.938 -35.525
  900   2HG   ARG 122          HG3       ARG 122  17.359  -3.723 -35.445
  901   1HD   ARG 122          HD2       ARG 122  14.771  -4.812 -34.260
  902   2HD   ARG 122          HD3       ARG 122  15.563  -5.386 -35.720
  903    HE   ARG 122           HE       ARG 122  16.478  -5.737 -32.896
  904   1HH1  ARG 122          HH21      ARG 122  17.088  -6.540 -36.321
  905   2HH1  ARG 122          HH22      ARG 122  18.272  -7.735 -35.936
  906   1HH2  ARG 122          HH11      ARG 122  17.950  -7.172 -32.416
  907   2HH2  ARG 122          HH12      ARG 122  18.790  -8.150 -33.608
  908    H    VAL 123           H        VAL 123  16.885  -0.550 -31.659
  909    HA   VAL 123           HA       VAL 123  17.307  -1.923 -29.177
  910    HB   VAL 123           HB       VAL 123  17.692   0.961 -30.087
  911   1HG1  VAL 123          HG11      VAL 123  17.480   1.023 -27.646
  912   2HG1  VAL 123          HG12      VAL 123  18.651  -0.305 -27.483
  913   3HG1  VAL 123          HG13      VAL 123  19.156   1.273 -28.128
  914   1HG2  VAL 123          HG21      VAL 123  19.149  -0.794 -31.153
  915   2HG2  VAL 123          HG22      VAL 123  20.072   0.337 -30.160
  916   3HG2  VAL 123          HG23      VAL 123  19.702  -1.283 -29.544
  917    H    ARG 124           H        ARG 124  14.880   0.521 -30.228
  918    HA   ARG 124           HA       ARG 124  13.613   1.003 -27.756
  919   1HB   ARG 124          HB2       ARG 124  13.096   2.224 -29.813
  920   2HB   ARG 124          HB3       ARG 124  12.574   0.761 -30.610
  921   1HG   ARG 124          HG2       ARG 124  10.841   0.883 -28.425
  922   2HG   ARG 124          HG3       ARG 124  11.092   2.570 -28.839
  923   1HD   ARG 124          HD2       ARG 124   9.191   1.842 -30.062
  924   2HD   ARG 124          HD3       ARG 124  10.510   1.989 -31.230
  925    HE   ARG 124           HE       ARG 124  10.159  -0.707 -30.132
  926   1HH1  ARG 124          HH21      ARG 124   9.151   1.530 -32.680
  927   2HH1  ARG 124          HH22      ARG 124   8.533   0.294 -33.721
  928   1HH2  ARG 124          HH11      ARG 124   9.125  -2.373 -31.447
  929   2HH2  ARG 124          HH12      ARG 124   8.554  -1.937 -33.011
  930    H    ASP 125           H        ASP 125  12.888  -1.531 -30.230
  931    HA   ASP 125           HA       ASP 125  10.765  -2.630 -28.725
  932   1HB   ASP 125          HB2       ASP 125  11.383  -2.900 -31.242
  933   2HB   ASP 125          HB3       ASP 125  12.403  -4.240 -30.719
  934    H    GLU 126           H        GLU 126  14.224  -3.599 -28.949
  935    HA   GLU 126           HA       GLU 126  13.938  -5.918 -27.332
  936   1HB   GLU 126          HB2       GLU 126  16.316  -4.226 -28.142
  937   2HB   GLU 126          HB3       GLU 126  16.463  -5.688 -27.144
  938   1HG   GLU 126          HG2       GLU 126  15.455  -7.071 -28.864
  939   2HG   GLU 126          HG3       GLU 126  15.074  -5.672 -29.859
  940    H    ILE 127           H        ILE 127  14.764  -2.518 -26.484
  941    HA   ILE 127           HA       ILE 127  15.172  -2.954 -23.683
  942    HB   ILE 127           HB       ILE 127  14.280  -0.590 -25.371
  943   1HG1  ILE 127          HG12      ILE 127  16.753  -1.065 -23.652
  944   2HG1  ILE 127          HG13      ILE 127  16.695  -1.391 -25.380
  945   1HG2  ILE 127          HG21      ILE 127  14.722  -0.498 -22.359
  946   2HG2  ILE 127          HG22      ILE 127  14.411   0.875 -23.452
  947   3HG2  ILE 127          HG23      ILE 127  13.152  -0.308 -23.172
  948   1HD1  ILE 127          HD11      ILE 127  16.103   1.070 -25.720
  949   2HD1  ILE 127          HD12      ILE 127  16.521   1.311 -24.008
  950   3HD1  ILE 127          HD13      ILE 127  17.747   0.729 -25.135
  951    H    GLY 128           H        GLY 128  12.211  -2.120 -25.577
  952   1HA   GLY 128          HA1       GLY 128  10.362  -2.062 -23.503
  953   2HA   GLY 128          HA2       GLY 128  10.006  -2.560 -25.170
  954    H    ASN 129           H        ASN 129  11.486  -4.925 -25.369
  955    HA   ASN 129           HA       ASN 129   9.793  -6.810 -24.105
  956   1HB   ASN 129          HB2       ASN 129  12.473  -7.083 -25.510
  957   2HB   ASN 129          HB3       ASN 129  11.764  -8.451 -24.671
  958   1HD2  ASN 129          HD22      ASN 129  11.186  -6.147 -27.351
  959   2HD2  ASN 129          HD21      ASN 129  10.096  -7.191 -28.216
  960    H    ARG 130           H        ARG 130  13.160  -5.855 -23.202
  961    HA   ARG 130           HA       ARG 130  13.019  -7.678 -20.935
  962   1HB   ARG 130          HB2       ARG 130  15.055  -5.708 -21.917
  963   2HB   ARG 130          HB3       ARG 130  15.050  -6.029 -20.192
  964   1HG   ARG 130          HG2       ARG 130  15.324  -8.149 -22.332
  965   2HG   ARG 130          HG3       ARG 130  16.623  -7.480 -21.353
  966   1HD   ARG 130          HD2       ARG 130  14.303  -9.216 -20.389
  967   2HD   ARG 130          HD3       ARG 130  15.993  -9.663 -20.475
  968    HE   ARG 130           HE       ARG 130  14.636  -8.215 -18.371
  969   1HH1  ARG 130          HH21      ARG 130  17.858  -8.520 -19.853
  970   2HH1  ARG 130          HH22      ARG 130  18.696  -8.196 -18.379
  971   1HH2  ARG 130          HH11      ARG 130  15.766  -8.020 -16.393
  972   2HH2  ARG 130          HH12      ARG 130  17.495  -7.807 -16.390
  973    H    LEU 131           H        LEU 131  12.075  -4.280 -21.367
  974    HA   LEU 131           HA       LEU 131  11.870  -3.787 -18.560
  975   1HB   LEU 131          HB2       LEU 131  11.384  -2.262 -20.910
  976   2HB   LEU 131          HB3       LEU 131   9.841  -2.388 -20.114
  977    HG   LEU 131           HG       LEU 131  10.780  -0.447 -19.302
  978   1HD1  LEU 131          HD11      LEU 131  11.035  -0.721 -16.900
  979   2HD1  LEU 131          HD12      LEU 131   9.796  -1.845 -17.485
  980   3HD1  LEU 131          HD13      LEU 131  11.430  -2.412 -17.083
  981   1HD2  LEU 131          HD21      LEU 131  13.115  -0.938 -20.073
  982   2HD2  LEU 131          HD22      LEU 131  12.994  -0.083 -18.541
  983   3HD2  LEU 131          HD23      LEU 131  13.369  -1.815 -18.547
  984    H    LYS 132           H        LYS 132   9.592  -5.070 -21.030
  985    HA   LYS 132           HA       LYS 132   7.356  -5.392 -19.354
  986   1HB   LYS 132          HB2       LYS 132   7.371  -5.672 -21.839
  987   2HB   LYS 132          HB3       LYS 132   8.254  -7.184 -21.659
  988   1HG   LYS 132          HG2       LYS 132   6.408  -8.190 -20.412
  989   2HG   LYS 132          HG3       LYS 132   5.513  -6.653 -20.445
  990   1HD   LYS 132          HD2       LYS 132   5.443  -6.745 -22.928
  991   2HD   LYS 132          HD3       LYS 132   6.332  -8.283 -22.896
  992   1HE   LYS 132          HE2       LYS 132   4.496  -9.313 -21.567
  993   2HE   LYS 132          HE3       LYS 132   3.611  -7.782 -21.599
  994   1HZ   LYS 132          HZ1       LYS 132   4.289  -9.406 -23.985
  995   2HZ   LYS 132          HZ2       LYS 132   2.818  -9.298 -23.297
  996   3HZ   LYS 132          HZ3       LYS 132   3.469  -7.990 -24.014
  997    H    GLU 133           H        GLU 133   9.996  -7.704 -20.095
  998    HA   GLU 133           HA       GLU 133   8.977  -9.660 -18.329
  999   1HB   GLU 133          HB2       GLU 133  11.841  -9.320 -19.284
 1000   2HB   GLU 133          HB3       GLU 133  11.182 -10.717 -18.404
 1001   1HG   GLU 133          HG2       GLU 133   9.470 -11.002 -20.205
 1002   2HG   GLU 133          HG3       GLU 133  10.269  -9.732 -21.130
 1003    H    PHE 134           H        PHE 134  11.251  -6.988 -17.700
 1004    HA   PHE 134           HA       PHE 134  11.944  -7.783 -15.079
 1005   1HB   PHE 134          HB2       PHE 134  13.222  -6.073 -16.169
 1006   2HB   PHE 134          HB3       PHE 134  11.792  -5.109 -16.502
 1007    HD1  PHE 134           HD1      PHE 134  13.714  -6.495 -13.570
 1008    HD2  PHE 134           HD2      PHE 134  11.233  -3.321 -15.110
 1009    HE1  PHE 134           HE1      PHE 134  13.990  -5.235 -11.450
 1010    HE2  PHE 134           HE2      PHE 134  11.578  -2.025 -13.036
 1011    HZ   PHE 134           HZ       PHE 134  12.960  -2.988 -11.194
 1012    H    ALA 135           H        ALA 135   9.116  -6.039 -16.326
 1013    HA   ALA 135           HA       ALA 135   8.196  -5.371 -13.664
 1014   1HB   ALA 135          HB1       ALA 135   6.232  -4.457 -14.869
 1015   2HB   ALA 135          HB2       ALA 135   7.738  -3.940 -15.660
 1016   3HB   ALA 135          HB3       ALA 135   6.768  -5.248 -16.366
 1017    H    GLU 136           H        GLU 136   7.477  -7.815 -16.115
 1018    HA   GLU 136           HA       GLU 136   5.121  -8.807 -14.750
 1019   1HB   GLU 136          HB2       GLU 136   5.213  -8.592 -17.198
 1020   2HB   GLU 136          HB3       GLU 136   6.610  -9.661 -17.265
 1021   1HG   GLU 136          HG2       GLU 136   4.731 -10.928 -17.958
 1022   2HG   GLU 136          HG3       GLU 136   5.209 -11.541 -16.387
 1023    H    THR 137           H        THR 137   8.356 -10.041 -15.567
 1024    HA   THR 137           HA       THR 137   7.797 -12.539 -14.087
 1025    HB   THR 137           HB       THR 137   9.341 -13.633 -15.470
 1026    HG1  THR 137           HG1      THR 137  10.106 -11.040 -16.283
 1027   1HG2  THR 137          HG21      THR 137   7.129 -13.170 -16.540
 1028   2HG2  THR 137          HG22      THR 137   7.857 -11.751 -17.340
 1029   3HG2  THR 137          HG23      THR 137   8.466 -13.375 -17.690
 1030    H    GLY 138           H        GLY 138   9.758  -9.655 -13.983
 1031   1HA   GLY 138          HA1       GLY 138  11.030  -8.906 -12.188
 1032   2HA   GLY 138          HA2       GLY 138  10.947 -10.499 -11.434
 1033    H    LYS 139           H        LYS 139  11.919 -10.437 -14.823
 1034    HA   LYS 139           HA       LYS 139  14.483 -11.581 -14.182
 1035   1HB   LYS 139          HB2       LYS 139  13.123 -10.697 -16.745
 1036   2HB   LYS 139          HB3       LYS 139  14.804 -11.256 -16.726
 1037   1HG   LYS 139          HG2       LYS 139  14.150 -13.430 -15.815
 1038   2HG   LYS 139          HG3       LYS 139  12.478 -12.896 -15.636
 1039   1HD   LYS 139          HD2       LYS 139  12.546 -12.438 -18.193
 1040   2HD   LYS 139          HD3       LYS 139  14.033 -13.404 -18.200
 1041   1HE   LYS 139          HE2       LYS 139  12.725 -15.290 -17.154
 1042   2HE   LYS 139          HE3       LYS 139  11.278 -14.263 -17.206
 1043   1HZ   LYS 139          HZ1       LYS 139  11.274 -15.687 -19.107
 1044   2HZ   LYS 139          HZ2       LYS 139  11.580 -14.164 -19.653
 1045   3HZ   LYS 139          HZ3       LYS 139  12.787 -15.266 -19.544
  Start of MODEL   17
    1   1H    MET   1           H1       MET   1   3.233   2.347   3.876
    2   2H    MET   1           H2       MET   1   2.695   3.880   3.754
    3   3H    MET   1           H3       MET   1   1.625   2.630   3.733
    4    HA   MET   1           HA       MET   1   2.566   1.806   1.693
    5   1HB   MET   1          HB2       MET   1   1.650   3.421   0.155
    6   2HB   MET   1          HB3       MET   1   0.592   3.253   1.547
    7   1HG   MET   1          HG2       MET   1   1.437   5.403   2.460
    8   2HG   MET   1          HG3       MET   1   2.573   5.530   1.117
    9   1HE   MET   1          HE1       MET   1  -1.124   5.850   2.320
   10   2HE   MET   1          HE2       MET   1  -2.017   6.131   0.811
   11   3HE   MET   1          HE3       MET   1  -1.343   4.525   1.150
   12    H    GLU   2           H        GLU   2   3.913   2.270  -0.236
   13    HA   GLU   2           HA       GLU   2   6.032   4.233  -0.025
   14   1HB   GLU   2          HB2       GLU   2   7.869   2.623  -0.168
   15   2HB   GLU   2          HB3       GLU   2   6.996   2.435   1.347
   16   1HG   GLU   2          HG2       GLU   2   5.806   0.448   0.418
   17   2HG   GLU   2          HG3       GLU   2   6.675   0.647  -1.106
   18    H    ASN   3           H        ASN   3   7.489   3.913  -2.093
   19    HA   ASN   3           HA       ASN   3   6.105   2.698  -4.385
   20   1HB   ASN   3          HB2       ASN   3   5.368   5.182  -3.979
   21   2HB   ASN   3          HB3       ASN   3   7.018   5.612  -4.431
   22   1HD2  ASN   3          HD22      ASN   3   7.723   5.003  -6.697
   23   2HD2  ASN   3          HD21      ASN   3   6.424   4.945  -7.907
   24    H    LYS   4           H        LYS   4   7.753   2.121  -5.969
   25    HA   LYS   4           HA       LYS   4  10.507   2.097  -4.889
   26   1HB   LYS   4          HB2       LYS   4   9.150   0.916  -7.360
   27   2HB   LYS   4          HB3       LYS   4  10.894   0.950  -7.208
   28   1HG   LYS   4          HG2       LYS   4  10.175  -1.191  -6.615
   29   2HG   LYS   4          HG3       LYS   4  10.780  -0.424  -5.159
   30   1HD   LYS   4          HD2       LYS   4   7.808  -0.349  -5.754
   31   2HD   LYS   4          HD3       LYS   4   8.511  -1.872  -5.245
   32   1HE   LYS   4          HE2       LYS   4   8.816   0.698  -3.636
   33   2HE   LYS   4          HE3       LYS   4   7.503  -0.459  -3.402
   34   1HZ   LYS   4          HZ1       LYS   4  10.379  -1.067  -3.045
   35   2HZ   LYS   4          HZ2       LYS   4   9.270  -0.862  -1.854
   36   3HZ   LYS   4          HZ3       LYS   4   9.156  -2.143  -2.863
   37    H    ILE   5           H        ILE   5  12.239   2.597  -6.606
   38    HA   ILE   5           HA       ILE   5  11.661   4.920  -8.292
   39    HB   ILE   5           HB       ILE   5  13.938   4.840  -6.279
   40   1HG1  ILE   5          HG12      ILE   5  12.715   7.125  -5.541
   41   2HG1  ILE   5          HG13      ILE   5  11.293   6.209  -6.015
   42   1HG2  ILE   5          HG21      ILE   5  14.420   7.162  -7.042
   43   2HG2  ILE   5          HG22      ILE   5  14.553   6.011  -8.365
   44   3HG2  ILE   5          HG23      ILE   5  13.106   7.021  -8.230
   45   1HD1  ILE   5          HD11      ILE   5  11.797   5.951  -3.619
   46   2HD1  ILE   5          HD12      ILE   5  12.027   4.384  -4.420
   47   3HD1  ILE   5          HD13      ILE   5  13.431   5.376  -4.008
   48    H    ILE   6           H        ILE   6  13.070   4.781 -10.161
   49    HA   ILE   6           HA       ILE   6  15.148   2.687 -10.137
   50    HB   ILE   6           HB       ILE   6  13.125   1.507 -10.818
   51   1HG1  ILE   6          HG12      ILE   6  14.978   1.885 -13.209
   52   2HG1  ILE   6          HG13      ILE   6  15.377   0.945 -11.766
   53   1HG2  ILE   6          HG21      ILE   6  12.945   3.401 -13.198
   54   2HG2  ILE   6          HG22      ILE   6  11.889   2.019 -12.865
   55   3HG2  ILE   6          HG23      ILE   6  11.843   3.411 -11.795
   56   1HD1  ILE   6          HD11      ILE   6  13.136   0.353 -13.739
   57   2HD1  ILE   6          HD12      ILE   6  14.631  -0.560 -13.492
   58   3HD1  ILE   6          HD13      ILE   6  13.401  -0.517 -12.208
   59    H    TYR   7           H        TYR   7  16.779   3.030 -11.705
   60    HA   TYR   7           HA       TYR   7  16.641   5.618 -13.148
   61   1HB   TYR   7          HB2       TYR   7  17.763   5.565 -10.804
   62   2HB   TYR   7          HB3       TYR   7  19.024   4.617 -11.556
   63    HD1  TYR   7           HD1      TYR   7  20.601   6.258 -10.687
   64    HD2  TYR   7           HD2      TYR   7  17.514   7.484 -13.441
   65    HE1  TYR   7           HE1      TYR   7  21.602   8.526 -10.827
   66    HE2  TYR   7           HE2      TYR   7  18.511   9.723 -13.578
   67    HH   TYR   7           HH       TYR   7  20.105  11.174 -12.691
   68    H    PHE   8           H        PHE   8  17.447   5.489 -15.188
   69    HA   PHE   8           HA       PHE   8  18.968   3.036 -16.017
   70   1HB   PHE   8          HB2       PHE   8  17.163   4.828 -17.695
   71   2HB   PHE   8          HB3       PHE   8  18.045   3.425 -18.263
   72    HD1  PHE   8           HD1      PHE   8  17.483   1.118 -17.154
   73    HD2  PHE   8           HD2      PHE   8  14.933   4.584 -16.919
   74    HE1  PHE   8           HE1      PHE   8  15.561  -0.343 -16.593
   75    HE2  PHE   8           HE2      PHE   8  13.012   3.104 -16.406
   76    HZ   PHE   8           HZ       PHE   8  13.326   0.657 -16.183
   77    H    LEU   9           H        LEU   9  20.973   3.402 -16.889
   78    HA   LEU   9           HA       LEU   9  21.828   6.242 -17.226
   79   1HB   LEU   9          HB2       LEU   9  23.247   3.891 -15.938
   80   2HB   LEU   9          HB3       LEU   9  24.001   5.444 -16.274
   81    HG   LEU   9           HG       LEU   9  21.741   4.887 -14.305
   82   1HD1  LEU   9          HD11      LEU   9  24.035   4.262 -13.595
   83   2HD1  LEU   9          HD12      LEU   9  24.586   5.921 -13.910
   84   3HD1  LEU   9          HD13      LEU   9  23.388   5.608 -12.641
   85   1HD2  LEU   9          HD21      LEU   9  22.920   7.536 -15.218
   86   2HD2  LEU   9          HD22      LEU   9  21.214   7.054 -15.182
   87   3HD2  LEU   9          HD23      LEU   9  22.061   7.330 -13.669
   88    H    CYS  10           H        CYS  10  23.152   6.728 -18.906
   89    HA   CYS  10           HA       CYS  10  24.250   4.517 -20.597
   90   1HB   CYS  10          HB2       CYS  10  22.442   6.834 -21.401
   91   2HB   CYS  10          HB3       CYS  10  23.470   6.019 -22.587
   92    HG   CYS  10           HG       CYS  10  21.733   4.205 -20.512
   93    H    THR  11           H        THR  11  25.719   5.345 -22.271
   94    HA   THR  11           HA       THR  11  27.629   7.306 -21.382
   95    HB   THR  11           HB       THR  11  28.679   6.515 -23.595
   96    HG1  THR  11           HG1      THR  11  27.582   4.420 -24.234
   97   1HG2  THR  11          HG21      THR  11  29.198   5.444 -21.398
   98   2HG2  THR  11          HG22      THR  11  27.845   4.315 -21.638
   99   3HG2  THR  11          HG23      THR  11  29.216   4.288 -22.756
  100    H    GLY  12           H        GLY  12  25.043   8.421 -21.697
  101   1HA   GLY  12          HA1       GLY  12  24.995  10.779 -22.827
  102   2HA   GLY  12          HA2       GLY  12  24.878   9.809 -24.310
  103    H    ASN  13           H        ASN  13  23.079  11.262 -21.838
  104    HA   ASN  13           HA       ASN  13  20.954   9.328 -21.624
  105   1HB   ASN  13          HB2       ASN  13  21.556  10.968 -19.837
  106   2HB   ASN  13          HB3       ASN  13  20.951  12.261 -20.872
  107   1HD2  ASN  13          HD22      ASN  13  19.260   9.019 -20.612
  108   2HD2  ASN  13          HD21      ASN  13  17.904   9.669 -19.720
  109    H    SER  14           H        SER  14  21.101   9.449 -24.289
  110    HA   SER  14           HA       SER  14  18.996  11.403 -25.149
  111   1HB   SER  14          HB2       SER  14  21.522  10.583 -26.609
  112   2HB   SER  14          HB3       SER  14  20.277  11.689 -27.222
  113    HG   SER  14           HG       SER  14  20.723  13.117 -25.634
  114    H    CYS  15           H        CYS  15  19.908   8.040 -25.251
  115    HA   CYS  15           HA       CYS  15  17.817   7.581 -27.334
  116   1HB   CYS  15          HB2       CYS  15  20.556   6.248 -27.288
  117   2HB   CYS  15          HB3       CYS  15  19.293   6.056 -28.508
  118    HG   CYS  15           HG       CYS  15  21.501   7.379 -29.191
  119    H    ARG  16           H        ARG  16  20.001   5.188 -25.885
  120    HA   ARG  16           HA       ARG  16  17.985   3.287 -25.449
  121   1HB   ARG  16          HB2       ARG  16  20.692   3.725 -24.147
  122   2HB   ARG  16          HB3       ARG  16  19.742   2.291 -23.834
  123   1HG   ARG  16          HG2       ARG  16  20.007   1.440 -25.996
  124   2HG   ARG  16          HG3       ARG  16  20.494   2.996 -26.678
  125   1HD   ARG  16          HD2       ARG  16  22.128   1.482 -24.588
  126   2HD   ARG  16          HD3       ARG  16  22.408   1.372 -26.335
  127    HE   ARG  16           HE       ARG  16  22.469   4.047 -26.020
  128   1HH1  ARG  16          HH21      ARG  16  24.255   1.585 -24.144
  129   2HH1  ARG  16          HH22      ARG  16  25.726   2.558 -24.229
  130   1HH2  ARG  16          HH11      ARG  16  24.105   5.321 -25.716
  131   2HH2  ARG  16          HH12      ARG  16  25.518   4.865 -24.772
  132    H    SER  17           H        SER  17  19.509   5.407 -22.983
  133    HA   SER  17           HA       SER  17  18.021   4.575 -20.750
  134   1HB   SER  17          HB2       SER  17  18.606   6.994 -19.982
  135   2HB   SER  17          HB3       SER  17  19.926   5.883 -20.295
  136    HG   SER  17           HG       SER  17  20.471   7.029 -22.056
  137    H    GLN  18           H        GLN  18  17.414   7.219 -23.032
  138    HA   GLN  18           HA       GLN  18  15.115   8.322 -21.815
  139   1HB   GLN  18          HB2       GLN  18  16.385   8.367 -24.569
  140   2HB   GLN  18          HB3       GLN  18  14.785   9.038 -24.380
  141   1HG   GLN  18          HG2       GLN  18  17.143   9.876 -22.643
  142   2HG   GLN  18          HG3       GLN  18  16.710  10.683 -24.147
  143   1HE2  GLN  18          HE22      GLN  18  16.657  12.322 -21.915
  144   2HE2  GLN  18          HE21      GLN  18  15.000  12.531 -21.350
  145    H    MET  19           H        MET  19  15.302   6.115 -24.612
  146    HA   MET  19           HA       MET  19  12.550   5.554 -24.818
  147   1HB   MET  19          HB2       MET  19  14.908   3.740 -25.503
  148   2HB   MET  19          HB3       MET  19  13.233   3.491 -26.010
  149   1HG   MET  19          HG2       MET  19  13.377   5.870 -27.030
  150   2HG   MET  19          HG3       MET  19  15.122   5.707 -26.859
  151   1HE   MET  19          HE1       MET  19  15.898   2.690 -29.285
  152   2HE   MET  19          HE2       MET  19  16.584   3.834 -28.105
  153   3HE   MET  19          HE3       MET  19  15.518   2.513 -27.562
  154    H    ALA  20           H        ALA  20  15.038   3.796 -22.846
  155    HA   ALA  20           HA       ALA  20  13.288   1.766 -21.922
  156   1HB   ALA  20          HB1       ALA  20  14.955   1.444 -20.125
  157   2HB   ALA  20          HB2       ALA  20  15.752   1.650 -21.697
  158   3HB   ALA  20          HB3       ALA  20  15.717   2.993 -20.530
  159    H    GLU  21           H        GLU  21  14.064   4.951 -20.466
  160    HA   GLU  21           HA       GLU  21  12.408   4.651 -18.204
  161   1HB   GLU  21          HB2       GLU  21  14.178   6.385 -18.672
  162   2HB   GLU  21          HB3       GLU  21  13.008   7.213 -19.700
  163   1HG   GLU  21          HG2       GLU  21  11.514   7.138 -17.514
  164   2HG   GLU  21          HG3       GLU  21  13.045   6.812 -16.712
  165    H    GLY  22           H        GLY  22  11.553   5.587 -21.569
  166   1HA   GLY  22          HA1       GLY  22   8.858   6.414 -21.062
  167   2HA   GLY  22          HA2       GLY  22   9.553   5.836 -22.603
  168    H    TRP  23           H        TRP  23  10.244   3.278 -22.206
  169    HA   TRP  23           HA       TRP  23   7.770   1.849 -22.217
  170   1HB   TRP  23          HB2       TRP  23  10.665   0.966 -21.889
  171   2HB   TRP  23          HB3       TRP  23   9.324  -0.166 -21.912
  172    HD1  TRP  23           HD1      TRP  23  11.613   1.602 -24.215
  173    HE1  TRP  23           HE1      TRP  23  10.977   1.189 -26.636
  174    HE3  TRP  23           HE3      TRP  23   6.982  -0.439 -23.470
  175    HZ2  TRP  23           HZ2      TRP  23   8.697   0.088 -28.110
  176    HZ3  TRP  23           HZ3      TRP  23   5.655  -1.272 -25.388
  177    HH2  TRP  23           HH2      TRP  23   6.524  -1.049 -27.704
  178    H    ALA  24           H        ALA  24  10.240   2.299 -19.669
  179    HA   ALA  24           HA       ALA  24   9.126   0.515 -17.809
  180   1HB   ALA  24          HB1       ALA  24  10.536   1.758 -16.169
  181   2HB   ALA  24          HB2       ALA  24  11.408   1.371 -17.655
  182   3HB   ALA  24          HB3       ALA  24  10.804   3.010 -17.409
  183    H    LYS  25           H        LYS  25   8.484   4.087 -18.170
  184    HA   LYS  25           HA       LYS  25   6.657   4.252 -16.026
  185   1HB   LYS  25          HB2       LYS  25   6.695   5.688 -18.707
  186   2HB   LYS  25          HB3       LYS  25   5.448   5.996 -17.491
  187   1HG   LYS  25          HG2       LYS  25   7.213   6.560 -15.821
  188   2HG   LYS  25          HG3       LYS  25   8.433   6.354 -17.088
  189   1HD   LYS  25          HD2       LYS  25   7.187   8.143 -18.434
  190   2HD   LYS  25          HD3       LYS  25   6.138   8.375 -17.028
  191   1HE   LYS  25          HE2       LYS  25   7.862  10.074 -16.963
  192   2HE   LYS  25          HE3       LYS  25   8.157   8.930 -15.645
  193   1HZ   LYS  25          HZ1       LYS  25  10.238   9.370 -16.838
  194   2HZ   LYS  25          HZ2       LYS  25   9.785   7.832 -17.134
  195   3HZ   LYS  25          HZ3       LYS  25   9.568   8.974 -18.267
  196    H    GLN  26           H        GLN  26   6.103   2.891 -19.257
  197    HA   GLN  26           HA       GLN  26   3.262   2.738 -18.909
  198   1HB   GLN  26          HB2       GLN  26   4.807   0.848 -20.707
  199   2HB   GLN  26          HB3       GLN  26   3.133   1.361 -20.822
  200   1HG   GLN  26          HG2       GLN  26   5.636   2.848 -21.555
  201   2HG   GLN  26          HG3       GLN  26   4.232   2.489 -22.538
  202   1HE2  GLN  26          HE22      GLN  26   5.815   4.978 -21.007
  203   2HE2  GLN  26          HE21      GLN  26   4.469   6.091 -20.802
  204    H    TYR  27           H        TYR  27   5.772   0.190 -18.677
  205    HA   TYR  27           HA       TYR  27   3.865  -1.770 -17.781
  206   1HB   TYR  27          HB2       TYR  27   6.905  -1.815 -17.634
  207   2HB   TYR  27          HB3       TYR  27   5.843  -3.190 -17.371
  208    HD1  TYR  27           HD1      TYR  27   4.094  -3.692 -19.341
  209    HD2  TYR  27           HD2      TYR  27   7.816  -1.566 -19.783
  210    HE1  TYR  27           HE1      TYR  27   4.125  -4.257 -21.752
  211    HE2  TYR  27           HE2      TYR  27   7.920  -2.220 -22.166
  212    HH   TYR  27           HH       TYR  27   6.813  -3.290 -23.926
  213    H    LEU  28           H        LEU  28   6.318   0.192 -16.055
  214    HA   LEU  28           HA       LEU  28   5.785  -1.071 -13.495
  215   1HB   LEU  28          HB2       LEU  28   7.278   1.510 -14.094
  216   2HB   LEU  28          HB3       LEU  28   7.341   0.592 -12.618
  217    HG   LEU  28           HG       LEU  28   8.379  -0.363 -15.317
  218   1HD1  LEU  28          HD11      LEU  28   9.681   1.443 -14.141
  219   2HD1  LEU  28          HD12      LEU  28   9.935   0.308 -12.798
  220   3HD1  LEU  28          HD13      LEU  28  10.573  -0.069 -14.411
  221   1HD2  LEU  28          HD21      LEU  28   8.569  -1.761 -12.620
  222   2HD2  LEU  28          HD22      LEU  28   7.569  -2.288 -13.990
  223   3HD2  LEU  28          HD23      LEU  28   9.320  -2.284 -14.143
  224    H    GLY  29           H        GLY  29   4.105   1.371 -15.233
  225   1HA   GLY  29          HA1       GLY  29   2.263   2.574 -14.715
  226   2HA   GLY  29          HA2       GLY  29   2.015   1.398 -13.412
  227    H    ASP  30           H        ASP  30   4.795   3.526 -13.493
  228    HA   ASP  30           HA       ASP  30   5.683   5.011 -12.122
  229   1HB   ASP  30          HB2       ASP  30   3.912   6.389 -13.069
  230   2HB   ASP  30          HB3       ASP  30   2.874   6.028 -11.687
  231    H    GLU  31           H        GLU  31   4.148   2.443 -10.935
  232    HA   GLU  31           HA       GLU  31   4.147   2.885  -8.102
  233   1HB   GLU  31          HB2       GLU  31   4.567   0.326  -9.678
  234   2HB   GLU  31          HB3       GLU  31   4.275   0.417  -7.950
  235   1HG   GLU  31          HG2       GLU  31   2.352   1.471 -10.052
  236   2HG   GLU  31          HG3       GLU  31   2.279  -0.152  -9.372
  237    H    TRP  32           H        TRP  32   6.538   2.937 -10.410
  238    HA   TRP  32           HA       TRP  32   8.746   2.806  -8.488
  239   1HB   TRP  32          HB2       TRP  32   8.906   1.965 -11.409
  240   2HB   TRP  32          HB3       TRP  32  10.192   1.904 -10.226
  241    HD1  TRP  32           HD1      TRP  32   6.644   0.296 -10.469
  242    HE1  TRP  32           HE1      TRP  32   6.768  -2.157  -9.897
  243    HE3  TRP  32           HE3      TRP  32  11.691  -0.065  -9.599
  244    HZ2  TRP  32           HZ2      TRP  32   8.802  -4.120  -9.436
  245    HZ3  TRP  32           HZ3      TRP  32  12.696  -2.285  -9.156
  246    HH2  TRP  32           HH2      TRP  32  11.272  -4.335  -9.145
  247    H    LYS  33           H        LYS  33   9.391   4.959  -8.412
  248    HA   LYS  33           HA       LYS  33   8.562   6.936 -10.318
  249   1HB   LYS  33          HB2       LYS  33  10.653   6.938  -8.087
  250   2HB   LYS  33          HB3       LYS  33  10.208   8.366  -9.027
  251   1HG   LYS  33          HG2       LYS  33   8.570   6.843  -6.997
  252   2HG   LYS  33          HG3       LYS  33   9.087   8.513  -6.942
  253   1HD   LYS  33          HD2       LYS  33   6.960   7.348  -8.791
  254   2HD   LYS  33          HD3       LYS  33   6.687   8.350  -7.368
  255   1HE   LYS  33          HE2       LYS  33   7.800  10.264  -8.412
  256   2HE   LYS  33          HE3       LYS  33   8.253   9.283  -9.814
  257   1HZ   LYS  33          HZ1       LYS  33   5.913   8.992 -10.321
  258   2HZ   LYS  33          HZ2       LYS  33   5.471   9.922  -9.041
  259   3HZ   LYS  33          HZ3       LYS  33   6.296  10.591 -10.283
  260    H    VAL  34           H        VAL  34   9.266   6.573 -12.373
  261    HA   VAL  34           HA       VAL  34  11.835   5.399 -12.859
  262    HB   VAL  34           HB       VAL  34  10.025   6.546 -14.993
  263   1HG1  VAL  34          HG11      VAL  34  12.319   5.311 -15.356
  264   2HG1  VAL  34          HG12      VAL  34  11.399   3.854 -14.980
  265   3HG1  VAL  34          HG13      VAL  34  10.913   4.887 -16.349
  266   1HG2  VAL  34          HG21      VAL  34   8.365   5.355 -13.709
  267   2HG2  VAL  34          HG22      VAL  34   8.795   4.363 -15.098
  268   3HG2  VAL  34          HG23      VAL  34   9.450   3.958 -13.501
  269    H    TYR  35           H        TYR  35  13.696   6.424 -13.476
  270    HA   TYR  35           HA       TYR  35  13.632   9.171 -14.604
  271   1HB   TYR  35          HB2       TYR  35  15.426   8.186 -12.339
  272   2HB   TYR  35          HB3       TYR  35  15.618   9.714 -13.178
  273    HD1  TYR  35           HD1      TYR  35  13.879  11.531 -12.936
  274    HD2  TYR  35           HD2      TYR  35  13.875   7.956 -10.518
  275    HE1  TYR  35           HE1      TYR  35  12.442  12.669 -11.268
  276    HE2  TYR  35           HE2      TYR  35  12.467   9.092  -8.834
  277    HH   TYR  35           HH       TYR  35  11.356  11.062  -8.239
  278    H    SER  36           H        SER  36  15.815   9.654 -15.673
  279    HA   SER  36           HA       SER  36  17.650   7.438 -15.894
  280   1HB   SER  36          HB2       SER  36  17.718   7.292 -18.253
  281   2HB   SER  36          HB3       SER  36  16.062   6.983 -17.756
  282    HG   SER  36           HG       SER  36  15.455   8.981 -18.446
  283    H    ALA  37           H        ALA  37  19.687   8.122 -16.983
  284    HA   ALA  37           HA       ALA  37  20.223  10.911 -17.430
  285   1HB   ALA  37          HB1       ALA  37  21.767  11.239 -15.552
  286   2HB   ALA  37          HB2       ALA  37  20.140  10.965 -14.964
  287   3HB   ALA  37          HB3       ALA  37  21.336   9.649 -14.885
  288    H    GLY  38           H        GLY  38  22.999  10.888 -17.087
  289   1HA   GLY  38          HA1       GLY  38  24.269   8.441 -17.767
  290   2HA   GLY  38          HA2       GLY  38  24.005   9.405 -19.234
  291    H    ILE  39           H        ILE  39  26.491   8.953 -18.796
  292    HA   ILE  39           HA       ILE  39  28.053  10.709 -17.226
  293    HB   ILE  39           HB       ILE  39  28.343   9.009 -19.660
  294   1HG1  ILE  39          HG12      ILE  39  30.228   9.418 -17.303
  295   2HG1  ILE  39          HG13      ILE  39  28.795   8.412 -17.197
  296   1HG2  ILE  39          HG21      ILE  39  30.426  11.140 -19.111
  297   2HG2  ILE  39          HG22      ILE  39  30.603   9.770 -20.233
  298   3HG2  ILE  39          HG23      ILE  39  29.401  11.005 -20.565
  299   1HD1  ILE  39          HD11      ILE  39  31.147   7.955 -19.080
  300   2HD1  ILE  39          HD12      ILE  39  30.726   7.008 -17.655
  301   3HD1  ILE  39          HD13      ILE  39  29.651   6.989 -19.068
  302    H    GLU  40           H        GLU  40  26.086  11.410 -20.060
  303    HA   GLU  40           HA       GLU  40  26.535  14.206 -19.631
  304   1HB   GLU  40          HB2       GLU  40  26.966  14.816 -21.917
  305   2HB   GLU  40          HB3       GLU  40  28.282  13.817 -21.305
  306   1HG   GLU  40          HG2       GLU  40  27.457  11.861 -22.537
  307   2HG   GLU  40          HG3       GLU  40  25.997  12.731 -23.013
  308    H    ALA  41           H        ALA  41  24.891  15.444 -20.953
  309    HA   ALA  41           HA       ALA  41  22.718  13.918 -22.157
  310   1HB   ALA  41          HB1       ALA  41  22.333  15.840 -19.803
  311   2HB   ALA  41          HB2       ALA  41  21.029  15.265 -20.853
  312   3HB   ALA  41          HB3       ALA  41  21.928  14.108 -19.845
  313    H    HIS  42           H        HIS  42  22.115  15.035 -23.945
  314    HA   HIS  42           HA       HIS  42  22.515  17.967 -24.086
  315   1HB   HIS  42          HB2       HIS  42  23.562  15.900 -26.064
  316   2HB   HIS  42          HB3       HIS  42  23.313  17.593 -26.490
  317    HD1  HIS  42           HD1      HIS  42  26.031  15.466 -25.002
  318    HD2  HIS  42           HD2      HIS  42  24.638  19.456 -24.825
  319    HE1  HIS  42           HE1      HIS  42  27.900  16.839 -24.011
  320    H    GLY  43           H        GLY  43  20.265  16.045 -23.579
  321   1HA   GLY  43          HA1       GLY  43  17.976  16.421 -24.016
  322   2HA   GLY  43          HA2       GLY  43  18.360  17.098 -25.605
  323    H    LEU  44           H        LEU  44  16.434  15.222 -25.498
  324    HA   LEU  44           HA       LEU  44  17.580  12.586 -25.997
  325   1HB   LEU  44          HB2       LEU  44  15.409  11.733 -26.021
  326   2HB   LEU  44          HB3       LEU  44  15.524  12.847 -24.663
  327    HG   LEU  44           HG       LEU  44  14.093  13.327 -27.311
  328   1HD1  LEU  44          HD11      LEU  44  13.080  12.942 -24.451
  329   2HD1  LEU  44          HD12      LEU  44  12.078  13.171 -25.898
  330   3HD1  LEU  44          HD13      LEU  44  13.069  11.714 -25.722
  331   1HD2  LEU  44          HD21      LEU  44  14.814  15.529 -26.540
  332   2HD2  LEU  44          HD22      LEU  44  13.104  15.343 -26.177
  333   3HD2  LEU  44          HD23      LEU  44  14.290  15.157 -24.870
  334    H    ASN  45           H        ASN  45  17.362  11.424 -27.931
  335    HA   ASN  45           HA       ASN  45  18.024  13.038 -30.222
  336   1HB   ASN  45          HB2       ASN  45  19.024  10.831 -29.559
  337   2HB   ASN  45          HB3       ASN  45  17.518  10.037 -29.997
  338   1HD2  ASN  45          HD22      ASN  45  20.502  10.317 -31.101
  339   2HD2  ASN  45          HD21      ASN  45  20.228  10.439 -32.825
  340    HA   PRO  46           HA       PRO  46  13.796  13.424 -31.837
  341   1HB   PRO  46          HB2       PRO  46  15.269  13.374 -34.480
  342   2HB   PRO  46          HB3       PRO  46  13.920  14.435 -33.965
  343   1HG   PRO  46          HG2       PRO  46  16.466  15.359 -33.919
  344   2HG   PRO  46          HG3       PRO  46  15.366  15.704 -32.544
  345   1HD   PRO  46          HD2       PRO  46  17.536  13.610 -32.736
  346   2HD   PRO  46          HD3       PRO  46  17.109  14.684 -31.369
  347    H    ASN  47           H        ASN  47  16.081  10.956 -33.101
  348    HA   ASN  47           HA       ASN  47  13.964   9.378 -34.352
  349   1HB   ASN  47          HB2       ASN  47  16.865   8.807 -33.690
  350   2HB   ASN  47          HB3       ASN  47  15.778   7.566 -34.299
  351   1HD2  ASN  47          HD22      ASN  47  18.239   8.901 -35.530
  352   2HD2  ASN  47          HD21      ASN  47  17.677   9.370 -37.113
  353    H    ALA  48           H        ALA  48  15.378   9.625 -31.115
  354    HA   ALA  48           HA       ALA  48  14.280   7.161 -30.114
  355   1HB   ALA  48          HB1       ALA  48  16.107   8.568 -28.958
  356   2HB   ALA  48          HB2       ALA  48  14.827   9.692 -28.490
  357   3HB   ALA  48          HB3       ALA  48  14.771   8.020 -27.927
  358    H    VAL  49           H        VAL  49  13.212  10.602 -30.224
  359    HA   VAL  49           HA       VAL  49  10.695  10.217 -29.000
  360    HB   VAL  49           HB       VAL  49  11.490  12.267 -31.118
  361   1HG1  VAL  49          HG11      VAL  49   9.168  12.263 -29.143
  362   2HG1  VAL  49          HG12      VAL  49   9.683  13.658 -30.114
  363   3HG1  VAL  49          HG13      VAL  49   9.063  12.219 -30.922
  364   1HG2  VAL  49          HG21      VAL  49  11.527  12.413 -28.077
  365   2HG2  VAL  49          HG22      VAL  49  12.955  12.368 -29.133
  366   3HG2  VAL  49          HG23      VAL  49  11.876  13.760 -29.180
  367    H    LYS  50           H        LYS  50  11.545  10.088 -32.551
  368    HA   LYS  50           HA       LYS  50   8.948   9.300 -33.361
  369   1HB   LYS  50          HB2       LYS  50  11.694   9.137 -34.567
  370   2HB   LYS  50          HB3       LYS  50  10.563   7.955 -35.161
  371   1HG   LYS  50          HG2       LYS  50  10.239  10.958 -35.300
  372   2HG   LYS  50          HG3       LYS  50  10.537   9.838 -36.621
  373   1HD   LYS  50          HD2       LYS  50   7.990  10.337 -35.089
  374   2HD   LYS  50          HD3       LYS  50   8.256  10.405 -36.815
  375   1HE   LYS  50          HE2       LYS  50   8.159   7.853 -35.126
  376   2HE   LYS  50          HE3       LYS  50   6.834   8.495 -36.081
  377   1HZ   LYS  50          HZ1       LYS  50   8.016   6.709 -37.173
  378   2HZ   LYS  50          HZ2       LYS  50   8.073   8.084 -38.073
  379   3HZ   LYS  50          HZ3       LYS  50   9.401   7.586 -37.245
  380    H    ALA  51           H        ALA  51  11.693   7.237 -32.270
  381    HA   ALA  51           HA       ALA  51  10.500   4.776 -32.904
  382   1HB   ALA  51          HB1       ALA  51  12.881   5.062 -32.276
  383   2HB   ALA  51          HB2       ALA  51  12.404   5.456 -30.614
  384   3HB   ALA  51          HB3       ALA  51  12.101   3.838 -31.264
  385    H    MET  52           H        MET  52  10.234   6.740 -29.890
  386    HA   MET  52           HA       MET  52   8.479   4.827 -28.636
  387   1HB   MET  52          HB2       MET  52   8.949   7.771 -28.017
  388   2HB   MET  52          HB3       MET  52   8.076   6.634 -26.992
  389   1HG   MET  52          HG2       MET  52  11.020   6.666 -27.669
  390   2HG   MET  52          HG3       MET  52  10.253   6.771 -26.097
  391   1HE   MET  52          HE1       MET  52   8.930   4.825 -25.030
  392   2HE   MET  52          HE2       MET  52   8.142   4.161 -26.496
  393   3HE   MET  52          HE3       MET  52   9.091   3.114 -25.435
  394    H    LYS  53           H        LYS  53   7.838   7.787 -30.612
  395    HA   LYS  53           HA       LYS  53   5.014   7.634 -30.285
  396   1HB   LYS  53          HB2       LYS  53   6.854   8.916 -32.280
  397   2HB   LYS  53          HB3       LYS  53   5.194   8.622 -32.787
  398   1HG   LYS  53          HG2       LYS  53   5.187  10.805 -31.876
  399   2HG   LYS  53          HG3       LYS  53   4.357   9.753 -30.722
  400   1HD   LYS  53          HD2       LYS  53   6.605   9.625 -29.454
  401   2HD   LYS  53          HD3       LYS  53   7.156  10.935 -30.496
  402   1HE   LYS  53          HE2       LYS  53   4.689  10.971 -28.703
  403   2HE   LYS  53          HE3       LYS  53   6.267  11.623 -28.253
  404   1HZ   LYS  53          HZ1       LYS  53   4.841  13.375 -29.021
  405   2HZ   LYS  53          HZ2       LYS  53   6.073  13.221 -30.071
  406   3HZ   LYS  53          HZ3       LYS  53   4.583  12.656 -30.459
  407    H    GLU  54           H        GLU  54   7.228   5.678 -32.216
  408    HA   GLU  54           HA       GLU  54   5.283   4.694 -34.029
  409   1HB   GLU  54          HB2       GLU  54   7.960   4.671 -34.027
  410   2HB   GLU  54          HB3       GLU  54   7.737   3.114 -33.254
  411   1HG   GLU  54          HG2       GLU  54   8.030   2.813 -35.626
  412   2HG   GLU  54          HG3       GLU  54   6.371   2.385 -35.228
  413    H    VAL  55           H        VAL  55   5.766   4.066 -30.665
  414    HA   VAL  55           HA       VAL  55   3.997   1.663 -30.835
  415    HB   VAL  55           HB       VAL  55   5.023   0.992 -28.667
  416   1HG1  VAL  55          HG11      VAL  55   6.959   1.324 -30.998
  417   2HG1  VAL  55          HG12      VAL  55   7.097   0.136 -29.693
  418   3HG1  VAL  55          HG13      VAL  55   5.748   0.041 -30.828
  419   1HG2  VAL  55          HG21      VAL  55   7.134   3.118 -29.248
  420   2HG2  VAL  55          HG22      VAL  55   5.865   3.293 -28.008
  421   3HG2  VAL  55          HG23      VAL  55   7.068   2.019 -27.871
  422    H    GLY  56           H        GLY  56   3.955   4.936 -30.059
  423   1HA   GLY  56          HA1       GLY  56   2.002   6.044 -29.453
  424   2HA   GLY  56          HA2       GLY  56   1.329   4.556 -28.767
  425    H    ILE  57           H        ILE  57   4.580   5.915 -28.101
  426    HA   ILE  57           HA       ILE  57   3.777   6.597 -25.317
  427    HB   ILE  57           HB       ILE  57   6.268   5.206 -26.366
  428   1HG1  ILE  57          HG12      ILE  57   4.285   4.323 -24.229
  429   2HG1  ILE  57          HG13      ILE  57   4.244   3.780 -25.901
  430   1HG2  ILE  57          HG21      ILE  57   7.088   6.822 -24.755
  431   2HG2  ILE  57          HG22      ILE  57   5.795   6.413 -23.606
  432   3HG2  ILE  57          HG23      ILE  57   7.094   5.268 -23.947
  433   1HD1  ILE  57          HD11      ILE  57   6.507   2.774 -25.647
  434   2HD1  ILE  57          HD12      ILE  57   6.458   3.169 -23.915
  435   3HD1  ILE  57          HD13      ILE  57   5.272   2.059 -24.614
  436    H    ASP  58           H        ASP  58   5.230   8.322 -24.496
  437    HA   ASP  58           HA       ASP  58   6.550   9.965 -26.560
  438   1HB   ASP  58          HB2       ASP  58   4.463  11.170 -26.220
  439   2HB   ASP  58          HB3       ASP  58   4.622  11.033 -24.457
  440    H    ILE  59           H        ILE  59   8.364  10.916 -25.819
  441    HA   ILE  59           HA       ILE  59   9.141  10.616 -22.989
  442    HB   ILE  59           HB       ILE  59  11.506  10.095 -23.783
  443   1HG1  ILE  59          HG12      ILE  59  10.143   9.211 -26.368
  444   2HG1  ILE  59          HG13      ILE  59  11.027  10.723 -26.222
  445   1HG2  ILE  59          HG21      ILE  59   9.381   7.976 -24.341
  446   2HG2  ILE  59          HG22      ILE  59  11.069   7.700 -23.855
  447   3HG2  ILE  59          HG23      ILE  59   9.942   8.458 -22.734
  448   1HD1  ILE  59          HD11      ILE  59  13.082   9.488 -25.629
  449   2HD1  ILE  59          HD12      ILE  59  12.224   7.946 -25.785
  450   3HD1  ILE  59          HD13      ILE  59  12.442   8.992 -27.195
  451    H    SER  60           H        SER  60   8.427  12.718 -25.454
  452    HA   SER  60           HA       SER  60  10.441  14.724 -25.181
  453   1HB   SER  60          HB2       SER  60   7.497  15.300 -25.583
  454   2HB   SER  60          HB3       SER  60   8.898  16.177 -26.218
  455    HG   SER  60           HG       SER  60   7.777  13.696 -26.958
  456    H    ASN  61           H        ASN  61   7.682  13.760 -23.229
  457    HA   ASN  61           HA       ASN  61   7.508  15.811 -21.334
  458   1HB   ASN  61          HB2       ASN  61   5.865  14.042 -21.601
  459   2HB   ASN  61          HB3       ASN  61   7.052  12.802 -21.210
  460   1HD2  ASN  61          HD22      ASN  61   7.048  12.064 -19.119
  461   2HD2  ASN  61          HD21      ASN  61   6.362  12.922 -17.762
  462    H    GLN  62           H        GLN  62  10.265  13.673 -21.723
  463    HA   GLN  62           HA       GLN  62  11.113  14.193 -18.917
  464   1HB   GLN  62          HB2       GLN  62  11.998  11.820 -18.886
  465   2HB   GLN  62          HB3       GLN  62  10.239  11.968 -18.826
  466   1HG   GLN  62          HG2       GLN  62   9.979  11.336 -21.103
  467   2HG   GLN  62          HG3       GLN  62  11.698  11.572 -21.443
  468   1HE2  GLN  62          HE22      GLN  62  12.908   9.868 -21.616
  469   2HE2  GLN  62          HE21      GLN  62  12.472   8.246 -21.120
  470    H    THR  63           H        THR  63  11.995  15.950 -20.576
  471    HA   THR  63           HA       THR  63  14.157  15.413 -22.234
  472    HB   THR  63           HB       THR  63  14.796  17.857 -21.528
  473    HG1  THR  63           HG1      THR  63  13.695  17.905 -19.541
  474   1HG2  THR  63          HG21      THR  63  12.000  17.239 -22.578
  475   2HG2  THR  63          HG22      THR  63  12.882  18.768 -22.792
  476   3HG2  THR  63          HG23      THR  63  13.483  17.286 -23.554
  477    H    SER  64           H        SER  64  16.362  15.240 -22.024
  478    HA   SER  64           HA       SER  64  17.244  13.669 -20.005
  479   1HB   SER  64          HB2       SER  64  18.911  15.361 -21.906
  480   2HB   SER  64          HB3       SER  64  19.320  13.772 -21.242
  481    HG   SER  64           HG       SER  64  18.458  13.074 -22.990
  482    H    ASP  65           H        ASP  65  19.110  13.833 -18.664
  483    HA   ASP  65           HA       ASP  65  20.301  16.391 -18.019
  484   1HB   ASP  65          HB2       ASP  65  18.236  16.370 -16.546
  485   2HB   ASP  65          HB3       ASP  65  18.846  14.896 -15.791
  486    H    ILE  66           H        ILE  66  22.172  16.078 -16.577
  487    HA   ILE  66           HA       ILE  66  23.519  13.498 -16.957
  488    HB   ILE  66           HB       ILE  66  25.201  14.814 -15.346
  489   1HG1  ILE  66          HG12      ILE  66  23.625  16.865 -15.224
  490   2HG1  ILE  66          HG13      ILE  66  25.348  17.079 -15.456
  491   1HG2  ILE  66          HG21      ILE  66  26.394  15.524 -17.373
  492   2HG2  ILE  66          HG22      ILE  66  25.746  13.882 -17.464
  493   3HG2  ILE  66          HG23      ILE  66  24.917  15.202 -18.322
  494   1HD1  ILE  66          HD11      ILE  66  24.037  18.619 -16.870
  495   2HD1  ILE  66          HD12      ILE  66  25.079  17.564 -17.835
  496   3HD1  ILE  66          HD13      ILE  66  23.339  17.247 -17.746
  497    H    ILE  67           H        ILE  67  24.529  12.501 -15.031
  498    HA   ILE  67           HA       ILE  67  22.572  11.519 -13.302
  499    HB   ILE  67           HB       ILE  67  25.603  11.413 -13.337
  500   1HG1  ILE  67          HG12      ILE  67  23.485   9.262 -13.761
  501   2HG1  ILE  67          HG13      ILE  67  24.089  10.254 -15.075
  502   1HG2  ILE  67          HG21      ILE  67  23.770   9.910 -11.418
  503   2HG2  ILE  67          HG22      ILE  67  25.504   9.587 -11.663
  504   3HG2  ILE  67          HG23      ILE  67  24.997  11.115 -10.963
  505   1HD1  ILE  67          HD11      ILE  67  25.239   8.185 -15.153
  506   2HD1  ILE  67          HD12      ILE  67  26.403   9.420 -14.636
  507   3HD1  ILE  67          HD13      ILE  67  25.717   8.275 -13.452
  508    H    ASP  68           H        ASP  68  22.126  11.779 -11.156
  509    HA   ASP  68           HA       ASP  68  23.433  13.962  -9.641
  510   1HB   ASP  68          HB2       ASP  68  21.325  14.831 -10.778
  511   2HB   ASP  68          HB3       ASP  68  20.408  13.699  -9.776
  512    H    SER  69           H        SER  69  23.751  13.442  -7.544
  513    HA   SER  69           HA       SER  69  23.626  10.865  -6.579
  514   1HB   SER  69          HB2       SER  69  23.613  13.403  -4.924
  515   2HB   SER  69          HB3       SER  69  24.312  11.830  -4.491
  516    HG   SER  69           HG       SER  69  25.891  13.323  -5.252
  517    H    ASP  70           H        ASP  70  21.070  13.276  -6.563
  518    HA   ASP  70           HA       ASP  70  19.620  12.300  -4.287
  519   1HB   ASP  70          HB2       ASP  70  19.467  14.613  -5.177
  520   2HB   ASP  70          HB3       ASP  70  18.687  13.987  -6.637
  521    H    ILE  71           H        ILE  71  20.019  11.016  -7.412
  522    HA   ILE  71           HA       ILE  71  17.576   9.336  -7.131
  523    HB   ILE  71           HB       ILE  71  19.093  10.015  -9.661
  524   1HG1  ILE  71          HG12      ILE  71  16.238  10.926  -9.213
  525   2HG1  ILE  71          HG13      ILE  71  17.520  11.902  -8.512
  526   1HG2  ILE  71          HG21      ILE  71  16.487   8.495  -9.139
  527   2HG2  ILE  71          HG22      ILE  71  17.126   8.900 -10.745
  528   3HG2  ILE  71          HG23      ILE  71  18.031   7.812  -9.684
  529   1HD1  ILE  71          HD11      ILE  71  16.948  12.733 -10.722
  530   2HD1  ILE  71          HD12      ILE  71  18.627  12.164 -10.651
  531   3HD1  ILE  71          HD13      ILE  71  17.377  11.168 -11.451
  532    H    LEU  72           H        LEU  72  21.081   9.433  -8.036
  533    HA   LEU  72           HA       LEU  72  21.628   6.727  -8.290
  534   1HB   LEU  72          HB2       LEU  72  23.247   8.810  -6.768
  535   2HB   LEU  72          HB3       LEU  72  23.829   7.193  -7.060
  536    HG   LEU  72           HG       LEU  72  23.194   9.185  -9.243
  537   1HD1  LEU  72          HD11      LEU  72  25.797   8.294  -7.911
  538   2HD1  LEU  72          HD12      LEU  72  25.735   9.239  -9.403
  539   3HD1  LEU  72          HD13      LEU  72  25.086   9.917  -7.907
  540   1HD2  LEU  72          HD21      LEU  72  24.580   6.451  -9.326
  541   2HD2  LEU  72          HD22      LEU  72  22.991   6.814 -10.014
  542   3HD2  LEU  72          HD23      LEU  72  24.434   7.564 -10.695
  543    H    ASN  73           H        ASN  73  21.823   8.464  -5.166
  544    HA   ASN  73           HA       ASN  73  22.122   5.986  -3.739
  545   1HB   ASN  73          HB2       ASN  73  22.800   7.213  -1.971
  546   2HB   ASN  73          HB3       ASN  73  23.041   8.448  -3.191
  547   1HD2  ASN  73          HD22      ASN  73  20.984   9.979  -3.495
  548   2HD2  ASN  73          HD21      ASN  73  20.134  10.384  -2.020
  549    H    ASN  74           H        ASN  74  19.381   7.174  -5.018
  550    HA   ASN  74           HA       ASN  74  17.590   6.635  -2.683
  551   1HB   ASN  74          HB2       ASN  74  17.790   8.967  -3.500
  552   2HB   ASN  74          HB3       ASN  74  17.389   8.423  -5.124
  553   1HD2  ASN  74          HD22      ASN  74  15.846  10.190  -4.895
  554   2HD2  ASN  74          HD21      ASN  74  14.260   9.833  -4.221
  555    H    ALA  75           H        ALA  75  18.232   5.978  -6.102
  556    HA   ALA  75           HA       ALA  75  15.828   4.688  -6.807
  557   1HB   ALA  75          HB1       ALA  75  17.433   5.576  -8.408
  558   2HB   ALA  75          HB2       ALA  75  18.608   4.329  -7.926
  559   3HB   ALA  75          HB3       ALA  75  17.062   3.872  -8.699
  560    H    ASP  76           H        ASP  76  15.042   2.731  -6.400
  561    HA   ASP  76           HA       ASP  76  16.272   0.950  -4.508
  562   1HB   ASP  76          HB2       ASP  76  13.825   1.136  -4.758
  563   2HB   ASP  76          HB3       ASP  76  13.937   0.527  -6.413
  564    H    LEU  77           H        LEU  77  16.344   1.352  -7.977
  565    HA   LEU  77           HA       LEU  77  18.425  -0.710  -8.213
  566   1HB   LEU  77          HB2       LEU  77  16.389  -1.982  -8.764
  567   2HB   LEU  77          HB3       LEU  77  15.856  -0.705  -9.859
  568    HG   LEU  77           HG       LEU  77  17.798  -1.162 -11.352
  569   1HD1  LEU  77          HD11      LEU  77  19.133  -3.191 -11.069
  570   2HD1  LEU  77          HD12      LEU  77  19.385  -2.140  -9.686
  571   3HD1  LEU  77          HD13      LEU  77  18.320  -3.554  -9.527
  572   1HD2  LEU  77          HD21      LEU  77  15.649  -2.222 -11.779
  573   2HD2  LEU  77          HD22      LEU  77  16.973  -3.304 -12.228
  574   3HD2  LEU  77          HD23      LEU  77  16.080  -3.580 -10.713
  575    H    VAL  78           H        VAL  78  19.949  -0.095  -9.685
  576    HA   VAL  78           HA       VAL  78  19.328   2.141 -11.549
  577    HB   VAL  78           HB       VAL  78  22.008   1.439 -10.272
  578   1HG1  VAL  78          HG11      VAL  78  22.326   2.424 -12.487
  579   2HG1  VAL  78          HG12      VAL  78  21.174   3.727 -12.117
  580   3HG1  VAL  78          HG13      VAL  78  22.725   3.628 -11.260
  581   1HG2  VAL  78          HG21      VAL  78  21.791   3.619  -9.081
  582   2HG2  VAL  78          HG22      VAL  78  20.135   3.783  -9.705
  583   3HG2  VAL  78          HG23      VAL  78  20.549   2.475  -8.582
  584    H    VAL  79           H        VAL  79  20.027   1.711 -13.752
  585    HA   VAL  79           HA       VAL  79  21.239  -0.962 -14.235
  586    HB   VAL  79           HB       VAL  79  18.964   0.178 -15.880
  587   1HG1  VAL  79          HG11      VAL  79  20.465  -1.439 -17.023
  588   2HG1  VAL  79          HG12      VAL  79  20.148  -2.625 -15.743
  589   3HG1  VAL  79          HG13      VAL  79  18.836  -2.086 -16.812
  590   1HG2  VAL  79          HG21      VAL  79  17.487  -1.582 -14.890
  591   2HG2  VAL  79          HG22      VAL  79  18.731  -1.880 -13.656
  592   3HG2  VAL  79          HG23      VAL  79  17.916  -0.303 -13.757
  593    H    THR  80           H        THR  80  22.947  -0.788 -15.638
  594    HA   THR  80           HA       THR  80  23.218   1.759 -17.174
  595    HB   THR  80           HB       THR  80  25.589   0.698 -17.561
  596    HG1  THR  80           HG1      THR  80  25.091  -1.238 -16.346
  597   1HG2  THR  80          HG21      THR  80  25.168   2.826 -16.468
  598   2HG2  THR  80          HG22      THR  80  24.766   1.999 -14.938
  599   3HG2  THR  80          HG23      THR  80  26.418   1.944 -15.600
  600    H    LEU  81           H        LEU  81  22.990   1.720 -19.310
  601    HA   LEU  81           HA       LEU  81  22.341  -0.899 -20.575
  602   1HB   LEU  81          HB2       LEU  81  21.624   1.939 -21.329
  603   2HB   LEU  81          HB3       LEU  81  21.267   0.544 -22.323
  604    HG   LEU  81           HG       LEU  81  19.777  -0.379 -20.608
  605   1HD1  LEU  81          HD11      LEU  81  18.968   1.144 -18.763
  606   2HD1  LEU  81          HD12      LEU  81  20.561   0.486 -18.495
  607   3HD1  LEU  81          HD13      LEU  81  20.386   2.173 -19.050
  608   1HD2  LEU  81          HD21      LEU  81  19.173   2.501 -21.399
  609   2HD2  LEU  81          HD22      LEU  81  18.770   1.023 -22.312
  610   3HD2  LEU  81          HD23      LEU  81  17.973   1.352 -20.785
  611    H    CYS  82           H        CYS  82  25.085   0.110 -20.049
  612    HA   CYS  82           HA       CYS  82  26.241   1.181 -22.428
  613   1HB   CYS  82          HB2       CYS  82  28.319   0.977 -21.202
  614   2HB   CYS  82          HB3       CYS  82  27.056   1.692 -20.208
  615    H    GLY  83           H        GLY  83  26.224  -0.098 -24.292
  616   1HA   GLY  83          HA1       GLY  83  28.006  -2.397 -24.263
  617   2HA   GLY  83          HA2       GLY  83  26.339  -2.786 -24.704
  618    H    ASP  84           H        ASP  84  27.743   0.352 -25.310
  619    HA   ASP  84           HA       ASP  84  27.434   0.070 -28.223
  620   1HB   ASP  84          HB2       ASP  84  26.809   2.401 -28.134
  621   2HB   ASP  84          HB3       ASP  84  25.956   1.607 -26.807
  622    H    ALA  85           H        ALA  85  28.612   2.103 -29.293
  623    HA   ALA  85           HA       ALA  85  31.264   1.271 -29.562
  624   1HB   ALA  85          HB1       ALA  85  29.977   2.471 -31.301
  625   2HB   ALA  85          HB2       ALA  85  30.040   3.959 -30.322
  626   3HB   ALA  85          HB3       ALA  85  31.532   3.264 -30.983
  627    H    ALA  86           H        ALA  86  29.971   3.729 -27.345
  628    HA   ALA  86           HA       ALA  86  32.645   4.795 -26.725
  629   1HB   ALA  86          HB1       ALA  86  31.455   6.217 -25.134
  630   2HB   ALA  86          HB2       ALA  86  30.657   6.283 -26.714
  631   3HB   ALA  86          HB3       ALA  86  29.948   5.319 -25.400
  632    H    ASP  87           H        ASP  87  30.076   2.946 -25.085
  633    HA   ASP  87           HA       ASP  87  29.989   1.782 -23.151
  634   1HB   ASP  87          HB2       ASP  87  30.827   0.156 -24.741
  635   2HB   ASP  87          HB3       ASP  87  32.497   0.535 -24.304
  636    H    LYS  88           H        LYS  88  31.323   4.340 -22.745
  637    HA   LYS  88           HA       LYS  88  33.444   4.084 -20.873
  638   1HB   LYS  88          HB2       LYS  88  31.345   6.276 -21.152
  639   2HB   LYS  88          HB3       LYS  88  32.805   6.383 -20.161
  640   1HG   LYS  88          HG2       LYS  88  34.239   6.171 -22.135
  641   2HG   LYS  88          HG3       LYS  88  32.845   5.885 -23.170
  642   1HD   LYS  88          HD2       LYS  88  33.530   8.157 -23.493
  643   2HD   LYS  88          HD3       LYS  88  31.966   8.129 -22.696
  644   1HE   LYS  88          HE2       LYS  88  33.281   9.861 -21.678
  645   2HE   LYS  88          HE3       LYS  88  33.095   8.569 -20.493
  646   1HZ   LYS  88          HZ1       LYS  88  35.506   9.038 -22.161
  647   2HZ   LYS  88          HZ2       LYS  88  35.363   9.406 -20.585
  648   3HZ   LYS  88          HZ3       LYS  88  35.361   7.846 -21.049
  649    H    CYS  89           H        CYS  89  30.069   3.482 -20.548
  650    HA   CYS  89           HA       CYS  89  28.663   2.946 -18.993
  651   1HB   CYS  89          HB2       CYS  89  30.264   0.966 -19.296
  652   2HB   CYS  89          HB3       CYS  89  30.760   1.316 -17.633
  653    HA   PRO  90           HA       PRO  90  29.335   6.279 -16.012
  654   1HB   PRO  90          HB2       PRO  90  26.477   5.613 -15.391
  655   2HB   PRO  90          HB3       PRO  90  27.258   7.211 -15.651
  656   1HG   PRO  90          HG2       PRO  90  25.751   6.052 -17.603
  657   2HG   PRO  90          HG3       PRO  90  27.235   6.963 -17.989
  658   1HD   PRO  90          HD2       PRO  90  26.840   3.996 -17.872
  659   2HD   PRO  90          HD3       PRO  90  27.838   4.983 -18.984
  660    H    MET  91           H        MET  91  29.849   6.365 -13.863
  661    HA   MET  91           HA       MET  91  30.031   3.923 -12.364
  662   1HB   MET  91          HB2       MET  91  31.779   5.702 -12.439
  663   2HB   MET  91          HB3       MET  91  30.680   6.808 -11.605
  664   1HG   MET  91          HG2       MET  91  30.648   5.319  -9.646
  665   2HG   MET  91          HG3       MET  91  31.683   4.158 -10.479
  666   1HE   MET  91          HE1       MET  91  34.003   5.864 -11.836
  667   2HE   MET  91          HE2       MET  91  35.170   5.878 -10.499
  668   3HE   MET  91          HE3       MET  91  34.235   4.407 -10.840
  669    H    THR  92           H        THR  92  28.941   3.429 -10.466
  670    HA   THR  92           HA       THR  92  26.650   5.074  -9.562
  671    HB   THR  92           HB       THR  92  25.649   2.764  -9.170
  672    HG1  THR  92           HG1      THR  92  27.448   1.473  -9.194
  673   1HG2  THR  92          HG21      THR  92  24.970   2.409 -11.460
  674   2HG2  THR  92          HG22      THR  92  25.189   4.155 -11.254
  675   3HG2  THR  92          HG23      THR  92  26.439   3.197 -12.079
  676    HA   PRO  93           HA       PRO  93  28.371   4.293  -5.453
  677   1HB   PRO  93          HB2       PRO  93  26.161   4.085  -3.845
  678   2HB   PRO  93          HB3       PRO  93  26.727   5.634  -4.540
  679   1HG   PRO  93          HG2       PRO  93  24.554   3.805  -5.590
  680   2HG   PRO  93          HG3       PRO  93  24.482   5.576  -5.357
  681   1HD   PRO  93          HD2       PRO  93  25.023   4.439  -7.784
  682   2HD   PRO  93          HD3       PRO  93  25.819   5.959  -7.276
  683    HA   PRO  94           HA       PRO  94  28.167  -0.187  -5.723
  684   1HB   PRO  94          HB2       PRO  94  29.867  -0.934  -3.714
  685   2HB   PRO  94          HB3       PRO  94  30.424  -0.164  -5.232
  686   1HG   PRO  94          HG2       PRO  94  29.889   1.160  -2.557
  687   2HG   PRO  94          HG3       PRO  94  31.327   1.341  -3.614
  688   1HD   PRO  94          HD2       PRO  94  29.253   3.132  -3.629
  689   2HD   PRO  94          HD3       PRO  94  30.152   2.722  -5.125
  690    H    HIS  95           H        HIS  95  27.208   1.587  -2.859
  691    HA   HIS  95           HA       HIS  95  26.167  -0.575  -1.315
  692   1HB   HIS  95          HB2       HIS  95  26.770   1.842  -0.642
  693   2HB   HIS  95          HB3       HIS  95  25.207   2.313  -1.301
  694    HD1  HIS  95           HD1      HIS  95  23.541  -0.186   0.017
  695    HD2  HIS  95           HD2      HIS  95  26.342   2.345   1.875
  696    HE1  HIS  95           HE1      HIS  95  23.008  -0.240   2.518
  697    H    VAL  96           H        VAL  96  24.994   0.910  -4.269
  698    HA   VAL  96           HA       VAL  96  22.183   0.192  -3.640
  699    HB   VAL  96           HB       VAL  96  23.322   1.986  -5.794
  700   1HG1  VAL  96          HG11      VAL  96  20.433   1.415  -5.001
  701   2HG1  VAL  96          HG12      VAL  96  20.957   2.717  -6.087
  702   3HG1  VAL  96          HG13      VAL  96  21.204   1.038  -6.558
  703   1HG2  VAL  96          HG21      VAL  96  23.536   2.980  -3.515
  704   2HG2  VAL  96          HG22      VAL  96  22.265   3.793  -4.423
  705   3HG2  VAL  96          HG23      VAL  96  21.834   2.603  -3.183
  706    H    LYS  97           H        LYS  97  21.051  -1.253  -4.944
  707    HA   LYS  97           HA       LYS  97  22.499  -3.316  -6.278
  708   1HB   LYS  97          HB2       LYS  97  20.236  -3.617  -5.218
  709   2HB   LYS  97          HB3       LYS  97  19.543  -2.566  -6.454
  710   1HG   LYS  97          HG2       LYS  97  19.049  -4.777  -7.121
  711   2HG   LYS  97          HG3       LYS  97  20.316  -4.234  -8.210
  712   1HD   LYS  97          HD2       LYS  97  21.995  -5.507  -6.732
  713   2HD   LYS  97          HD3       LYS  97  20.604  -6.080  -5.807
  714   1HE   LYS  97          HE2       LYS  97  20.827  -7.843  -7.277
  715   2HE   LYS  97          HE3       LYS  97  19.670  -6.842  -8.153
  716   1HZ   LYS  97          HZ1       LYS  97  22.551  -7.188  -8.693
  717   2HZ   LYS  97          HZ2       LYS  97  21.290  -7.436  -9.715
  718   3HZ   LYS  97          HZ3       LYS  97  21.736  -5.928  -9.350
  719    H    ARG  98           H        ARG  98  23.006  -3.556  -8.387
  720    HA   ARG  98           HA       ARG  98  22.029  -1.572 -10.347
  721   1HB   ARG  98          HB2       ARG  98  24.262  -0.924  -9.613
  722   2HB   ARG  98          HB3       ARG  98  24.888  -2.533 -10.000
  723   1HG   ARG  98          HG2       ARG  98  24.543  -2.169 -12.380
  724   2HG   ARG  98          HG3       ARG  98  23.687  -0.629 -12.072
  725   1HD   ARG  98          HD2       ARG  98  25.663   0.368 -11.195
  726   2HD   ARG  98          HD3       ARG  98  26.544  -1.167 -11.191
  727    HE   ARG  98           HE       ARG  98  25.684  -0.577 -13.854
  728   1HH1  ARG  98          HH21      ARG  98  27.923   0.857 -11.513
  729   2HH1  ARG  98          HH22      ARG  98  29.254   0.932 -12.623
  730   1HH2  ARG  98          HH12      ARG  98  27.311  -0.317 -15.329
  731   2HH2  ARG  98          HH11      ARG  98  28.879   0.311 -14.898
  732    H    GLU  99           H        GLU  99  22.053  -2.383 -12.562
  733    HA   GLU  99           HA       GLU  99  22.629  -5.235 -13.008
  734   1HB   GLU  99          HB2       GLU  99  19.992  -3.814 -13.560
  735   2HB   GLU  99          HB3       GLU  99  20.497  -5.168 -14.553
  736   1HG   GLU  99          HG2       GLU  99  20.067  -5.251 -11.543
  737   2HG   GLU  99          HG3       GLU  99  18.962  -5.865 -12.767
  738    H    HIS 100           H        HIS 100  22.718  -5.600 -15.444
  739    HA   HIS 100           HA       HIS 100  23.802  -3.218 -16.870
  740   1HB   HIS 100          HB2       HIS 100  25.709  -4.335 -15.929
  741   2HB   HIS 100          HB3       HIS 100  25.082  -5.925 -16.363
  742    HD1  HIS 100           HD1      HIS 100  26.793  -2.899 -18.041
  743    HD2  HIS 100           HD2      HIS 100  25.490  -6.827 -18.819
  744    HE1  HIS 100           HE1      HIS 100  27.781  -3.551 -20.291
  745    H    TRP 101           H        TRP 101  22.700  -2.999 -18.677
  746    HA   TRP 101           HA       TRP 101  21.548  -5.357 -20.118
  747   1HB   TRP 101          HB2       TRP 101  20.315  -2.622 -19.583
  748   2HB   TRP 101          HB3       TRP 101  19.708  -3.763 -20.763
  749    HD1  TRP 101           HD1      TRP 101  20.519  -5.211 -17.313
  750    HE1  TRP 101           HE1      TRP 101  18.373  -5.754 -16.100
  751    HE3  TRP 101           HE3      TRP 101  17.195  -3.160 -20.633
  752    HZ2  TRP 101           HZ2      TRP 101  15.545  -5.251 -16.425
  753    HZ3  TRP 101           HZ3      TRP 101  14.757  -3.275 -20.177
  754    HH2  TRP 101           HH2      TRP 101  13.937  -4.270 -18.039
  755    H    GLY 102           H        GLY 102  24.083  -4.707 -20.857
  756   1HA   GLY 102          HA1       GLY 102  24.373  -2.384 -22.454
  757   2HA   GLY 102          HA2       GLY 102  25.423  -3.804 -22.449
  758    H    PHE 103           H        PHE 103  23.863  -1.942 -24.516
  759    HA   PHE 103           HA       PHE 103  24.049  -3.875 -26.604
  760   1HB   PHE 103          HB2       PHE 103  21.676  -3.033 -27.489
  761   2HB   PHE 103          HB3       PHE 103  21.875  -4.494 -26.552
  762    HD1  PHE 103           HD1      PHE 103  21.319  -0.818 -25.856
  763    HD2  PHE 103           HD2      PHE 103  20.283  -4.897 -24.911
  764    HE1  PHE 103           HE1      PHE 103  19.739  -0.029 -24.115
  765    HE2  PHE 103           HE2      PHE 103  18.687  -4.097 -23.192
  766    HZ   PHE 103           HZ       PHE 103  18.462  -1.658 -22.746
  767    H    ASP 104           H        ASP 104  23.963  -2.660 -28.698
  768    HA   ASP 104           HA       ASP 104  25.523  -0.338 -28.349
  769   1HB   ASP 104          HB2       ASP 104  25.863  -1.919 -30.207
  770   2HB   ASP 104          HB3       ASP 104  24.312  -1.434 -30.901
  771    H    ASP 105           H        ASP 105  25.196   1.754 -28.884
  772    HA   ASP 105           HA       ASP 105  22.539   2.774 -28.302
  773   1HB   ASP 105          HB2       ASP 105  24.737   3.925 -27.674
  774   2HB   ASP 105          HB3       ASP 105  24.865   4.410 -29.357
  775    HA   PRO 106           HA       PRO 106  21.450   2.432 -32.594
  776   1HB   PRO 106          HB2       PRO 106  19.065   3.758 -32.669
  777   2HB   PRO 106          HB3       PRO 106  19.275   2.132 -31.965
  778   1HG   PRO 106          HG2       PRO 106  19.212   4.770 -30.489
  779   2HG   PRO 106          HG3       PRO 106  18.343   3.256 -30.082
  780   1HD   PRO 106          HD2       PRO 106  20.699   3.956 -28.905
  781   2HD   PRO 106          HD3       PRO 106  20.346   2.247 -29.301
  782    H    ALA 107           H        ALA 107  21.886   5.596 -31.058
  783    HA   ALA 107           HA       ALA 107  21.926   7.017 -33.588
  784   1HB   ALA 107          HB1       ALA 107  21.363   8.155 -31.469
  785   2HB   ALA 107          HB2       ALA 107  23.017   7.861 -30.876
  786   3HB   ALA 107          HB3       ALA 107  22.750   8.902 -32.284
  787    H    ARG 108           H        ARG 108  24.026   4.773 -32.127
  788    HA   ARG 108           HA       ARG 108  26.417   5.868 -33.544
  789   1HB   ARG 108          HB2       ARG 108  26.308   4.003 -31.132
  790   2HB   ARG 108          HB3       ARG 108  27.768   4.594 -31.930
  791   1HG   ARG 108          HG2       ARG 108  27.142   6.928 -31.391
  792   2HG   ARG 108          HG3       ARG 108  25.690   6.361 -30.562
  793   1HD   ARG 108          HD2       ARG 108  27.077   5.172 -28.897
  794   2HD   ARG 108          HD3       ARG 108  28.545   5.744 -29.708
  795    HE   ARG 108           HE       ARG 108  27.430   8.085 -29.325
  796   1HH1  ARG 108          HH21      ARG 108  27.707   5.452 -26.894
  797   2HH1  ARG 108          HH22      ARG 108  27.341   6.500 -25.582
  798   1HH2  ARG 108          HH11      ARG 108  27.118   9.451 -27.497
  799   2HH2  ARG 108          HH12      ARG 108  27.142   8.771 -25.898
  800    H    ALA 109           H        ALA 109  23.968   3.757 -34.043
  801    HA   ALA 109           HA       ALA 109  25.314   1.500 -35.185
  802   1HB   ALA 109          HB1       ALA 109  23.073   1.004 -36.092
  803   2HB   ALA 109          HB2       ALA 109  22.987   1.427 -34.367
  804   3HB   ALA 109          HB3       ALA 109  22.502   2.607 -35.604
  805    H    GLN 110           H        GLN 110  26.930   3.072 -36.207
  806    HA   GLN 110           HA       GLN 110  26.293   4.957 -38.164
  807   1HB   GLN 110          HB2       GLN 110  28.798   3.322 -37.611
  808   2HB   GLN 110          HB3       GLN 110  28.766   4.647 -38.774
  809   1HG   GLN 110          HG2       GLN 110  28.600   6.291 -37.164
  810   2HG   GLN 110          HG3       GLN 110  27.726   5.287 -36.023
  811   1HE2  GLN 110          HE21      GLN 110  28.874   3.868 -34.587
  812   2HE2  GLN 110          HE22      GLN 110  30.607   4.020 -34.363
  813    H    GLY 111           H        GLY 111  26.089   4.960 -40.285
  814   1HA   GLY 111          HA1       GLY 111  26.991   3.255 -42.246
  815   2HA   GLY 111          HA2       GLY 111  25.399   2.596 -41.798
  816    H    THR 112           H        THR 112  23.721   4.502 -41.374
  817    HA   THR 112           HA       THR 112  24.032   7.002 -42.597
  818    HB   THR 112           HB       THR 112  23.802   5.872 -44.739
  819    HG1  THR 112           HG1      THR 112  22.185   7.051 -45.527
  820   1HG2  THR 112          HG21      THR 112  22.719   3.787 -44.151
  821   2HG2  THR 112          HG22      THR 112  21.236   4.641 -43.665
  822   3HG2  THR 112          HG23      THR 112  21.749   4.622 -45.365
  823    H    GLU 113           H        GLU 113  21.773   8.128 -42.537
  824    HA   GLU 113           HA       GLU 113  20.854   7.876 -39.847
  825   1HB   GLU 113          HB2       GLU 113  19.226   9.585 -40.430
  826   2HB   GLU 113          HB3       GLU 113  20.833  10.001 -41.026
  827   1HG   GLU 113          HG2       GLU 113  20.159   9.225 -43.316
  828   2HG   GLU 113          HG3       GLU 113  18.541   8.877 -42.703
  829    H    GLU 114           H        GLU 114  19.729   6.452 -42.882
  830    HA   GLU 114           HA       GLU 114  17.224   5.538 -41.842
  831   1HB   GLU 114          HB2       GLU 114  17.731   5.820 -44.249
  832   2HB   GLU 114          HB3       GLU 114  18.861   4.459 -44.171
  833   1HG   GLU 114          HG2       GLU 114  17.018   2.936 -43.571
  834   2HG   GLU 114          HG3       GLU 114  15.891   4.292 -43.493
  835    H    GLU 115           H        GLU 115  20.521   4.185 -41.860
  836    HA   GLU 115           HA       GLU 115  19.718   1.577 -40.890
  837   1HB   GLU 115          HB2       GLU 115  22.398   3.016 -40.990
  838   2HB   GLU 115          HB3       GLU 115  22.206   1.422 -40.274
  839   1HG   GLU 115          HG2       GLU 115  21.438   2.070 -43.149
  840   2HG   GLU 115          HG3       GLU 115  23.014   1.454 -42.664
  841    H    LYS 116           H        LYS 116  20.991   4.606 -39.429
  842    HA   LYS 116           HA       LYS 116  20.927   3.757 -36.728
  843   1HB   LYS 116          HB2       LYS 116  20.554   6.491 -38.014
  844   2HB   LYS 116          HB3       LYS 116  20.587   6.237 -36.258
  845   1HG   LYS 116          HG2       LYS 116  22.846   5.180 -36.489
  846   2HG   LYS 116          HG3       LYS 116  22.827   5.577 -38.219
  847   1HD   LYS 116          HD2       LYS 116  22.574   8.005 -37.610
  848   2HD   LYS 116          HD3       LYS 116  22.676   7.545 -35.899
  849   1HE   LYS 116          HE2       LYS 116  24.923   6.416 -36.512
  850   2HE   LYS 116          HE3       LYS 116  24.814   7.285 -38.054
  851   1HZ   LYS 116          HZ1       LYS 116  24.940   8.460 -35.340
  852   2HZ   LYS 116          HZ2       LYS 116  26.099   8.560 -36.488
  853   3HZ   LYS 116          HZ3       LYS 116  24.694   9.362 -36.700
  854    H    TRP 117           H        TRP 117  18.311   5.322 -38.682
  855    HA   TRP 117           HA       TRP 117  16.371   5.273 -36.642
  856   1HB   TRP 117          HB2       TRP 117  16.046   6.635 -38.566
  857   2HB   TRP 117          HB3       TRP 117  16.228   5.270 -39.661
  858    HD1  TRP 117           HD1      TRP 117  14.081   4.745 -40.793
  859    HE1  TRP 117           HE1      TRP 117  11.640   4.453 -40.154
  860    HE3  TRP 117           HE3      TRP 117  14.361   6.163 -35.874
  861    HZ2  TRP 117           HZ2      TRP 117   9.978   4.792 -37.794
  862    HZ3  TRP 117           HZ3      TRP 117  12.366   6.070 -34.441
  863    HH2  TRP 117           HH2      TRP 117  10.160   5.363 -35.376
  864    H    ALA 118           H        ALA 118  17.263   2.678 -38.989
  865    HA   ALA 118           HA       ALA 118  15.093   0.973 -38.233
  866   1HB   ALA 118          HB1       ALA 118  16.394  -0.794 -39.352
  867   2HB   ALA 118          HB2       ALA 118  16.314   0.682 -40.336
  868   3HB   ALA 118          HB3       ALA 118  17.803   0.285 -39.443
  869    H    PHE 119           H        PHE 119  18.472   1.293 -37.131
  870    HA   PHE 119           HA       PHE 119  18.354  -0.819 -35.243
  871   1HB   PHE 119          HB2       PHE 119  20.374   0.613 -36.250
  872   2HB   PHE 119          HB3       PHE 119  20.166   1.529 -34.769
  873    HD1  PHE 119           HD1      PHE 119  21.223  -1.638 -36.307
  874    HD2  PHE 119           HD2      PHE 119  20.561   0.361 -32.546
  875    HE1  PHE 119           HE1      PHE 119  22.552  -3.379 -35.140
  876    HE2  PHE 119           HE2      PHE 119  21.895  -1.368 -31.386
  877    HZ   PHE 119           HZ       PHE 119  22.894  -3.247 -32.678
  878    H    PHE 120           H        PHE 120  17.484   2.618 -34.995
  879    HA   PHE 120           HA       PHE 120  16.979   2.742 -32.209
  880   1HB   PHE 120          HB2       PHE 120  16.140   4.279 -34.622
  881   2HB   PHE 120          HB3       PHE 120  14.965   4.300 -33.332
  882    HD1  PHE 120           HD1      PHE 120  18.096   5.708 -34.493
  883    HD2  PHE 120           HD2      PHE 120  15.674   4.998 -30.997
  884    HE1  PHE 120           HE1      PHE 120  19.353   7.455 -33.268
  885    HE2  PHE 120           HE2      PHE 120  16.953   6.725 -29.771
  886    HZ   PHE 120           HZ       PHE 120  18.754   8.000 -30.923
  887    H    GLN 121           H        GLN 121  14.736   1.724 -34.837
  888    HA   GLN 121           HA       GLN 121  12.617   1.119 -33.007
  889   1HB   GLN 121          HB2       GLN 121  13.267   0.212 -35.835
  890   2HB   GLN 121          HB3       GLN 121  11.802  -0.305 -34.996
  891   1HG   GLN 121          HG2       GLN 121  10.902   1.869 -34.908
  892   2HG   GLN 121          HG3       GLN 121  12.463   2.650 -35.180
  893   1HE2  GLN 121          HE22      GLN 121  13.442   2.607 -37.273
  894   2HE2  GLN 121          HE21      GLN 121  12.473   2.342 -38.704
  895    H    ARG 122           H        ARG 122  15.368  -0.860 -34.177
  896    HA   ARG 122           HA       ARG 122  14.413  -3.309 -32.988
  897   1HB   ARG 122          HB2       ARG 122  17.241  -2.385 -33.686
  898   2HB   ARG 122          HB3       ARG 122  16.833  -4.014 -33.150
  899   1HG   ARG 122          HG2       ARG 122  15.428  -4.393 -35.106
  900   2HG   ARG 122          HG3       ARG 122  15.653  -2.723 -35.646
  901   1HD   ARG 122          HD2       ARG 122  18.121  -3.139 -35.800
  902   2HD   ARG 122          HD3       ARG 122  17.822  -4.845 -35.398
  903    HE   ARG 122           HE       ARG 122  16.155  -4.233 -37.562
  904   1HH1  ARG 122          HH21      ARG 122  19.650  -4.376 -36.953
  905   2HH1  ARG 122          HH22      ARG 122  20.070  -4.691 -38.596
  906   1HH2  ARG 122          HH11      ARG 122  16.710  -4.666 -39.753
  907   2HH2  ARG 122          HH12      ARG 122  18.355  -4.871 -40.219
  908    H    VAL 123           H        VAL 123  16.725  -0.782 -31.746
  909    HA   VAL 123           HA       VAL 123  17.093  -2.171 -29.260
  910    HB   VAL 123           HB       VAL 123  17.586   0.707 -30.122
  911   1HG1  VAL 123          HG11      VAL 123  17.365   0.766 -27.700
  912   2HG1  VAL 123          HG12      VAL 123  18.401  -0.671 -27.520
  913   3HG1  VAL 123          HG13      VAL 123  19.078   0.857 -28.110
  914   1HG2  VAL 123          HG21      VAL 123  19.935  -0.005 -30.184
  915   2HG2  VAL 123          HG22      VAL 123  19.500  -1.622 -29.601
  916   3HG2  VAL 123          HG23      VAL 123  18.981  -1.086 -31.208
  917    H    ARG 124           H        ARG 124  14.776   0.364 -30.334
  918    HA   ARG 124           HA       ARG 124  13.450   0.857 -27.893
  919   1HB   ARG 124          HB2       ARG 124  13.007   2.177 -29.864
  920   2HB   ARG 124          HB3       ARG 124  12.659   0.763 -30.808
  921   1HG   ARG 124          HG2       ARG 124  10.624   0.618 -28.942
  922   2HG   ARG 124          HG3       ARG 124  10.869   2.352 -29.063
  923   1HD   ARG 124          HD2       ARG 124   9.170   1.578 -30.629
  924   2HD   ARG 124          HD3       ARG 124  10.565   2.210 -31.520
  925    HE   ARG 124           HE       ARG 124  11.080  -0.489 -31.353
  926   1HH1  ARG 124          HH21      ARG 124   8.401   1.405 -32.687
  927   2HH1  ARG 124          HH22      ARG 124   8.037   0.254 -33.928
  928   1HH2  ARG 124          HH11      ARG 124  10.679  -1.945 -33.022
  929   2HH2  ARG 124          HH12      ARG 124   9.347  -1.717 -34.099
  930    H    ASP 125           H        ASP 125  12.767  -1.680 -30.400
  931    HA   ASP 125           HA       ASP 125  10.540  -2.720 -28.966
  932   1HB   ASP 125          HB2       ASP 125  10.801  -3.132 -31.343
  933   2HB   ASP 125          HB3       ASP 125  12.335  -3.966 -31.087
  934    H    GLU 126           H        GLU 126  13.998  -3.751 -29.076
  935    HA   GLU 126           HA       GLU 126  13.630  -6.032 -27.430
  936   1HB   GLU 126          HB2       GLU 126  15.515  -5.674 -28.943
  937   2HB   GLU 126          HB3       GLU 126  16.121  -4.353 -27.927
  938   1HG   GLU 126          HG2       GLU 126  16.540  -5.896 -26.083
  939   2HG   GLU 126          HG3       GLU 126  15.705  -7.204 -26.925
  940    H    ILE 127           H        ILE 127  14.477  -2.624 -26.622
  941    HA   ILE 127           HA       ILE 127  14.805  -3.017 -23.815
  942    HB   ILE 127           HB       ILE 127  14.072  -0.642 -25.563
  943   1HG1  ILE 127          HG12      ILE 127  16.474  -1.250 -23.779
  944   2HG1  ILE 127          HG13      ILE 127  16.443  -1.536 -25.511
  945   1HG2  ILE 127          HG21      ILE 127  12.903  -0.278 -23.393
  946   2HG2  ILE 127          HG22      ILE 127  14.447  -0.507 -22.546
  947   3HG2  ILE 127          HG23      ILE 127  14.207   0.852 -23.677
  948   1HD1  ILE 127          HD11      ILE 127  15.983   0.969 -25.802
  949   2HD1  ILE 127          HD12      ILE 127  16.395   1.143 -24.080
  950   3HD1  ILE 127          HD13      ILE 127  17.597   0.518 -25.211
  951    H    GLY 128           H        GLY 128  11.872  -2.096 -25.758
  952   1HA   GLY 128          HA1       GLY 128  10.037  -1.988 -23.672
  953   2HA   GLY 128          HA2       GLY 128   9.663  -2.514 -25.330
  954    H    ASN 129           H        ASN 129  11.054  -4.895 -25.534
  955    HA   ASN 129           HA       ASN 129   9.353  -6.711 -24.147
  956   1HB   ASN 129          HB2       ASN 129  11.908  -7.083 -25.752
  957   2HB   ASN 129          HB3       ASN 129  11.190  -8.425 -24.874
  958   1HD2  ASN 129          HD22      ASN 129  10.604  -6.113 -27.530
  959   2HD2  ASN 129          HD21      ASN 129   9.338  -7.052 -28.277
  960    H    ARG 130           H        ARG 130  12.751  -5.721 -23.503
  961    HA   ARG 130           HA       ARG 130  12.949  -7.662 -21.400
  962   1HB   ARG 130          HB2       ARG 130  14.866  -6.778 -22.775
  963   2HB   ARG 130          HB3       ARG 130  14.722  -5.233 -21.936
  964   1HG   ARG 130          HG2       ARG 130  16.533  -6.600 -21.005
  965   2HG   ARG 130          HG3       ARG 130  15.275  -6.330 -19.803
  966   1HD   ARG 130          HD2       ARG 130  14.360  -8.621 -20.240
  967   2HD   ARG 130          HD3       ARG 130  15.659  -8.878 -21.413
  968    HE   ARG 130           HE       ARG 130  17.153  -9.190 -19.700
  969   1HH1  ARG 130          HH11      ARG 130  14.209  -7.707 -18.310
  970   2HH1  ARG 130          HH12      ARG 130  14.630  -8.144 -16.671
  971   1HH2  ARG 130          HH21      ARG 130  17.740  -9.593 -17.517
  972   2HH2  ARG 130          HH22      ARG 130  16.653  -9.218 -16.217
  973    H    LEU 131           H        LEU 131  11.931  -4.272 -21.490
  974    HA   LEU 131           HA       LEU 131  11.899  -3.871 -18.648
  975   1HB   LEU 131          HB2       LEU 131  11.378  -2.249 -20.893
  976   2HB   LEU 131          HB3       LEU 131   9.823  -2.420 -20.125
  977    HG   LEU 131           HG       LEU 131  10.816  -0.491 -19.250
  978   1HD1  LEU 131          HD11      LEU 131   9.685  -1.879 -17.530
  979   2HD1  LEU 131          HD12      LEU 131  11.259  -2.566 -17.090
  980   3HD1  LEU 131          HD13      LEU 131  10.963  -0.849 -16.854
  981   1HD2  LEU 131          HD21      LEU 131  13.307  -2.004 -18.428
  982   2HD2  LEU 131          HD22      LEU 131  13.163  -1.052 -19.922
  983   3HD2  LEU 131          HD23      LEU 131  13.011  -0.262 -18.356
  984    H    LYS 132           H        LYS 132   9.479  -5.035 -21.058
  985    HA   LYS 132           HA       LYS 132   7.347  -5.416 -19.273
  986   1HB   LYS 132          HB2       LYS 132   7.189  -5.625 -21.746
  987   2HB   LYS 132          HB3       LYS 132   8.094  -7.134 -21.683
  988   1HG   LYS 132          HG2       LYS 132   6.352  -8.205 -20.348
  989   2HG   LYS 132          HG3       LYS 132   5.441  -6.677 -20.265
  990   1HD   LYS 132          HD2       LYS 132   5.208  -6.683 -22.742
  991   2HD   LYS 132          HD3       LYS 132   6.106  -8.214 -22.820
  992   1HE   LYS 132          HE2       LYS 132   4.368  -9.301 -21.406
  993   2HE   LYS 132          HE3       LYS 132   3.472  -7.779 -21.334
  994   1HZ   LYS 132          HZ1       LYS 132   3.178  -7.914 -23.741
  995   2HZ   LYS 132          HZ2       LYS 132   4.005  -9.323 -23.807
  996   3HZ   LYS 132          HZ3       LYS 132   2.580  -9.247 -23.024
  997    H    GLU 133           H        GLU 133   9.971  -7.705 -20.153
  998    HA   GLU 133           HA       GLU 133   9.031  -9.690 -18.378
  999   1HB   GLU 133          HB2       GLU 133  11.876  -9.282 -19.364
 1000   2HB   GLU 133          HB3       GLU 133  11.271 -10.687 -18.460
 1001   1HG   GLU 133          HG2       GLU 133   9.551 -11.052 -20.232
 1002   2HG   GLU 133          HG3       GLU 133  10.287  -9.761 -21.183
 1003    H    PHE 134           H        PHE 134  11.326  -7.022 -17.788
 1004    HA   PHE 134           HA       PHE 134  12.026  -7.788 -15.156
 1005   1HB   PHE 134          HB2       PHE 134  13.300  -6.111 -16.275
 1006   2HB   PHE 134          HB3       PHE 134  11.879  -5.140 -16.616
 1007    HD1  PHE 134           HD1      PHE 134  14.080  -6.298 -13.811
 1008    HD2  PHE 134           HD2      PHE 134  11.117  -3.460 -15.134
 1009    HE1  PHE 134           HE1      PHE 134  14.454  -4.944 -11.770
 1010    HE2  PHE 134           HE2      PHE 134  11.558  -2.054 -13.147
 1011    HZ   PHE 134           HZ       PHE 134  13.218  -2.812 -11.443
 1012    H    ALA 135           H        ALA 135   9.184  -6.062 -16.383
 1013    HA   ALA 135           HA       ALA 135   8.280  -5.399 -13.717
 1014   1HB   ALA 135          HB1       ALA 135   6.302  -4.501 -14.908
 1015   2HB   ALA 135          HB2       ALA 135   7.795  -3.984 -15.723
 1016   3HB   ALA 135          HB3       ALA 135   6.822  -5.301 -16.407
 1017    H    GLU 136           H        GLU 136   7.544  -7.888 -16.122
 1018    HA   GLU 136           HA       GLU 136   5.225  -8.860 -14.669
 1019   1HB   GLU 136          HB2       GLU 136   5.170  -8.653 -17.105
 1020   2HB   GLU 136          HB3       GLU 136   6.585  -9.687 -17.261
 1021   1HG   GLU 136          HG2       GLU 136   4.587 -10.921 -17.850
 1022   2HG   GLU 136          HG3       GLU 136   5.364 -11.626 -16.440
 1023    H    THR 137           H        THR 137   8.444 -10.056 -15.566
 1024    HA   THR 137           HA       THR 137   7.937 -12.589 -14.123
 1025    HB   THR 137           HB       THR 137   9.500 -13.633 -15.529
 1026    HG1  THR 137           HG1      THR 137  10.183 -11.015 -16.333
 1027   1HG2  THR 137          HG21      THR 137   7.269 -13.237 -16.567
 1028   2HG2  THR 137          HG22      THR 137   7.927 -11.777 -17.353
 1029   3HG2  THR 137          HG23      THR 137   8.594 -13.370 -17.742
 1030    H    GLY 138           H        GLY 138   9.859  -9.674 -14.019
 1031   1HA   GLY 138          HA1       GLY 138  11.178  -8.907 -12.276
 1032   2HA   GLY 138          HA2       GLY 138  11.056 -10.473 -11.469
 1033    H    LYS 139           H        LYS 139  12.031 -10.472 -14.870
 1034    HA   LYS 139           HA       LYS 139  14.576 -11.674 -14.216
 1035   1HB   LYS 139          HB2       LYS 139  13.242 -10.745 -16.783
 1036   2HB   LYS 139          HB3       LYS 139  14.909 -11.348 -16.757
 1037   1HG   LYS 139          HG2       LYS 139  14.205 -13.512 -15.886
 1038   2HG   LYS 139          HG3       LYS 139  12.544 -12.948 -15.699
 1039   1HD   LYS 139          HD2       LYS 139  12.610 -12.455 -18.243
 1040   2HD   LYS 139          HD3       LYS 139  14.090 -13.432 -18.274
 1041   1HE   LYS 139          HE2       LYS 139  12.768 -15.324 -17.249
 1042   2HE   LYS 139          HE3       LYS 139  11.329 -14.288 -17.300
 1043   1HZ   LYS 139          HZ1       LYS 139  11.326 -15.686 -19.217
 1044   2HZ   LYS 139          HZ2       LYS 139  11.654 -14.162 -19.746
 1045   3HZ   LYS 139          HZ3       LYS 139  12.850 -15.278 -19.636
  Start of MODEL   18
    1   1H    MET   1           H1       MET   1   6.853   6.582   0.001
    2   2H    MET   1           H2       MET   1   6.952   7.439   1.394
    3   3H    MET   1           H3       MET   1   8.234   6.564   0.878
    4    HA   MET   1           HA       MET   1   7.175   5.479   2.700
    5   1HB   MET   1          HB2       MET   1   4.907   6.368   2.325
    6   2HB   MET   1          HB3       MET   1   4.718   5.343   0.906
    7   1HG   MET   1          HG2       MET   1   3.615   4.374   2.865
    8   2HG   MET   1          HG3       MET   1   4.897   3.330   2.284
    9   1HE   MET   1          HE1       MET   1   3.544   5.573   5.156
   10   2HE   MET   1          HE2       MET   1   4.924   5.714   6.265
   11   3HE   MET   1          HE3       MET   1   4.954   6.563   4.707
   12    H    GLU   2           H        GLU   2   5.800   3.970  -0.303
   13    HA   GLU   2           HA       GLU   2   8.049   2.025  -0.262
   14   1HB   GLU   2          HB2       GLU   2   6.049   1.410   1.218
   15   2HB   GLU   2          HB3       GLU   2   5.101   1.317  -0.263
   16   1HG   GLU   2          HG2       GLU   2   5.851  -0.897   0.592
   17   2HG   GLU   2          HG3       GLU   2   6.435  -0.608  -1.028
   18    H    ASN   3           H        ASN   3   6.734   4.225  -2.153
   19    HA   ASN   3           HA       ASN   3   6.218   2.719  -4.604
   20   1HB   ASN   3          HB2       ASN   3   5.499   5.179  -3.979
   21   2HB   ASN   3          HB3       ASN   3   7.146   5.614  -4.455
   22   1HD2  ASN   3          HD22      ASN   3   7.796   4.985  -6.757
   23   2HD2  ASN   3          HD21      ASN   3   6.477   5.006  -7.947
   24    H    LYS   4           H        LYS   4   7.874   1.988  -5.974
   25    HA   LYS   4           HA       LYS   4  10.647   2.068  -4.995
   26   1HB   LYS   4          HB2       LYS   4   9.208   0.806  -7.365
   27   2HB   LYS   4          HB3       LYS   4  10.940   1.017  -7.436
   28   1HG   LYS   4          HG2       LYS   4  10.659  -1.155  -6.763
   29   2HG   LYS   4          HG3       LYS   4  11.184  -0.318  -5.316
   30   1HD   LYS   4          HD2       LYS   4   8.229  -0.778  -5.857
   31   2HD   LYS   4          HD3       LYS   4   9.214  -2.115  -5.293
   32   1HE   LYS   4          HE2       LYS   4   9.018   0.532  -3.803
   33   2HE   LYS   4          HE3       LYS   4   7.928  -0.820  -3.538
   34   1HZ   LYS   4          HZ1       LYS   4   9.856  -2.172  -2.918
   35   2HZ   LYS   4          HZ2       LYS   4  10.840  -0.864  -3.040
   36   3HZ   LYS   4          HZ3       LYS   4   9.624  -0.892  -1.932
   37    H    ILE   5           H        ILE   5  12.338   2.594  -6.719
   38    HA   ILE   5           HA       ILE   5  11.731   4.926  -8.379
   39    HB   ILE   5           HB       ILE   5  14.029   4.844  -6.388
   40   1HG1  ILE   5          HG12      ILE   5  12.813   7.096  -5.593
   41   2HG1  ILE   5          HG13      ILE   5  11.378   6.215  -6.095
   42   1HG2  ILE   5          HG21      ILE   5  14.610   6.035  -8.468
   43   2HG2  ILE   5          HG22      ILE   5  13.160   7.039  -8.304
   44   3HG2  ILE   5          HG23      ILE   5  14.487   7.172  -7.130
   45   1HD1  ILE   5          HD11      ILE   5  11.912   5.914  -3.691
   46   2HD1  ILE   5          HD12      ILE   5  12.032   4.356  -4.529
   47   3HD1  ILE   5          HD13      ILE   5  13.498   5.249  -4.128
   48    H    ILE   6           H        ILE   6  13.124   4.795 -10.267
   49    HA   ILE   6           HA       ILE   6  15.181   2.685 -10.282
   50    HB   ILE   6           HB       ILE   6  13.163   1.492 -10.882
   51   1HG1  ILE   6          HG12      ILE   6  14.873   1.916 -13.371
   52   2HG1  ILE   6          HG13      ILE   6  15.349   0.947 -11.973
   53   1HG2  ILE   6          HG21      ILE   6  11.787   2.007 -12.829
   54   2HG2  ILE   6          HG22      ILE   6  11.810   3.407 -11.771
   55   3HG2  ILE   6          HG23      ILE   6  12.823   3.386 -13.238
   56   1HD1  ILE   6          HD11      ILE   6  13.000   0.397 -13.830
   57   2HD1  ILE   6          HD12      ILE   6  14.509  -0.511 -13.705
   58   3HD1  ILE   6          HD13      ILE   6  13.362  -0.521 -12.347
   59    H    TYR   7           H        TYR   7  16.794   3.035 -11.847
   60    HA   TYR   7           HA       TYR   7  16.651   5.645 -13.253
   61   1HB   TYR   7          HB2       TYR   7  17.733   5.549 -10.894
   62   2HB   TYR   7          HB3       TYR   7  19.030   4.651 -11.644
   63    HD1  TYR   7           HD1      TYR   7  17.588   7.436 -13.652
   64    HD2  TYR   7           HD2      TYR   7  20.434   6.396 -10.578
   65    HE1  TYR   7           HE1      TYR   7  18.496   9.702 -13.745
   66    HE2  TYR   7           HE2      TYR   7  21.362   8.697 -10.683
   67    HH   TYR   7           HH       TYR   7  19.946  11.241 -12.752
   68    H    PHE   8           H        PHE   8  17.248   5.451 -15.317
   69    HA   PHE   8           HA       PHE   8  18.857   3.064 -16.199
   70   1HB   PHE   8          HB2       PHE   8  17.014   4.878 -17.816
   71   2HB   PHE   8          HB3       PHE   8  17.933   3.519 -18.443
   72    HD1  PHE   8           HD1      PHE   8  14.843   4.547 -16.874
   73    HD2  PHE   8           HD2      PHE   8  17.407   1.156 -17.568
   74    HE1  PHE   8           HE1      PHE   8  12.986   2.996 -16.355
   75    HE2  PHE   8           HE2      PHE   8  15.566  -0.377 -16.982
   76    HZ   PHE   8           HZ       PHE   8  13.347   0.542 -16.339
   77    H    LEU   9           H        LEU   9  20.889   3.455 -16.927
   78    HA   LEU   9           HA       LEU   9  21.687   6.298 -17.323
   79   1HB   LEU   9          HB2       LEU   9  23.115   4.040 -15.893
   80   2HB   LEU   9          HB3       LEU   9  23.784   5.637 -16.221
   81    HG   LEU   9           HG       LEU   9  21.482   5.003 -14.346
   82   1HD1  LEU   9          HD11      LEU   9  24.284   6.112 -13.853
   83   2HD1  LEU   9          HD12      LEU   9  23.044   5.789 -12.625
   84   3HD1  LEU   9          HD13      LEU   9  23.763   4.446 -13.530
   85   1HD2  LEU   9          HD21      LEU   9  20.961   7.150 -15.306
   86   2HD2  LEU   9          HD22      LEU   9  21.693   7.456 -13.739
   87   3HD2  LEU   9          HD23      LEU   9  22.655   7.671 -15.222
   88    H    CYS  10           H        CYS  10  23.219   6.767 -18.819
   89    HA   CYS  10           HA       CYS  10  24.508   4.620 -20.434
   90   1HB   CYS  10          HB2       CYS  10  22.790   6.936 -21.444
   91   2HB   CYS  10          HB3       CYS  10  23.934   6.077 -22.488
   92    HG   CYS  10           HG       CYS  10  21.953   4.315 -20.620
   93    H    THR  11           H        THR  11  26.168   5.866 -22.039
   94    HA   THR  11           HA       THR  11  27.686   7.687 -20.408
   95    HB   THR  11           HB       THR  11  27.961   6.747 -23.253
   96    HG1  THR  11           HG1      THR  11  28.005   5.061 -21.773
   97   1HG2  THR  11          HG21      THR  11  29.380   8.683 -22.888
   98   2HG2  THR  11          HG22      THR  11  30.085   7.891 -21.453
   99   3HG2  THR  11          HG23      THR  11  30.297   7.180 -23.087
  100    H    GLY  12           H        GLY  12  25.050   8.036 -22.737
  101   1HA   GLY  12          HA1       GLY  12  25.088  10.917 -22.189
  102   2HA   GLY  12          HA2       GLY  12  25.057  10.433 -23.892
  103    H    ASN  13           H        ASN  13  23.043  11.532 -21.689
  104    HA   ASN  13           HA       ASN  13  20.995   9.482 -21.615
  105   1HB   ASN  13          HB2       ASN  13  21.441  11.100 -19.751
  106   2HB   ASN  13          HB3       ASN  13  20.836  12.398 -20.785
  107   1HD2  ASN  13          HD22      ASN  13  19.420   9.011 -20.457
  108   2HD2  ASN  13          HD21      ASN  13  17.920   9.598 -19.757
  109    H    SER  14           H        SER  14  21.259   9.679 -24.254
  110    HA   SER  14           HA       SER  14  19.154  11.621 -25.157
  111   1HB   SER  14          HB2       SER  14  21.746  10.854 -26.537
  112   2HB   SER  14          HB3       SER  14  20.509  11.953 -27.181
  113    HG   SER  14           HG       SER  14  20.866  13.355 -25.551
  114    H    CYS  15           H        CYS  15  20.056   8.278 -25.227
  115    HA   CYS  15           HA       CYS  15  18.139   7.825 -27.477
  116   1HB   CYS  15          HB2       CYS  15  20.848   6.477 -27.094
  117   2HB   CYS  15          HB3       CYS  15  19.691   6.162 -28.399
  118    HG   CYS  15           HG       CYS  15  21.862   7.432 -29.142
  119    H    ARG  16           H        ARG  16  19.867   5.139 -26.188
  120    HA   ARG  16           HA       ARG  16  17.483   3.782 -25.644
  121   1HB   ARG  16          HB2       ARG  16  18.915   2.010 -24.802
  122   2HB   ARG  16          HB3       ARG  16  19.546   2.716 -26.292
  123   1HG   ARG  16          HG2       ARG  16  20.883   4.188 -24.399
  124   2HG   ARG  16          HG3       ARG  16  20.650   2.702 -23.511
  125   1HD   ARG  16          HD2       ARG  16  22.366   1.732 -24.606
  126   2HD   ARG  16          HD3       ARG  16  21.615   2.031 -26.170
  127    HE   ARG  16           HE       ARG  16  22.633   4.228 -26.260
  128   1HH1  ARG  16          HH11      ARG  16  24.022   2.197 -23.663
  129   2HH1  ARG  16          HH12      ARG  16  25.251   3.404 -23.303
  130   1HH2  ARG  16          HH21      ARG  16  24.186   5.590 -25.871
  131   2HH2  ARG  16          HH22      ARG  16  25.523   5.211 -24.785
  132    H    SER  17           H        SER  17  19.500   5.571 -23.282
  133    HA   SER  17           HA       SER  17  18.199   4.573 -20.929
  134   1HB   SER  17          HB2       SER  17  18.909   6.904 -20.030
  135   2HB   SER  17          HB3       SER  17  20.153   5.768 -20.485
  136    HG   SER  17           HG       SER  17  20.746   7.057 -22.082
  137    H    GLN  18           H        GLN  18  17.527   7.381 -23.002
  138    HA   GLN  18           HA       GLN  18  15.222   8.334 -21.641
  139   1HB   GLN  18          HB2       GLN  18  16.300   8.607 -24.475
  140   2HB   GLN  18          HB3       GLN  18  14.773   9.310 -24.031
  141   1HG   GLN  18          HG2       GLN  18  17.314   9.886 -22.451
  142   2HG   GLN  18          HG3       GLN  18  16.897  10.789 -23.903
  143   1HE2  GLN  18          HE22      GLN  18  17.008  11.764 -20.974
  144   2HE2  GLN  18          HE21      GLN  18  15.393  12.446 -20.774
  145    H    MET  19           H        MET  19  15.494   6.184 -24.491
  146    HA   MET  19           HA       MET  19  12.750   5.618 -24.786
  147   1HB   MET  19          HB2       MET  19  15.091   3.751 -25.376
  148   2HB   MET  19          HB3       MET  19  13.436   3.544 -25.939
  149   1HG   MET  19          HG2       MET  19  13.703   5.928 -26.967
  150   2HG   MET  19          HG3       MET  19  15.437   5.656 -26.775
  151   1HE   MET  19          HE1       MET  19  15.786   2.529 -27.420
  152   2HE   MET  19          HE2       MET  19  16.108   2.625 -29.164
  153   3HE   MET  19          HE3       MET  19  16.839   3.815 -28.064
  154    H    ALA  20           H        ALA  20  15.148   3.863 -22.721
  155    HA   ALA  20           HA       ALA  20  13.375   1.816 -21.887
  156   1HB   ALA  20          HB1       ALA  20  15.759   3.026 -20.407
  157   2HB   ALA  20          HB2       ALA  20  14.990   1.466 -20.054
  158   3HB   ALA  20          HB3       ALA  20  15.831   1.706 -21.598
  159    H    GLU  21           H        GLU  21  14.108   4.980 -20.380
  160    HA   GLU  21           HA       GLU  21  12.348   4.754 -18.197
  161   1HB   GLU  21          HB2       GLU  21  13.990   6.555 -18.525
  162   2HB   GLU  21          HB3       GLU  21  12.988   7.244 -19.807
  163   1HG   GLU  21          HG2       GLU  21  11.141   7.503 -18.061
  164   2HG   GLU  21          HG3       GLU  21  12.323   7.017 -16.852
  165    H    GLY  22           H        GLY  22  11.559   5.684 -21.593
  166   1HA   GLY  22          HA1       GLY  22   8.795   6.319 -21.213
  167   2HA   GLY  22          HA2       GLY  22   9.546   5.725 -22.710
  168    H    TRP  23           H        TRP  23  10.342   3.200 -22.181
  169    HA   TRP  23           HA       TRP  23   7.887   1.715 -22.216
  170   1HB   TRP  23          HB2       TRP  23  10.783   0.878 -21.787
  171   2HB   TRP  23          HB3       TRP  23   9.449  -0.267 -21.831
  172    HD1  TRP  23           HD1      TRP  23  11.780   1.502 -24.098
  173    HE1  TRP  23           HE1      TRP  23  11.211   1.020 -26.527
  174    HE3  TRP  23           HE3      TRP  23   7.123  -0.508 -23.434
  175    HZ2  TRP  23           HZ2      TRP  23   8.920  -0.014 -28.045
  176    HZ3  TRP  23           HZ3      TRP  23   5.814  -1.319 -25.369
  177    HH2  TRP  23           HH2      TRP  23   6.717  -1.106 -27.671
  178    H    ALA  24           H        ALA  24  10.301   2.239 -19.628
  179    HA   ALA  24           HA       ALA  24   9.151   0.475 -17.766
  180   1HB   ALA  24          HB1       ALA  24  10.829   2.976 -17.387
  181   2HB   ALA  24          HB2       ALA  24  10.576   1.727 -16.144
  182   3HB   ALA  24          HB3       ALA  24  11.442   1.343 -17.638
  183    H    LYS  25           H        LYS  25   8.539   4.008 -18.248
  184    HA   LYS  25           HA       LYS  25   6.847   4.395 -16.033
  185   1HB   LYS  25          HB2       LYS  25   6.907   5.611 -18.813
  186   2HB   LYS  25          HB3       LYS  25   5.665   6.085 -17.646
  187   1HG   LYS  25          HG2       LYS  25   7.275   6.865 -16.053
  188   2HG   LYS  25          HG3       LYS  25   8.625   6.189 -16.980
  189   1HD   LYS  25          HD2       LYS  25   8.203   7.727 -18.828
  190   2HD   LYS  25          HD3       LYS  25   6.796   8.422 -17.981
  191   1HE   LYS  25          HE2       LYS  25   8.172   9.327 -16.227
  192   2HE   LYS  25          HE3       LYS  25   9.545   8.316 -16.702
  193   1HZ   LYS  25          HZ1       LYS  25   8.564  10.695 -18.159
  194   2HZ   LYS  25          HZ2       LYS  25  10.074  10.355 -17.497
  195   3HZ   LYS  25          HZ3       LYS  25   9.586   9.576 -18.811
  196    H    GLN  26           H        GLN  26   5.983   3.044 -19.216
  197    HA   GLN  26           HA       GLN  26   3.216   2.969 -18.425
  198   1HB   GLN  26          HB2       GLN  26   2.701   1.852 -20.464
  199   2HB   GLN  26          HB3       GLN  26   3.665   3.298 -20.738
  200   1HG   GLN  26          HG2       GLN  26   5.503   2.122 -21.514
  201   2HG   GLN  26          HG3       GLN  26   5.021   0.599 -20.732
  202   1HE2  GLN  26          HE22      GLN  26   3.506   2.946 -23.021
  203   2HE2  GLN  26          HE21      GLN  26   2.879   1.726 -24.106
  204    H    TYR  27           H        TYR  27   5.740   0.436 -18.615
  205    HA   TYR  27           HA       TYR  27   3.874  -1.658 -17.877
  206   1HB   TYR  27          HB2       TYR  27   6.914  -1.567 -17.768
  207   2HB   TYR  27          HB3       TYR  27   5.946  -2.992 -17.429
  208    HD1  TYR  27           HD1      TYR  27   7.853  -1.533 -19.895
  209    HD2  TYR  27           HD2      TYR  27   4.064  -3.507 -19.368
  210    HE1  TYR  27           HE1      TYR  27   7.967  -2.344 -22.231
  211    HE2  TYR  27           HE2      TYR  27   4.090  -4.201 -21.745
  212    HH   TYR  27           HH       TYR  27   6.832  -3.461 -23.941
  213    H    LEU  28           H        LEU  28   6.305   0.239 -16.052
  214    HA   LEU  28           HA       LEU  28   5.746  -1.113 -13.547
  215   1HB   LEU  28          HB2       LEU  28   7.261   1.474 -14.060
  216   2HB   LEU  28          HB3       LEU  28   7.316   0.512 -12.613
  217    HG   LEU  28           HG       LEU  28   8.334  -0.399 -15.335
  218   1HD1  LEU  28          HD11      LEU  28   9.643   1.403 -14.166
  219   2HD1  LEU  28          HD12      LEU  28   9.919   0.261 -12.832
  220   3HD1  LEU  28          HD13      LEU  28  10.536  -0.107 -14.457
  221   1HD2  LEU  28          HD21      LEU  28   8.576  -1.814 -12.654
  222   2HD2  LEU  28          HD22      LEU  28   7.542  -2.327 -14.002
  223   3HD2  LEU  28          HD23      LEU  28   9.291  -2.326 -14.198
  224    H    GLY  29           H        GLY  29   4.071   1.374 -15.197
  225   1HA   GLY  29          HA1       GLY  29   2.206   2.529 -14.649
  226   2HA   GLY  29          HA2       GLY  29   2.002   1.363 -13.328
  227    H    ASP  30           H        ASP  30   4.763   3.507 -13.501
  228    HA   ASP  30           HA       ASP  30   5.680   5.006 -12.155
  229   1HB   ASP  30          HB2       ASP  30   3.894   6.375 -13.079
  230   2HB   ASP  30          HB3       ASP  30   2.870   6.014 -11.687
  231    H    GLU  31           H        GLU  31   4.163   2.448 -10.917
  232    HA   GLU  31           HA       GLU  31   4.217   2.919  -8.089
  233   1HB   GLU  31          HB2       GLU  31   4.595   0.341  -9.646
  234   2HB   GLU  31          HB3       GLU  31   4.338   0.452  -7.912
  235   1HG   GLU  31          HG2       GLU  31   2.382   1.491  -9.992
  236   2HG   GLU  31          HG3       GLU  31   2.309  -0.120  -9.285
  237    H    TRP  32           H        TRP  32   6.571   2.957 -10.430
  238    HA   TRP  32           HA       TRP  32   8.811   2.804  -8.546
  239   1HB   TRP  32          HB2       TRP  32   8.901   1.960 -11.468
  240   2HB   TRP  32          HB3       TRP  32  10.218   1.904 -10.318
  241    HD1  TRP  32           HD1      TRP  32   6.662   0.296 -10.447
  242    HE1  TRP  32           HE1      TRP  32   6.808  -2.157  -9.878
  243    HE3  TRP  32           HE3      TRP  32  11.735  -0.061  -9.747
  244    HZ2  TRP  32           HZ2      TRP  32   8.857  -4.117  -9.480
  245    HZ3  TRP  32           HZ3      TRP  32  12.758  -2.279  -9.334
  246    HH2  TRP  32           HH2      TRP  32  11.335  -4.330  -9.273
  247    H    LYS  33           H        LYS  33   9.458   4.961  -8.473
  248    HA   LYS  33           HA       LYS  33   8.625   6.945 -10.374
  249   1HB   LYS  33          HB2       LYS  33  10.723   6.937  -8.152
  250   2HB   LYS  33          HB3       LYS  33  10.282   8.369  -9.087
  251   1HG   LYS  33          HG2       LYS  33   8.651   6.853  -7.048
  252   2HG   LYS  33          HG3       LYS  33   9.166   8.524  -7.004
  253   1HD   LYS  33          HD2       LYS  33   7.031   7.351  -8.840
  254   2HD   LYS  33          HD3       LYS  33   6.762   8.354  -7.418
  255   1HE   LYS  33          HE2       LYS  33   7.863  10.270  -8.469
  256   2HE   LYS  33          HE3       LYS  33   8.319   9.288  -9.869
  257   1HZ   LYS  33          HZ1       LYS  33   5.980   8.991 -10.377
  258   2HZ   LYS  33          HZ2       LYS  33   5.534   9.914  -9.094
  259   3HZ   LYS  33          HZ3       LYS  33   6.354  10.591 -10.335
  260    H    VAL  34           H        VAL  34   9.334   6.622 -12.438
  261    HA   VAL  34           HA       VAL  34  11.902   5.436 -12.923
  262    HB   VAL  34           HB       VAL  34  10.063   6.559 -15.043
  263   1HG1  VAL  34          HG11      VAL  34  11.463   3.885 -15.038
  264   2HG1  VAL  34          HG12      VAL  34  10.936   4.899 -16.405
  265   3HG1  VAL  34          HG13      VAL  34  12.363   5.349 -15.452
  266   1HG2  VAL  34          HG21      VAL  34   8.427   5.352 -13.759
  267   2HG2  VAL  34          HG22      VAL  34   8.879   4.335 -15.123
  268   3HG2  VAL  34          HG23      VAL  34   9.539   3.981 -13.518
  269    H    TYR  35           H        TYR  35  13.746   6.453 -13.619
  270    HA   TYR  35           HA       TYR  35  13.664   9.210 -14.723
  271   1HB   TYR  35          HB2       TYR  35  15.491   8.202 -12.492
  272   2HB   TYR  35          HB3       TYR  35  15.688   9.729 -13.329
  273    HD1  TYR  35           HD1      TYR  35  14.049  11.593 -13.009
  274    HD2  TYR  35           HD2      TYR  35  13.903   7.961 -10.681
  275    HE1  TYR  35           HE1      TYR  35  12.669  12.748 -11.304
  276    HE2  TYR  35           HE2      TYR  35  12.548   9.112  -8.962
  277    HH   TYR  35           HH       TYR  35  11.526  11.111  -8.312
  278    H    SER  36           H        SER  36  15.796   9.704 -15.844
  279    HA   SER  36           HA       SER  36  17.641   7.499 -16.117
  280   1HB   SER  36          HB2       SER  36  17.694   7.501 -18.532
  281   2HB   SER  36          HB3       SER  36  16.080   7.063 -17.981
  282    HG   SER  36           HG       SER  36  15.342   9.078 -18.504
  283    H    ALA  37           H        ALA  37  19.713   8.202 -17.072
  284    HA   ALA  37           HA       ALA  37  20.245  11.002 -17.515
  285   1HB   ALA  37          HB1       ALA  37  20.026  11.083 -15.061
  286   2HB   ALA  37          HB2       ALA  37  21.241   9.792 -14.900
  287   3HB   ALA  37          HB3       ALA  37  21.674  11.381 -15.568
  288    H    GLY  38           H        GLY  38  22.994  11.074 -17.062
  289   1HA   GLY  38          HA1       GLY  38  24.386   8.665 -17.542
  290   2HA   GLY  38          HA2       GLY  38  24.161   9.510 -19.087
  291    H    ILE  39           H        ILE  39  26.633   9.291 -18.694
  292    HA   ILE  39           HA       ILE  39  28.077  11.034 -17.011
  293    HB   ILE  39           HB       ILE  39  28.522   9.514 -19.556
  294   1HG1  ILE  39          HG12      ILE  39  30.173   9.607 -17.019
  295   2HG1  ILE  39          HG13      ILE  39  28.759   8.580 -17.232
  296   1HG2  ILE  39          HG21      ILE  39  29.626  11.569 -20.173
  297   2HG2  ILE  39          HG22      ILE  39  30.550  11.565 -18.645
  298   3HG2  ILE  39          HG23      ILE  39  30.808  10.313 -19.884
  299   1HD1  ILE  39          HD11      ILE  39  31.278   8.401 -18.945
  300   2HD1  ILE  39          HD12      ILE  39  30.825   7.330 -17.628
  301   3HD1  ILE  39          HD13      ILE  39  29.826   7.382 -19.092
  302    H    GLU  40           H        GLU  40  26.212  11.706 -19.934
  303    HA   GLU  40           HA       GLU  40  26.504  14.516 -19.415
  304   1HB   GLU  40          HB2       GLU  40  26.939  15.180 -21.698
  305   2HB   GLU  40          HB3       GLU  40  28.299  14.293 -21.026
  306   1HG   GLU  40          HG2       GLU  40  27.852  12.356 -22.335
  307   2HG   GLU  40          HG3       GLU  40  26.210  12.877 -22.727
  308    H    ALA  41           H        ALA  41  24.902  15.730 -20.845
  309    HA   ALA  41           HA       ALA  41  22.800  14.177 -22.114
  310   1HB   ALA  41          HB1       ALA  41  21.032  15.461 -20.840
  311   2HB   ALA  41          HB2       ALA  41  21.909  14.283 -19.836
  312   3HB   ALA  41          HB3       ALA  41  22.285  16.020 -19.722
  313    H    HIS  42           H        HIS  42  22.154  15.342 -23.874
  314    HA   HIS  42           HA       HIS  42  22.492  18.287 -23.910
  315   1HB   HIS  42          HB2       HIS  42  23.604  16.310 -25.942
  316   2HB   HIS  42          HB3       HIS  42  23.304  18.002 -26.331
  317    HD1  HIS  42           HD1      HIS  42  26.032  15.906 -24.785
  318    HD2  HIS  42           HD2      HIS  42  24.609  19.888 -24.726
  319    HE1  HIS  42           HE1      HIS  42  27.890  17.321 -23.821
  320    H    GLY  43           H        GLY  43  20.287  16.138 -23.625
  321   1HA   GLY  43          HA1       GLY  43  17.981  16.597 -24.100
  322   2HA   GLY  43          HA2       GLY  43  18.427  17.278 -25.670
  323    H    LEU  44           H        LEU  44  16.542  15.419 -25.762
  324    HA   LEU  44           HA       LEU  44  17.771  12.780 -26.130
  325   1HB   LEU  44          HB2       LEU  44  15.639  11.838 -26.035
  326   2HB   LEU  44          HB3       LEU  44  15.763  12.988 -24.713
  327    HG   LEU  44           HG       LEU  44  14.225  13.357 -27.320
  328   1HD1  LEU  44          HD11      LEU  44  13.276  11.744 -25.691
  329   2HD1  LEU  44          HD12      LEU  44  13.294  12.989 -24.433
  330   3HD1  LEU  44          HD13      LEU  44  12.248  13.179 -25.849
  331   1HD2  LEU  44          HD21      LEU  44  13.188  15.355 -26.185
  332   2HD2  LEU  44          HD22      LEU  44  14.438  15.247 -24.930
  333   3HD2  LEU  44          HD23      LEU  44  14.870  15.597 -26.631
  334    H    ASN  45           H        ASN  45  17.527  11.554 -27.995
  335    HA   ASN  45           HA       ASN  45  18.132  13.079 -30.351
  336   1HB   ASN  45          HB2       ASN  45  19.213  10.951 -29.595
  337   2HB   ASN  45          HB3       ASN  45  17.718  10.084 -29.910
  338   1HD2  ASN  45          HD22      ASN  45  20.687  10.494 -31.157
  339   2HD2  ASN  45          HD21      ASN  45  20.328  10.363 -32.864
  340    HA   PRO  46           HA       PRO  46  13.931  13.230 -31.886
  341   1HB   PRO  46          HB2       PRO  46  14.313  13.487 -34.624
  342   2HB   PRO  46          HB3       PRO  46  14.472  14.810 -33.430
  343   1HG   PRO  46          HG2       PRO  46  16.664  13.075 -34.599
  344   2HG   PRO  46          HG3       PRO  46  16.644  14.859 -34.406
  345   1HD   PRO  46          HD2       PRO  46  17.922  13.282 -32.626
  346   2HD   PRO  46          HD3       PRO  46  16.980  14.691 -32.060
  347    H    ASN  47           H        ASN  47  16.192  10.767 -33.195
  348    HA   ASN  47           HA       ASN  47  14.006   9.171 -34.325
  349   1HB   ASN  47          HB2       ASN  47  16.960   8.699 -33.916
  350   2HB   ASN  47          HB3       ASN  47  15.876   7.335 -34.119
  351   1HD2  ASN  47          HD22      ASN  47  18.062   8.403 -35.914
  352   2HD2  ASN  47          HD21      ASN  47  17.265   8.497 -37.465
  353    H    ALA  48           H        ALA  48  15.520   9.592 -31.151
  354    HA   ALA  48           HA       ALA  48  14.453   7.170 -30.024
  355   1HB   ALA  48          HB1       ALA  48  15.046   9.752 -28.502
  356   2HB   ALA  48          HB2       ALA  48  14.998   8.100 -27.884
  357   3HB   ALA  48          HB3       ALA  48  16.306   8.606 -28.968
  358    H    VAL  49           H        VAL  49  13.365  10.612 -30.164
  359    HA   VAL  49           HA       VAL  49  10.880  10.230 -28.879
  360    HB   VAL  49           HB       VAL  49  11.599  12.237 -31.064
  361   1HG1  VAL  49          HG11      VAL  49   9.348  12.282 -28.997
  362   2HG1  VAL  49          HG12      VAL  49   9.811  13.644 -30.033
  363   3HG1  VAL  49          HG13      VAL  49   9.167  12.176 -30.769
  364   1HG2  VAL  49          HG21      VAL  49  12.025  13.781 -29.168
  365   2HG2  VAL  49          HG22      VAL  49  11.719  12.457 -28.027
  366   3HG2  VAL  49          HG23      VAL  49  13.118  12.399 -29.123
  367    H    LYS  50           H        LYS  50  11.664  10.020 -32.426
  368    HA   LYS  50           HA       LYS  50   9.076   9.227 -33.274
  369   1HB   LYS  50          HB2       LYS  50  11.843   8.482 -34.308
  370   2HB   LYS  50          HB3       LYS  50  10.343   7.934 -35.057
  371   1HG   LYS  50          HG2       LYS  50   9.683  10.125 -35.693
  372   2HG   LYS  50          HG3       LYS  50  10.948  10.885 -34.710
  373   1HD   LYS  50          HD2       LYS  50  11.512  10.804 -37.149
  374   2HD   LYS  50          HD3       LYS  50  12.693  10.020 -36.101
  375   1HE   LYS  50          HE2       LYS  50  11.525   7.776 -36.654
  376   2HE   LYS  50          HE3       LYS  50  10.602   8.651 -37.863
  377   1HZ   LYS  50          HZ1       LYS  50  12.610   7.651 -38.805
  378   2HZ   LYS  50          HZ2       LYS  50  12.724   9.277 -38.917
  379   3HZ   LYS  50          HZ3       LYS  50  13.571   8.478 -37.756
  380    H    ALA  51           H        ALA  51  11.825   7.179 -32.117
  381    HA   ALA  51           HA       ALA  51  10.674   4.714 -32.734
  382   1HB   ALA  51          HB1       ALA  51  12.269   3.802 -31.060
  383   2HB   ALA  51          HB2       ALA  51  13.041   5.024 -32.070
  384   3HB   ALA  51          HB3       ALA  51  12.538   5.430 -30.419
  385    H    MET  52           H        MET  52  10.358   6.682 -29.758
  386    HA   MET  52           HA       MET  52   8.618   4.776 -28.478
  387   1HB   MET  52          HB2       MET  52   9.038   7.737 -27.903
  388   2HB   MET  52          HB3       MET  52   8.230   6.581 -26.847
  389   1HG   MET  52          HG2       MET  52  11.149   6.735 -27.583
  390   2HG   MET  52          HG3       MET  52  10.407   6.764 -25.997
  391   1HE   MET  52          HE1       MET  52   9.214   4.745 -24.948
  392   2HE   MET  52          HE2       MET  52   8.425   4.074 -26.411
  393   3HE   MET  52          HE3       MET  52   9.450   3.054 -25.396
  394    H    LYS  53           H        LYS  53   7.955   7.736 -30.458
  395    HA   LYS  53           HA       LYS  53   5.129   7.533 -30.128
  396   1HB   LYS  53          HB2       LYS  53   6.946   8.893 -32.100
  397   2HB   LYS  53          HB3       LYS  53   5.277   8.610 -32.582
  398   1HG   LYS  53          HG2       LYS  53   5.281  10.764 -31.605
  399   2HG   LYS  53          HG3       LYS  53   4.477   9.675 -30.469
  400   1HD   LYS  53          HD2       LYS  53   6.751   9.519 -29.250
  401   2HD   LYS  53          HD3       LYS  53   7.274  10.866 -30.259
  402   1HE   LYS  53          HE2       LYS  53   4.832  10.830 -28.430
  403   2HE   LYS  53          HE3       LYS  53   6.418  11.451 -27.965
  404   1HZ   LYS  53          HZ1       LYS  53   6.224  13.129 -29.707
  405   2HZ   LYS  53          HZ2       LYS  53   4.720  12.600 -30.099
  406   3HZ   LYS  53          HZ3       LYS  53   5.013  13.246 -28.630
  407    H    GLU  54           H        GLU  54   7.387   5.656 -32.085
  408    HA   GLU  54           HA       GLU  54   5.418   4.672 -33.896
  409   1HB   GLU  54          HB2       GLU  54   8.008   4.921 -34.147
  410   2HB   GLU  54          HB3       GLU  54   8.070   3.334 -33.400
  411   1HG   GLU  54          HG2       GLU  54   6.545   4.129 -35.933
  412   2HG   GLU  54          HG3       GLU  54   8.170   3.471 -35.921
  413    H    VAL  55           H        VAL  55   6.022   3.997 -30.579
  414    HA   VAL  55           HA       VAL  55   4.326   1.545 -30.798
  415    HB   VAL  55           HB       VAL  55   5.354   0.869 -28.642
  416   1HG1  VAL  55          HG11      VAL  55   7.274   1.263 -30.960
  417   2HG1  VAL  55          HG12      VAL  55   7.433   0.053 -29.675
  418   3HG1  VAL  55          HG13      VAL  55   6.085  -0.040 -30.809
  419   1HG2  VAL  55          HG21      VAL  55   7.418   3.044 -29.171
  420   2HG2  VAL  55          HG22      VAL  55   6.137   3.174 -27.942
  421   3HG2  VAL  55          HG23      VAL  55   7.365   1.930 -27.806
  422    H    GLY  56           H        GLY  56   4.155   4.798 -29.989
  423   1HA   GLY  56          HA1       GLY  56   2.173   5.828 -29.345
  424   2HA   GLY  56          HA2       GLY  56   1.552   4.303 -28.695
  425    H    ILE  57           H        ILE  57   4.750   5.743 -27.999
  426    HA   ILE  57           HA       ILE  57   3.963   6.296 -25.178
  427    HB   ILE  57           HB       ILE  57   6.508   5.094 -26.324
  428   1HG1  ILE  57          HG12      ILE  57   4.439   4.085 -24.348
  429   2HG1  ILE  57          HG13      ILE  57   4.667   3.498 -25.992
  430   1HG2  ILE  57          HG21      ILE  57   5.961   6.133 -23.507
  431   2HG2  ILE  57          HG22      ILE  57   7.322   5.087 -23.918
  432   3HG2  ILE  57          HG23      ILE  57   7.228   6.683 -24.632
  433   1HD1  ILE  57          HD11      ILE  57   6.483   3.039 -23.618
  434   2HD1  ILE  57          HD12      ILE  57   5.638   1.857 -24.621
  435   3HD1  ILE  57          HD13      ILE  57   6.998   2.731 -25.304
  436    H    ASP  58           H        ASP  58   5.344   8.075 -24.313
  437    HA   ASP  58           HA       ASP  58   6.504   9.872 -26.360
  438   1HB   ASP  58          HB2       ASP  58   4.396  10.948 -25.805
  439   2HB   ASP  58          HB3       ASP  58   4.688  10.719 -24.066
  440    H    ILE  59           H        ILE  59   8.380  10.774 -25.737
  441    HA   ILE  59           HA       ILE  59   9.270  10.550 -22.934
  442    HB   ILE  59           HB       ILE  59  11.606  10.077 -23.739
  443   1HG1  ILE  59          HG12      ILE  59  10.289   9.198 -26.342
  444   2HG1  ILE  59          HG13      ILE  59  11.172  10.709 -26.159
  445   1HG2  ILE  59          HG21      ILE  59  11.225   7.656 -23.827
  446   2HG2  ILE  59          HG22      ILE  59  10.097   8.390 -22.695
  447   3HG2  ILE  59          HG23      ILE  59   9.530   7.905 -24.297
  448   1HD1  ILE  59          HD11      ILE  59  12.369   7.929 -25.730
  449   2HD1  ILE  59          HD12      ILE  59  12.609   8.988 -27.127
  450   3HD1  ILE  59          HD13      ILE  59  13.219   9.472 -25.546
  451    H    SER  60           H        SER  60   8.296  12.621 -25.279
  452    HA   SER  60           HA       SER  60  10.319  14.644 -25.183
  453   1HB   SER  60          HB2       SER  60   7.369  15.236 -25.419
  454   2HB   SER  60          HB3       SER  60   8.745  16.052 -26.186
  455    HG   SER  60           HG       SER  60   7.516  13.581 -26.749
  456    H    ASN  61           H        ASN  61   7.765  13.624 -23.001
  457    HA   ASN  61           HA       ASN  61   7.702  15.780 -21.187
  458   1HB   ASN  61          HB2       ASN  61   6.617  14.219 -19.669
  459   2HB   ASN  61          HB3       ASN  61   6.026  13.944 -21.296
  460   1HD2  ASN  61          HD21      ASN  61   6.596  12.001 -22.384
  461   2HD2  ASN  61          HD22      ASN  61   7.265  10.614 -21.552
  462    H    GLN  62           H        GLN  62  10.517  13.910 -21.707
  463    HA   GLN  62           HA       GLN  62  11.407  14.315 -18.899
  464   1HB   GLN  62          HB2       GLN  62  12.382  11.961 -19.005
  465   2HB   GLN  62          HB3       GLN  62  10.626  12.066 -18.877
  466   1HG   GLN  62          HG2       GLN  62  10.307  11.575 -21.195
  467   2HG   GLN  62          HG3       GLN  62  12.026  11.820 -21.542
  468   1HE2  GLN  62          HE22      GLN  62  13.277  10.126 -21.690
  469   2HE2  GLN  62          HE21      GLN  62  12.792   8.466 -21.313
  470    H    THR  63           H        THR  63  12.108  16.105 -20.717
  471    HA   THR  63           HA       THR  63  14.288  15.701 -22.359
  472    HB   THR  63           HB       THR  63  14.766  18.183 -21.722
  473    HG1  THR  63           HG1      THR  63  13.738  18.166 -19.681
  474   1HG2  THR  63          HG21      THR  63  11.967  17.365 -22.631
  475   2HG2  THR  63          HG22      THR  63  12.743  18.940 -22.919
  476   3HG2  THR  63          HG23      THR  63  13.400  17.479 -23.675
  477    H    SER  64           H        SER  64  16.397  15.321 -22.153
  478    HA   SER  64           HA       SER  64  17.323  13.933 -20.104
  479   1HB   SER  64          HB2       SER  64  19.013  15.537 -22.046
  480   2HB   SER  64          HB3       SER  64  19.378  13.947 -21.357
  481    HG   SER  64           HG       SER  64  18.399  13.152 -22.977
  482    H    ASP  65           H        ASP  65  19.054  14.057 -18.678
  483    HA   ASP  65           HA       ASP  65  20.280  16.604 -17.980
  484   1HB   ASP  65          HB2       ASP  65  18.153  16.576 -16.625
  485   2HB   ASP  65          HB3       ASP  65  18.689  15.066 -15.883
  486    H    ILE  66           H        ILE  66  22.081  16.238 -16.480
  487    HA   ILE  66           HA       ILE  66  23.459  13.683 -16.892
  488    HB   ILE  66           HB       ILE  66  25.051  14.959 -15.158
  489   1HG1  ILE  66          HG12      ILE  66  23.441  16.980 -15.017
  490   2HG1  ILE  66          HG13      ILE  66  25.167  17.228 -15.172
  491   1HG2  ILE  66          HG21      ILE  66  26.313  15.770 -17.105
  492   2HG2  ILE  66          HG22      ILE  66  25.695  14.124 -17.289
  493   3HG2  ILE  66          HG23      ILE  66  24.882  15.466 -18.126
  494   1HD1  ILE  66          HD11      ILE  66  23.252  17.457 -17.538
  495   2HD1  ILE  66          HD12      ILE  66  23.878  18.804 -16.574
  496   3HD1  ILE  66          HD13      ILE  66  24.985  17.813 -17.534
  497    H    ILE  67           H        ILE  67  24.405  12.626 -14.957
  498    HA   ILE  67           HA       ILE  67  22.402  11.603 -13.288
  499    HB   ILE  67           HB       ILE  67  25.434  11.498 -13.242
  500   1HG1  ILE  67          HG12      ILE  67  23.335   9.343 -13.756
  501   2HG1  ILE  67          HG13      ILE  67  23.977  10.356 -15.038
  502   1HG2  ILE  67          HG21      ILE  67  23.541   9.958 -11.409
  503   2HG2  ILE  67          HG22      ILE  67  25.286   9.657 -11.590
  504   3HG2  ILE  67          HG23      ILE  67  24.737  11.169 -10.889
  505   1HD1  ILE  67          HD11      ILE  67  26.275   9.521 -14.550
  506   2HD1  ILE  67          HD12      ILE  67  25.566   8.372 -13.385
  507   3HD1  ILE  67          HD13      ILE  67  25.131   8.279 -15.097
  508    H    ASP  68           H        ASP  68  21.891  11.874 -11.162
  509    HA   ASP  68           HA       ASP  68  23.114  14.119  -9.652
  510   1HB   ASP  68          HB2       ASP  68  21.030  14.942 -10.762
  511   2HB   ASP  68          HB3       ASP  68  20.116  13.692  -9.906
  512    H    SER  69           H        SER  69  23.490  13.647  -7.589
  513    HA   SER  69           HA       SER  69  23.585  11.080  -6.646
  514   1HB   SER  69          HB2       SER  69  23.456  13.600  -4.961
  515   2HB   SER  69          HB3       SER  69  24.319  12.096  -4.591
  516    HG   SER  69           HG       SER  69  25.709  13.726  -5.426
  517    H    ASP  70           H        ASP  70  20.795  13.229  -6.491
  518    HA   ASP  70           HA       ASP  70  19.736  11.895  -4.133
  519   1HB   ASP  70          HB2       ASP  70  19.462  14.355  -4.545
  520   2HB   ASP  70          HB3       ASP  70  18.434  13.977  -5.934
  521    H    ILE  71           H        ILE  71  19.836  11.096  -7.382
  522    HA   ILE  71           HA       ILE  71  17.414   9.379  -7.149
  523    HB   ILE  71           HB       ILE  71  18.983  10.144  -9.630
  524   1HG1  ILE  71          HG12      ILE  71  16.116  11.031  -9.135
  525   2HG1  ILE  71          HG13      ILE  71  17.431  12.003  -8.489
  526   1HG2  ILE  71          HG21      ILE  71  17.920   7.923  -9.724
  527   2HG2  ILE  71          HG22      ILE  71  16.356   8.617  -9.258
  528   3HG2  ILE  71          HG23      ILE  71  17.095   9.036 -10.818
  529   1HD1  ILE  71          HD11      ILE  71  16.794  12.854 -10.659
  530   2HD1  ILE  71          HD12      ILE  71  18.455  12.232 -10.677
  531   3HD1  ILE  71          HD13      ILE  71  17.138  11.285 -11.420
  532    H    LEU  72           H        LEU  72  20.922   9.537  -7.988
  533    HA   LEU  72           HA       LEU  72  21.527   6.838  -8.260
  534   1HB   LEU  72          HB2       LEU  72  23.066   8.983  -6.737
  535   2HB   LEU  72          HB3       LEU  72  23.686   7.363  -6.945
  536    HG   LEU  72           HG       LEU  72  23.113   9.299  -9.193
  537   1HD1  LEU  72          HD11      LEU  72  25.636   9.322  -9.322
  538   2HD1  LEU  72          HD12      LEU  72  25.013   9.971  -7.804
  539   3HD1  LEU  72          HD13      LEU  72  25.688   8.333  -7.856
  540   1HD2  LEU  72          HD21      LEU  72  24.377   6.505  -9.189
  541   2HD2  LEU  72          HD22      LEU  72  22.860   6.962  -9.985
  542   3HD2  LEU  72          HD23      LEU  72  24.388   7.609 -10.577
  543    H    ASN  73           H        ASN  73  21.667   8.563  -5.129
  544    HA   ASN  73           HA       ASN  73  22.030   6.118  -3.669
  545   1HB   ASN  73          HB2       ASN  73  21.309   8.917  -2.670
  546   2HB   ASN  73          HB3       ASN  73  21.818   7.591  -1.641
  547   1HD2  ASN  73          HD22      ASN  73  22.905  10.132  -3.711
  548   2HD2  ASN  73          HD21      ASN  73  24.629   9.829  -3.501
  549    H    ASN  74           H        ASN  74  19.236   7.168  -5.060
  550    HA   ASN  74           HA       ASN  74  17.427   6.502  -2.773
  551   1HB   ASN  74          HB2       ASN  74  17.551   8.842  -3.606
  552   2HB   ASN  74          HB3       ASN  74  17.154   8.274  -5.223
  553   1HD2  ASN  74          HD22      ASN  74  15.572  10.032  -4.888
  554   2HD2  ASN  74          HD21      ASN  74  14.005   9.604  -4.217
  555    H    ALA  75           H        ALA  75  18.214   5.912  -6.169
  556    HA   ALA  75           HA       ALA  75  15.877   4.577  -6.983
  557   1HB   ALA  75          HB1       ALA  75  17.212   3.840  -8.860
  558   2HB   ALA  75          HB2       ALA  75  17.495   5.547  -8.505
  559   3HB   ALA  75          HB3       ALA  75  18.706   4.339  -8.011
  560    H    ASP  76           H        ASP  76  15.060   2.671  -6.503
  561    HA   ASP  76           HA       ASP  76  16.264   0.800  -4.698
  562   1HB   ASP  76          HB2       ASP  76  13.818   0.971  -4.960
  563   2HB   ASP  76          HB3       ASP  76  13.945   0.468  -6.648
  564    H    LEU  77           H        LEU  77  16.241   1.250  -8.195
  565    HA   LEU  77           HA       LEU  77  18.286  -0.855  -8.485
  566   1HB   LEU  77          HB2       LEU  77  16.183  -1.999  -9.091
  567   2HB   LEU  77          HB3       LEU  77  15.729  -0.657 -10.138
  568    HG   LEU  77           HG       LEU  77  17.667  -1.150 -11.632
  569   1HD1  LEU  77          HD11      LEU  77  18.039  -3.655  -9.928
  570   2HD1  LEU  77          HD12      LEU  77  18.904  -3.244 -11.421
  571   3HD1  LEU  77          HD13      LEU  77  19.171  -2.284  -9.976
  572   1HD2  LEU  77          HD21      LEU  77  15.471  -2.091 -12.115
  573   2HD2  LEU  77          HD22      LEU  77  16.750  -3.207 -12.605
  574   3HD2  LEU  77          HD23      LEU  77  15.836  -3.509 -11.109
  575    H    VAL  78           H        VAL  78  19.848  -0.235  -9.891
  576    HA   VAL  78           HA       VAL  78  19.320   2.088 -11.679
  577    HB   VAL  78           HB       VAL  78  21.972   1.256 -10.426
  578   1HG1  VAL  78          HG11      VAL  78  22.658   3.547 -11.330
  579   2HG1  VAL  78          HG12      VAL  78  22.337   2.339 -12.577
  580   3HG1  VAL  78          HG13      VAL  78  21.131   3.595 -12.216
  581   1HG2  VAL  78          HG21      VAL  78  20.138   3.606  -9.754
  582   2HG2  VAL  78          HG22      VAL  78  20.540   2.249  -8.681
  583   3HG2  VAL  78          HG23      VAL  78  21.794   3.398  -9.143
  584    H    VAL  79           H        VAL  79  19.994   1.746 -13.872
  585    HA   VAL  79           HA       VAL  79  20.980  -0.988 -14.534
  586    HB   VAL  79           HB       VAL  79  18.858   0.535 -16.076
  587   1HG1  VAL  79          HG11      VAL  79  18.449  -1.617 -17.167
  588   2HG1  VAL  79          HG12      VAL  79  20.161  -1.208 -17.315
  589   3HG1  VAL  79          HG13      VAL  79  19.644  -2.409 -16.124
  590   1HG2  VAL  79          HG21      VAL  79  18.373  -1.606 -13.976
  591   2HG2  VAL  79          HG22      VAL  79  17.755   0.060 -13.987
  592   3HG2  VAL  79          HG23      VAL  79  17.178  -1.095 -15.184
  593    H    THR  80           H        THR  80  22.827  -0.802 -15.751
  594    HA   THR  80           HA       THR  80  23.270   1.768 -17.213
  595    HB   THR  80           HB       THR  80  25.717   0.726 -17.257
  596    HG1  THR  80           HG1      THR  80  25.103  -1.140 -15.995
  597   1HG2  THR  80          HG21      THR  80  26.212   2.146 -15.317
  598   2HG2  THR  80          HG22      THR  80  25.028   2.904 -16.372
  599   3HG2  THR  80          HG23      THR  80  24.492   2.136 -14.854
  600    H    LEU  81           H        LEU  81  22.976   1.801 -19.269
  601    HA   LEU  81           HA       LEU  81  22.596  -0.751 -20.717
  602   1HB   LEU  81          HB2       LEU  81  21.760   2.098 -21.324
  603   2HB   LEU  81          HB3       LEU  81  21.453   0.732 -22.375
  604    HG   LEU  81           HG       LEU  81  19.948  -0.275 -20.724
  605   1HD1  LEU  81          HD11      LEU  81  20.424   2.295 -19.134
  606   2HD1  LEU  81          HD12      LEU  81  19.081   1.168 -18.866
  607   3HD1  LEU  81          HD13      LEU  81  20.721   0.626 -18.587
  608   1HD2  LEU  81          HD21      LEU  81  19.011   1.194 -22.455
  609   2HD2  LEU  81          HD22      LEU  81  18.115   1.409 -20.955
  610   3HD2  LEU  81          HD23      LEU  81  19.305   2.624 -21.438
  611    H    CYS  82           H        CYS  82  25.306   0.852 -20.227
  612    HA   CYS  82           HA       CYS  82  26.251   1.634 -22.822
  613   1HB   CYS  82          HB2       CYS  82  28.478   1.452 -21.695
  614   2HB   CYS  82          HB3       CYS  82  27.347   2.564 -20.939
  615    H    GLY  83           H        GLY  83  26.505   0.241 -24.522
  616   1HA   GLY  83          HA1       GLY  83  28.103  -2.204 -23.974
  617   2HA   GLY  83          HA2       GLY  83  26.600  -2.364 -24.862
  618    H    ASP  84           H        ASP  84  27.484   0.578 -25.985
  619    HA   ASP  84           HA       ASP  84  28.902  -0.392 -28.346
  620   1HB   ASP  84          HB2       ASP  84  27.441   1.453 -28.737
  621   2HB   ASP  84          HB3       ASP  84  28.044   2.340 -27.345
  622    H    ALA  85           H        ALA  85  31.041   0.148 -28.849
  623    HA   ALA  85           HA       ALA  85  32.884  -0.386 -26.802
  624   1HB   ALA  85          HB1       ALA  85  33.196  -0.990 -29.176
  625   2HB   ALA  85          HB2       ALA  85  33.387   0.731 -29.594
  626   3HB   ALA  85          HB3       ALA  85  34.582  -0.075 -28.559
  627    H    ALA  86           H        ALA  86  31.608   2.759 -27.681
  628    HA   ALA  86           HA       ALA  86  33.807   4.068 -26.134
  629   1HB   ALA  86          HB1       ALA  86  33.337   6.085 -27.382
  630   2HB   ALA  86          HB2       ALA  86  33.730   4.770 -28.511
  631   3HB   ALA  86          HB3       ALA  86  32.032   5.279 -28.279
  632    H    ASP  87           H        ASP  87  30.928   2.820 -25.497
  633    HA   ASP  87           HA       ASP  87  29.765   5.135 -24.111
  634   1HB   ASP  87          HB2       ASP  87  28.573   2.956 -25.257
  635   2HB   ASP  87          HB3       ASP  87  28.665   2.413 -23.595
  636    H    LYS  88           H        LYS  88  31.430   5.680 -22.772
  637    HA   LYS  88           HA       LYS  88  33.255   4.053 -21.492
  638   1HB   LYS  88          HB2       LYS  88  32.250   6.843 -20.909
  639   2HB   LYS  88          HB3       LYS  88  33.233   6.047 -19.704
  640   1HG   LYS  88          HG2       LYS  88  34.738   7.313 -20.987
  641   2HG   LYS  88          HG3       LYS  88  35.020   5.616 -21.352
  642   1HD   LYS  88          HD2       LYS  88  35.211   6.866 -23.382
  643   2HD   LYS  88          HD3       LYS  88  33.750   5.890 -23.486
  644   1HE   LYS  88          HE2       LYS  88  32.443   7.972 -22.737
  645   2HE   LYS  88          HE3       LYS  88  33.955   8.875 -22.831
  646   1HZ   LYS  88          HZ1       LYS  88  32.654   9.102 -24.858
  647   2HZ   LYS  88          HZ2       LYS  88  34.051   8.337 -25.198
  648   3HZ   LYS  88          HZ3       LYS  88  32.652   7.478 -25.100
  649    H    CYS  89           H        CYS  89  29.982   4.641 -20.452
  650    HA   CYS  89           HA       CYS  89  28.654   3.620 -18.975
  651   1HB   CYS  89          HB2       CYS  89  31.042   2.202 -17.763
  652   2HB   CYS  89          HB3       CYS  89  29.383   2.006 -17.280
  653    HA   PRO  90           HA       PRO  90  29.496   6.628 -15.631
  654   1HB   PRO  90          HB2       PRO  90  26.991   6.475 -14.451
  655   2HB   PRO  90          HB3       PRO  90  27.432   7.547 -15.807
  656   1HG   PRO  90          HG2       PRO  90  25.984   4.932 -15.861
  657   2HG   PRO  90          HG3       PRO  90  25.725   6.392 -16.877
  658   1HD   PRO  90          HD2       PRO  90  27.054   4.133 -17.717
  659   2HD   PRO  90          HD3       PRO  90  27.388   5.770 -18.363
  660    H    MET  91           H        MET  91  28.925   6.351 -13.090
  661    HA   MET  91           HA       MET  91  29.167   3.550 -12.289
  662   1HB   MET  91          HB2       MET  91  31.444   4.623 -12.426
  663   2HB   MET  91          HB3       MET  91  30.925   5.797 -11.220
  664   1HG   MET  91          HG2       MET  91  32.288   3.929 -10.299
  665   2HG   MET  91          HG3       MET  91  30.720   4.095  -9.535
  666   1HE   MET  91          HE1       MET  91  31.604   2.328 -13.047
  667   2HE   MET  91          HE2       MET  91  32.973   2.004 -11.958
  668   3HE   MET  91          HE3       MET  91  31.904   0.678 -12.462
  669    H    THR  92           H        THR  92  28.588   3.208 -10.030
  670    HA   THR  92           HA       THR  92  26.422   5.021  -9.139
  671    HB   THR  92           HB       THR  92  25.417   2.739  -8.502
  672    HG1  THR  92           HG1      THR  92  27.119   1.372  -8.569
  673   1HG2  THR  92          HG21      THR  92  24.620   2.262 -10.724
  674   2HG2  THR  92          HG22      THR  92  24.820   4.019 -10.602
  675   3HG2  THR  92          HG23      THR  92  26.023   3.047 -11.473
  676    HA   PRO  93           HA       PRO  93  28.165   4.674  -5.007
  677   1HB   PRO  93          HB2       PRO  93  25.972   4.235  -3.370
  678   2HB   PRO  93          HB3       PRO  93  26.436   5.819  -4.058
  679   1HG   PRO  93          HG2       PRO  93  24.365   3.874  -5.030
  680   2HG   PRO  93          HG3       PRO  93  24.243   5.651  -4.923
  681   1HD   PRO  93          HD2       PRO  93  24.783   4.322  -7.251
  682   2HD   PRO  93          HD3       PRO  93  25.465   5.939  -6.910
  683    HA   PRO  94           HA       PRO  94  29.006   0.484  -4.619
  684   1HB   PRO  94          HB2       PRO  94  29.919   0.093  -2.080
  685   2HB   PRO  94          HB3       PRO  94  30.712   1.214  -3.228
  686   1HG   PRO  94          HG2       PRO  94  28.689   1.889  -1.067
  687   2HG   PRO  94          HG3       PRO  94  30.275   2.669  -1.376
  688   1HD   PRO  94          HD2       PRO  94  27.915   3.672  -2.345
  689   2HD   PRO  94          HD3       PRO  94  29.447   3.807  -3.268
  690    H    HIS  95           H        HIS  95  26.237   1.458  -2.822
  691    HA   HIS  95           HA       HIS  95  25.725  -1.303  -1.831
  692   1HB   HIS  95          HB2       HIS  95  24.373  -0.232  -0.113
  693   2HB   HIS  95          HB3       HIS  95  26.023   0.372  -0.105
  694    HD1  HIS  95           HD1      HIS  95  22.478   1.556  -1.173
  695    HD2  HIS  95           HD2      HIS  95  26.359   2.979  -0.368
  696    HE1  HIS  95           HE1      HIS  95  22.332   4.096  -1.211
  697    H    VAL  96           H        VAL  96  24.539   0.879  -4.287
  698    HA   VAL  96           HA       VAL  96  21.775   0.085  -4.007
  699    HB   VAL  96           HB       VAL  96  21.521   1.115  -6.251
  700   1HG1  VAL  96          HG11      VAL  96  21.039   2.342  -4.252
  701   2HG1  VAL  96          HG12      VAL  96  22.745   2.759  -4.014
  702   3HG1  VAL  96          HG13      VAL  96  21.841   3.407  -5.403
  703   1HG2  VAL  96          HG21      VAL  96  23.264   2.516  -7.188
  704   2HG2  VAL  96          HG22      VAL  96  24.439   1.874  -6.020
  705   3HG2  VAL  96          HG23      VAL  96  23.716   0.809  -7.234
  706    H    LYS  97           H        LYS  97  20.636  -1.321  -5.287
  707    HA   LYS  97           HA       LYS  97  21.959  -3.676  -6.373
  708   1HB   LYS  97          HB2       LYS  97  19.746  -3.706  -5.224
  709   2HB   LYS  97          HB3       LYS  97  19.118  -2.601  -6.453
  710   1HG   LYS  97          HG2       LYS  97  19.378  -4.350  -8.181
  711   2HG   LYS  97          HG3       LYS  97  20.082  -5.441  -6.983
  712   1HD   LYS  97          HD2       LYS  97  17.697  -5.955  -7.381
  713   2HD   LYS  97          HD3       LYS  97  18.002  -5.469  -5.703
  714   1HE   LYS  97          HE2       LYS  97  17.196  -3.185  -6.210
  715   2HE   LYS  97          HE3       LYS  97  16.877  -3.646  -7.882
  716   1HZ   LYS  97          HZ1       LYS  97  15.149  -5.108  -7.092
  717   2HZ   LYS  97          HZ2       LYS  97  15.549  -4.848  -5.523
  718   3HZ   LYS  97          HZ3       LYS  97  14.933  -3.620  -6.407
  719    H    ARG  98           H        ARG  98  22.400  -3.965  -8.573
  720    HA   ARG  98           HA       ARG  98  21.670  -1.806 -10.444
  721   1HB   ARG  98          HB2       ARG  98  23.849  -1.256  -9.442
  722   2HB   ARG  98          HB3       ARG  98  24.497  -2.815  -9.969
  723   1HG   ARG  98          HG2       ARG  98  24.276  -2.170 -12.315
  724   2HG   ARG  98          HG3       ARG  98  23.435  -0.663 -11.867
  725   1HD   ARG  98          HD2       ARG  98  25.415   0.171 -10.756
  726   2HD   ARG  98          HD3       ARG  98  26.254  -1.372 -10.971
  727    HE   ARG  98           HE       ARG  98  25.497  -0.455 -13.541
  728   1HH1  ARG  98          HH21      ARG  98  27.590   0.792 -10.962
  729   2HH1  ARG  98          HH22      ARG  98  28.966   1.015 -11.995
  730   1HH2  ARG  98          HH11      ARG  98  27.150   0.060 -14.917
  731   2HH2  ARG  98          HH12      ARG  98  28.627   0.810 -14.373
  732    H    GLU  99           H        GLU  99  21.704  -2.401 -12.630
  733    HA   GLU  99           HA       GLU  99  22.076  -5.260 -13.364
  734   1HB   GLU  99          HB2       GLU  99  19.745  -3.371 -13.754
  735   2HB   GLU  99          HB3       GLU  99  20.144  -4.450 -15.074
  736   1HG   GLU  99          HG2       GLU  99  19.712  -5.511 -12.269
  737   2HG   GLU  99          HG3       GLU  99  18.373  -5.212 -13.377
  738    H    HIS 100           H        HIS 100  22.541  -5.424 -15.726
  739    HA   HIS 100           HA       HIS 100  23.700  -2.977 -16.918
  740   1HB   HIS 100          HB2       HIS 100  25.457  -4.148 -15.621
  741   2HB   HIS 100          HB3       HIS 100  25.140  -5.628 -16.523
  742    HD1  HIS 100           HD1      HIS 100  25.385  -2.271 -18.443
  743    HD2  HIS 100           HD2      HIS 100  27.666  -5.665 -17.392
  744    HE1  HIS 100           HE1      HIS 100  27.563  -2.134 -19.756
  745    H    TRP 101           H        TRP 101  22.725  -2.792 -18.817
  746    HA   TRP 101           HA       TRP 101  21.773  -5.207 -20.310
  747   1HB   TRP 101          HB2       TRP 101  20.393  -2.521 -19.916
  748   2HB   TRP 101          HB3       TRP 101  19.872  -3.763 -21.034
  749    HD1  TRP 101           HD1      TRP 101  20.666  -5.183 -17.621
  750    HE1  TRP 101           HE1      TRP 101  18.558  -5.686 -16.351
  751    HE3  TRP 101           HE3      TRP 101  17.319  -3.041 -20.847
  752    HZ2  TRP 101           HZ2      TRP 101  15.713  -5.037 -16.575
  753    HZ3  TRP 101           HZ3      TRP 101  14.888  -3.125 -20.350
  754    HH2  TRP 101           HH2      TRP 101  14.086  -4.051 -18.180
  755    H    GLY 102           H        GLY 102  24.308  -4.431 -20.913
  756   1HA   GLY 102          HA1       GLY 102  24.550  -2.085 -22.496
  757   2HA   GLY 102          HA2       GLY 102  25.697  -3.425 -22.406
  758    H    PHE 103           H        PHE 103  24.123  -1.701 -24.580
  759    HA   PHE 103           HA       PHE 103  24.510  -3.719 -26.612
  760   1HB   PHE 103          HB2       PHE 103  22.225  -2.821 -27.684
  761   2HB   PHE 103          HB3       PHE 103  22.327  -4.262 -26.704
  762    HD1  PHE 103           HD1      PHE 103  21.927  -0.558 -26.010
  763    HD2  PHE 103           HD2      PHE 103  20.540  -4.577 -25.263
  764    HE1  PHE 103           HE1      PHE 103  20.298   0.289 -24.346
  765    HE2  PHE 103           HE2      PHE 103  18.893  -3.707 -23.629
  766    HZ   PHE 103           HZ       PHE 103  18.822  -1.271 -23.116
  767    H    ASP 104           H        ASP 104  24.427  -2.601 -28.771
  768    HA   ASP 104           HA       ASP 104  26.078  -0.315 -28.852
  769   1HB   ASP 104          HB2       ASP 104  25.995  -1.946 -30.652
  770   2HB   ASP 104          HB3       ASP 104  24.273  -1.645 -30.907
  771    H    ASP 105           H        ASP 105  25.600   1.839 -29.039
  772    HA   ASP 105           HA       ASP 105  22.939   2.763 -28.317
  773   1HB   ASP 105          HB2       ASP 105  24.977   4.005 -27.598
  774   2HB   ASP 105          HB3       ASP 105  25.315   4.403 -29.285
  775    HA   PRO 106           HA       PRO 106  21.715   2.294 -32.522
  776   1HB   PRO 106          HB2       PRO 106  19.291   3.606 -32.579
  777   2HB   PRO 106          HB3       PRO 106  19.562   1.986 -31.875
  778   1HG   PRO 106          HG2       PRO 106  19.447   4.645 -30.427
  779   2HG   PRO 106          HG3       PRO 106  18.675   3.099 -29.962
  780   1HD   PRO 106          HD2       PRO 106  21.037   3.939 -28.881
  781   2HD   PRO 106          HD3       PRO 106  20.751   2.208 -29.225
  782    H    ALA 107           H        ALA 107  22.146   5.551 -31.213
  783    HA   ALA 107           HA       ALA 107  21.914   6.867 -33.783
  784   1HB   ALA 107          HB1       ALA 107  23.234   7.855 -31.223
  785   2HB   ALA 107          HB2       ALA 107  22.758   8.830 -32.623
  786   3HB   ALA 107          HB3       ALA 107  21.512   8.049 -31.630
  787    H    ARG 108           H        ARG 108  24.239   4.737 -32.488
  788    HA   ARG 108           HA       ARG 108  26.458   5.946 -34.081
  789   1HB   ARG 108          HB2       ARG 108  26.625   3.904 -31.830
  790   2HB   ARG 108          HB3       ARG 108  27.977   4.681 -32.664
  791   1HG   ARG 108          HG2       ARG 108  27.196   6.905 -31.809
  792   2HG   ARG 108          HG3       ARG 108  25.906   6.072 -30.924
  793   1HD   ARG 108          HD2       ARG 108  27.747   4.689 -29.809
  794   2HD   ARG 108          HD3       ARG 108  28.907   5.862 -30.459
  795    HE   ARG 108           HE       ARG 108  27.159   7.520 -29.273
  796   1HH1  ARG 108          HH11      ARG 108  28.867   4.652 -27.946
  797   2HH1  ARG 108          HH12      ARG 108  28.216   4.949 -26.339
  798   1HH2  ARG 108          HH21      ARG 108  26.578   7.909 -27.017
  799   2HH2  ARG 108          HH22      ARG 108  27.098   6.734 -25.826
  800    H    ALA 109           H        ALA 109  24.045   3.845 -34.631
  801    HA   ALA 109           HA       ALA 109  25.443   1.656 -35.868
  802   1HB   ALA 109          HB1       ALA 109  23.210   1.169 -36.816
  803   2HB   ALA 109          HB2       ALA 109  23.132   1.462 -35.063
  804   3HB   ALA 109          HB3       ALA 109  22.606   2.720 -36.197
  805    H    GLN 110           H        GLN 110  27.072   3.212 -36.897
  806    HA   GLN 110           HA       GLN 110  26.367   5.212 -38.693
  807   1HB   GLN 110          HB2       GLN 110  28.888   3.548 -38.970
  808   2HB   GLN 110          HB3       GLN 110  28.643   5.222 -39.440
  809   1HG   GLN 110          HG2       GLN 110  28.902   4.106 -36.624
  810   2HG   GLN 110          HG3       GLN 110  30.062   5.080 -37.490
  811   1HE2  GLN 110          HE22      GLN 110  29.454   5.918 -35.006
  812   2HE2  GLN 110          HE21      GLN 110  28.494   7.373 -35.070
  813    H    GLY 111           H        GLY 111  25.894   5.340 -40.781
  814   1HA   GLY 111          HA1       GLY 111  26.607   3.771 -42.916
  815   2HA   GLY 111          HA2       GLY 111  25.096   3.029 -42.344
  816    H    THR 112           H        THR 112  23.372   4.811 -41.693
  817    HA   THR 112           HA       THR 112  23.455   7.368 -42.853
  818    HB   THR 112           HB       THR 112  23.099   6.296 -45.000
  819    HG1  THR 112           HG1      THR 112  21.350   7.389 -45.606
  820   1HG2  THR 112          HG21      THR 112  20.717   4.869 -43.758
  821   2HG2  THR 112          HG22      THR 112  21.084   4.932 -45.494
  822   3HG2  THR 112          HG23      THR 112  22.202   4.124 -44.392
  823    H    GLU 113           H        GLU 113  21.225   8.415 -42.544
  824    HA   GLU 113           HA       GLU 113  20.478   8.018 -39.819
  825   1HB   GLU 113          HB2       GLU 113  18.785   9.715 -40.227
  826   2HB   GLU 113          HB3       GLU 113  20.344  10.192 -40.900
  827   1HG   GLU 113          HG2       GLU 113  19.550   9.498 -43.176
  828   2HG   GLU 113          HG3       GLU 113  17.979   9.088 -42.485
  829    H    GLU 114           H        GLU 114  19.238   6.667 -42.837
  830    HA   GLU 114           HA       GLU 114  16.798   5.674 -41.716
  831   1HB   GLU 114          HB2       GLU 114  17.195   6.065 -44.133
  832   2HB   GLU 114          HB3       GLU 114  18.339   4.714 -44.160
  833   1HG   GLU 114          HG2       GLU 114  16.538   3.149 -43.541
  834   2HG   GLU 114          HG3       GLU 114  15.403   4.490 -43.359
  835    H    GLU 115           H        GLU 115  20.114   4.391 -41.939
  836    HA   GLU 115           HA       GLU 115  19.402   1.732 -41.025
  837   1HB   GLU 115          HB2       GLU 115  22.052   3.219 -41.223
  838   2HB   GLU 115          HB3       GLU 115  21.921   1.597 -40.554
  839   1HG   GLU 115          HG2       GLU 115  20.990   2.330 -43.361
  840   2HG   GLU 115          HG3       GLU 115  22.600   1.728 -42.983
  841    H    LYS 116           H        LYS 116  20.728   4.728 -39.549
  842    HA   LYS 116           HA       LYS 116  20.812   3.806 -36.872
  843   1HB   LYS 116          HB2       LYS 116  20.348   6.578 -38.050
  844   2HB   LYS 116          HB3       LYS 116  20.530   6.267 -36.308
  845   1HG   LYS 116          HG2       LYS 116  22.733   5.205 -36.740
  846   2HG   LYS 116          HG3       LYS 116  22.573   5.580 -38.467
  847   1HD   LYS 116          HD2       LYS 116  22.501   8.016 -37.908
  848   2HD   LYS 116          HD3       LYS 116  22.705   7.593 -36.190
  849   1HE   LYS 116          HE2       LYS 116  24.781   6.236 -36.985
  850   2HE   LYS 116          HE3       LYS 116  24.637   7.127 -38.505
  851   1HZ   LYS 116          HZ1       LYS 116  25.046   8.291 -35.815
  852   2HZ   LYS 116          HZ2       LYS 116  26.186   8.140 -36.989
  853   3HZ   LYS 116          HZ3       LYS 116  24.927   9.181 -37.205
  854    H    TRP 117           H        TRP 117  18.087   5.337 -38.671
  855    HA   TRP 117           HA       TRP 117  16.246   5.252 -36.551
  856   1HB   TRP 117          HB2       TRP 117  15.818   6.576 -38.494
  857   2HB   TRP 117          HB3       TRP 117  15.979   5.194 -39.565
  858    HD1  TRP 117           HD1      TRP 117  13.777   4.754 -40.640
  859    HE1  TRP 117           HE1      TRP 117  11.372   4.425 -39.899
  860    HE3  TRP 117           HE3      TRP 117  14.297   5.969 -35.692
  861    HZ2  TRP 117           HZ2      TRP 117   9.802   4.765 -37.461
  862    HZ3  TRP 117           HZ3      TRP 117  12.369   5.905 -34.189
  863    HH2  TRP 117           HH2      TRP 117  10.104   5.286 -35.045
  864    H    ALA 118           H        ALA 118  17.045   2.685 -38.967
  865    HA   ALA 118           HA       ALA 118  14.999   0.913 -38.065
  866   1HB   ALA 118          HB1       ALA 118  17.633   0.307 -39.462
  867   2HB   ALA 118          HB2       ALA 118  16.254  -0.803 -39.291
  868   3HB   ALA 118          HB3       ALA 118  16.075   0.685 -40.242
  869    H    PHE 119           H        PHE 119  18.424   1.311 -37.134
  870    HA   PHE 119           HA       PHE 119  18.450  -0.804 -35.218
  871   1HB   PHE 119          HB2       PHE 119  20.211   1.547 -35.824
  872   2HB   PHE 119          HB3       PHE 119  20.343   0.831 -34.232
  873    HD1  PHE 119           HD1      PHE 119  20.281  -0.250 -37.857
  874    HD2  PHE 119           HD2      PHE 119  21.771  -0.983 -33.874
  875    HE1  PHE 119           HE1      PHE 119  21.734  -2.054 -38.731
  876    HE2  PHE 119           HE2      PHE 119  23.218  -2.789 -34.753
  877    HZ   PHE 119           HZ       PHE 119  23.208  -3.330 -37.183
  878    H    PHE 120           H        PHE 120  17.563   2.637 -34.926
  879    HA   PHE 120           HA       PHE 120  17.155   2.694 -32.129
  880   1HB   PHE 120          HB2       PHE 120  16.253   4.297 -34.473
  881   2HB   PHE 120          HB3       PHE 120  15.124   4.301 -33.144
  882    HD1  PHE 120           HD1      PHE 120  18.260   5.677 -34.354
  883    HD2  PHE 120           HD2      PHE 120  15.888   4.948 -30.832
  884    HE1  PHE 120           HE1      PHE 120  19.497   7.454 -33.153
  885    HE2  PHE 120           HE2      PHE 120  17.168   6.681 -29.615
  886    HZ   PHE 120           HZ       PHE 120  18.924   7.996 -30.802
  887    H    GLN 121           H        GLN 121  14.807   1.760 -34.701
  888    HA   GLN 121           HA       GLN 121  12.737   1.109 -32.845
  889   1HB   GLN 121          HB2       GLN 121  13.345   0.183 -35.681
  890   2HB   GLN 121          HB3       GLN 121  11.881  -0.298 -34.822
  891   1HG   GLN 121          HG2       GLN 121  11.034   1.907 -34.732
  892   2HG   GLN 121          HG3       GLN 121  12.598   2.639 -35.094
  893   1HE2  GLN 121          HE22      GLN 121  13.481   2.499 -37.215
  894   2HE2  GLN 121          HE21      GLN 121  12.458   2.199 -38.607
  895    H    ARG 122           H        ARG 122  15.452  -0.896 -34.100
  896    HA   ARG 122           HA       ARG 122  14.464  -3.312 -32.857
  897   1HB   ARG 122          HB2       ARG 122  17.284  -2.497 -33.711
  898   2HB   ARG 122          HB3       ARG 122  16.857  -4.102 -33.133
  899   1HG   ARG 122          HG2       ARG 122  15.687  -2.798 -35.628
  900   2HG   ARG 122          HG3       ARG 122  17.009  -3.963 -35.598
  901   1HD   ARG 122          HD2       ARG 122  15.454  -5.640 -34.542
  902   2HD   ARG 122          HD3       ARG 122  14.145  -4.466 -34.684
  903    HE   ARG 122           HE       ARG 122  14.016  -4.780 -36.952
  904   1HH1  ARG 122          HH22      ARG 122  16.836  -6.571 -35.738
  905   2HH1  ARG 122          HH21      ARG 122  17.072  -7.461 -37.195
  906   1HH2  ARG 122          HH11      ARG 122  14.331  -5.967 -38.888
  907   2HH2  ARG 122          HH12      ARG 122  15.613  -7.109 -39.022
  908    H    VAL 123           H        VAL 123  16.859  -0.825 -31.710
  909    HA   VAL 123           HA       VAL 123  17.325  -2.231 -29.247
  910    HB   VAL 123           HB       VAL 123  17.735   0.673 -30.087
  911   1HG1  VAL 123          HG11      VAL 123  19.302   0.834 -28.135
  912   2HG1  VAL 123          HG12      VAL 123  17.613   0.671 -27.655
  913   3HG1  VAL 123          HG13      VAL 123  18.702  -0.731 -27.554
  914   1HG2  VAL 123          HG21      VAL 123  19.722  -1.623 -29.729
  915   2HG2  VAL 123          HG22      VAL 123  19.143  -1.018 -31.291
  916   3HG2  VAL 123          HG23      VAL 123  20.110   0.029 -30.251
  917    H    ARG 124           H        ARG 124  14.969   0.327 -30.212
  918    HA   ARG 124           HA       ARG 124  13.730   0.756 -27.717
  919   1HB   ARG 124          HB2       ARG 124  13.282   2.124 -29.681
  920   2HB   ARG 124          HB3       ARG 124  12.796   0.734 -30.601
  921   1HG   ARG 124          HG2       ARG 124  10.916   0.692 -28.558
  922   2HG   ARG 124          HG3       ARG 124  11.231   2.410 -28.731
  923   1HD   ARG 124          HD2       ARG 124   9.367   1.715 -30.150
  924   2HD   ARG 124          HD3       ARG 124  10.723   2.252 -31.146
  925    HE   ARG 124           HE       ARG 124  10.893  -0.574 -30.822
  926   1HH1  ARG 124          HH21      ARG 124   8.957   1.887 -32.415
  927   2HH1  ARG 124          HH22      ARG 124   8.485   0.895 -33.763
  928   1HH2  ARG 124          HH11      ARG 124  10.440  -1.887 -32.693
  929   2HH2  ARG 124          HH12      ARG 124   9.362  -1.299 -33.907
  930    H    ASP 125           H        ASP 125  12.949  -1.693 -30.288
  931    HA   ASP 125           HA       ASP 125  10.741  -2.758 -28.862
  932   1HB   ASP 125          HB2       ASP 125  11.003  -3.124 -31.250
  933   2HB   ASP 125          HB3       ASP 125  12.532  -3.972 -31.006
  934    H    GLU 126           H        GLU 126  14.199  -3.787 -28.974
  935    HA   GLU 126           HA       GLU 126  13.839  -6.104 -27.387
  936   1HB   GLU 126          HB2       GLU 126  15.744  -5.677 -28.855
  937   2HB   GLU 126          HB3       GLU 126  16.316  -4.383 -27.786
  938   1HG   GLU 126          HG2       GLU 126  16.706  -5.982 -25.981
  939   2HG   GLU 126          HG3       GLU 126  15.914  -7.271 -26.890
  940    H    ILE 127           H        ILE 127  14.636  -2.715 -26.486
  941    HA   ILE 127           HA       ILE 127  14.935  -3.167 -23.680
  942    HB   ILE 127           HB       ILE 127  14.177  -0.758 -25.372
  943   1HG1  ILE 127          HG12      ILE 127  16.629  -1.371 -23.660
  944   2HG1  ILE 127          HG13      ILE 127  16.541  -1.728 -25.378
  945   1HG2  ILE 127          HG21      ILE 127  13.081  -0.423 -23.162
  946   2HG2  ILE 127          HG22      ILE 127  14.635  -0.732 -22.355
  947   3HG2  ILE 127          HG23      ILE 127  14.422   0.679 -23.419
  948   1HD1  ILE 127          HD11      ILE 127  16.045   0.760 -25.758
  949   2HD1  ILE 127          HD12      ILE 127  16.562   1.008 -24.071
  950   3HD1  ILE 127          HD13      ILE 127  17.679   0.299 -25.253
  951    H    GLY 128           H        GLY 128  12.043  -2.170 -25.637
  952   1HA   GLY 128          HA1       GLY 128  10.163  -2.106 -23.599
  953   2HA   GLY 128          HA2       GLY 128   9.825  -2.598 -25.275
  954    H    ASN 129           H        ASN 129  11.222  -4.986 -25.481
  955    HA   ASN 129           HA       ASN 129   9.473  -6.813 -24.195
  956   1HB   ASN 129          HB2       ASN 129  12.087  -7.166 -25.698
  957   2HB   ASN 129          HB3       ASN 129  11.363  -8.520 -24.847
  958   1HD2  ASN 129          HD22      ASN 129  10.812  -6.194 -27.500
  959   2HD2  ASN 129          HD21      ASN 129   9.587  -7.153 -28.292
  960    H    ARG 130           H        ARG 130  12.883  -5.954 -23.359
  961    HA   ARG 130           HA       ARG 130  12.832  -7.861 -21.185
  962   1HB   ARG 130          HB2       ARG 130  14.946  -7.189 -22.252
  963   2HB   ARG 130          HB3       ARG 130  14.714  -5.528 -21.695
  964   1HG   ARG 130          HG2       ARG 130  16.295  -6.600 -20.249
  965   2HG   ARG 130          HG3       ARG 130  14.817  -6.315 -19.347
  966   1HD   ARG 130          HD2       ARG 130  14.174  -8.726 -19.701
  967   2HD   ARG 130          HD3       ARG 130  15.802  -8.998 -20.346
  968    HE   ARG 130           HE       ARG 130  14.958  -8.701 -17.587
  969   1HH1  ARG 130          HH11      ARG 130  17.811  -7.977 -19.620
  970   2HH1  ARG 130          HH12      ARG 130  18.848  -7.760 -18.256
  971   1HH2  ARG 130          HH21      ARG 130  16.360  -8.637 -15.879
  972   2HH2  ARG 130          HH22      ARG 130  17.963  -7.958 -16.055
  973    H    LEU 131           H        LEU 131  11.972  -4.383 -21.429
  974    HA   LEU 131           HA       LEU 131  11.799  -3.947 -18.621
  975   1HB   LEU 131          HB2       LEU 131  11.272  -2.385 -20.948
  976   2HB   LEU 131          HB3       LEU 131   9.764  -2.488 -20.095
  977    HG   LEU 131           HG       LEU 131  10.732  -0.574 -19.302
  978   1HD1  LEU 131          HD11      LEU 131   9.880  -2.009 -17.439
  979   2HD1  LEU 131          HD12      LEU 131  11.560  -2.507 -17.123
  980   3HD1  LEU 131          HD13      LEU 131  11.101  -0.827 -16.939
  981   1HD2  LEU 131          HD21      LEU 131  13.014  -1.008 -20.210
  982   2HD2  LEU 131          HD22      LEU 131  12.991  -0.207 -18.643
  983   3HD2  LEU 131          HD23      LEU 131  13.370  -1.934 -18.736
  984    H    LYS 132           H        LYS 132   9.478  -5.182 -21.057
  985    HA   LYS 132           HA       LYS 132   7.245  -5.420 -19.348
  986   1HB   LYS 132          HB2       LYS 132   7.191  -5.675 -21.831
  987   2HB   LYS 132          HB3       LYS 132   8.012  -7.226 -21.687
  988   1HG   LYS 132          HG2       LYS 132   6.160  -8.166 -20.402
  989   2HG   LYS 132          HG3       LYS 132   5.332  -6.591 -20.391
  990   1HD   LYS 132          HD2       LYS 132   5.186  -6.646 -22.871
  991   2HD   LYS 132          HD3       LYS 132   6.004  -8.224 -22.882
  992   1HE   LYS 132          HE2       LYS 132   4.162  -9.184 -21.512
  993   2HE   LYS 132          HE3       LYS 132   3.349  -7.615 -21.499
  994   1HZ   LYS 132          HZ1       LYS 132   3.126  -7.786 -23.911
  995   2HZ   LYS 132          HZ2       LYS 132   3.880  -9.237 -23.923
  996   3HZ   LYS 132          HZ3       LYS 132   2.436  -9.071 -23.189
  997    H    GLU 133           H        GLU 133   9.779  -7.843 -20.144
  998    HA   GLU 133           HA       GLU 133   8.705  -9.768 -18.371
  999   1HB   GLU 133          HB2       GLU 133  11.605  -9.533 -19.244
 1000   2HB   GLU 133          HB3       GLU 133  10.837 -10.932 -18.464
 1001   1HG   GLU 133          HG2       GLU 133   9.263 -11.132 -20.371
 1002   2HG   GLU 133          HG3       GLU 133  10.053  -9.777 -21.172
 1003    H    PHE 134           H        PHE 134  11.095  -7.191 -17.797
 1004    HA   PHE 134           HA       PHE 134  11.796  -7.961 -15.175
 1005   1HB   PHE 134          HB2       PHE 134  13.128  -6.366 -16.350
 1006   2HB   PHE 134          HB3       PHE 134  11.744  -5.339 -16.687
 1007    HD1  PHE 134           HD1      PHE 134  13.917  -6.556 -13.891
 1008    HD2  PHE 134           HD2      PHE 134  11.095  -3.589 -15.244
 1009    HE1  PHE 134           HE1      PHE 134  14.361  -5.194 -11.864
 1010    HE2  PHE 134           HE2      PHE 134  11.599  -2.187 -13.266
 1011    HZ   PHE 134           HZ       PHE 134  13.223  -3.003 -11.559
 1012    H    ALA 135           H        ALA 135   9.014  -6.141 -16.401
 1013    HA   ALA 135           HA       ALA 135   8.176  -5.355 -13.741
 1014   1HB   ALA 135          HB1       ALA 135   6.703  -5.251 -16.425
 1015   2HB   ALA 135          HB2       ALA 135   6.224  -4.401 -14.940
 1016   3HB   ALA 135          HB3       ALA 135   7.733  -3.961 -15.773
 1017    H    GLU 136           H        GLU 136   7.308  -7.832 -16.109
 1018    HA   GLU 136           HA       GLU 136   4.948  -8.685 -14.655
 1019   1HB   GLU 136          HB2       GLU 136   4.981  -8.544 -17.110
 1020   2HB   GLU 136          HB3       GLU 136   6.336  -9.663 -17.182
 1021   1HG   GLU 136          HG2       GLU 136   4.409 -10.894 -17.785
 1022   2HG   GLU 136          HG3       GLU 136   4.885 -11.463 -16.196
 1023    H    THR 137           H        THR 137   8.114 -10.049 -15.504
 1024    HA   THR 137           HA       THR 137   7.521 -12.483 -13.935
 1025    HB   THR 137           HB       THR 137   8.969 -13.675 -15.350
 1026    HG1  THR 137           HG1      THR 137   9.742 -11.126 -16.287
 1027   1HG2  THR 137          HG21      THR 137   7.411 -11.821 -17.194
 1028   2HG2  THR 137          HG22      THR 137   7.939 -13.482 -17.513
 1029   3HG2  THR 137          HG23      THR 137   6.698 -13.177 -16.284
 1030    H    GLY 138           H        GLY 138   9.593  -9.680 -14.006
 1031   1HA   GLY 138          HA1       GLY 138  11.037  -8.945 -12.348
 1032   2HA   GLY 138          HA2       GLY 138  10.935 -10.506 -11.536
 1033    H    LYS 139           H        LYS 139  11.679 -10.700 -14.984
 1034    HA   LYS 139           HA       LYS 139  14.266 -11.834 -14.395
 1035   1HB   LYS 139          HB2       LYS 139  12.726 -11.225 -16.945
 1036   2HB   LYS 139          HB3       LYS 139  14.381 -11.853 -16.948
 1037   1HG   LYS 139          HG2       LYS 139  13.722 -13.876 -15.790
 1038   2HG   LYS 139          HG3       LYS 139  12.099 -13.258 -15.484
 1039   1HD   LYS 139          HD2       LYS 139  12.096 -14.902 -17.304
 1040   2HD   LYS 139          HD3       LYS 139  11.566 -13.311 -17.875
 1041   1HE   LYS 139          HE2       LYS 139  13.821 -12.858 -18.760
 1042   2HE   LYS 139          HE3       LYS 139  14.379 -14.442 -18.193
 1043   1HZ   LYS 139          HZ1       LYS 139  13.801 -14.517 -20.529
 1044   2HZ   LYS 139          HZ2       LYS 139  12.737 -15.445 -19.711
 1045   3HZ   LYS 139          HZ3       LYS 139  12.291 -13.952 -20.246
  Start of MODEL   19
    1   1H    MET   1           H1       MET   1   2.563   3.511   1.124
    2   2H    MET   1           H2       MET   1   1.900   3.321   2.611
    3   3H    MET   1           H3       MET   1   3.068   4.442   2.368
    4    HA   MET   1           HA       MET   1   3.958   2.578   3.530
    5   1HB   MET   1          HB2       MET   1   2.394   0.886   2.659
    6   2HB   MET   1          HB3       MET   1   3.168   0.956   1.072
    7   1HG   MET   1          HG2       MET   1   5.300   0.183   2.087
    8   2HG   MET   1          HG3       MET   1   4.530   0.157   3.679
    9   1HE   MET   1          HE1       MET   1   5.134  -3.635   2.890
   10   2HE   MET   1          HE2       MET   1   6.172  -2.268   2.428
   11   3HE   MET   1          HE3       MET   1   5.414  -2.307   4.037
   12    H    GLU   2           H        GLU   2   4.571   2.153  -0.043
   13    HA   GLU   2           HA       GLU   2   6.961   3.822   0.081
   14   1HB   GLU   2          HB2       GLU   2   7.686   1.592   0.982
   15   2HB   GLU   2          HB3       GLU   2   7.089   0.812  -0.483
   16   1HG   GLU   2          HG2       GLU   2   8.747   2.027  -1.838
   17   2HG   GLU   2          HG3       GLU   2   9.287   2.928  -0.420
   18    H    ASN   3           H        ASN   3   7.769   4.135  -2.141
   19    HA   ASN   3           HA       ASN   3   6.145   3.083  -4.369
   20   1HB   ASN   3          HB2       ASN   3   5.564   5.578  -3.774
   21   2HB   ASN   3          HB3       ASN   3   7.199   5.944  -4.356
   22   1HD2  ASN   3          HD22      ASN   3   7.706   5.314  -6.696
   23   2HD2  ASN   3          HD21      ASN   3   6.318   5.360  -7.797
   24    H    LYS   4           H        LYS   4   7.641   2.384  -5.992
   25    HA   LYS   4           HA       LYS   4  10.409   2.212  -5.057
   26   1HB   LYS   4          HB2       LYS   4   9.304   1.342  -7.750
   27   2HB   LYS   4          HB3       LYS   4  10.743   0.743  -6.944
   28   1HG   LYS   4          HG2       LYS   4   7.848   0.188  -6.204
   29   2HG   LYS   4          HG3       LYS   4   8.999  -0.933  -6.913
   30   1HD   LYS   4          HD2       LYS   4   9.203   0.287  -4.140
   31   2HD   LYS   4          HD3       LYS   4   8.658  -1.357  -4.522
   32   1HE   LYS   4          HE2       LYS   4  10.890  -1.845  -5.527
   33   2HE   LYS   4          HE3       LYS   4  11.418  -0.211  -5.112
   34   1HZ   LYS   4          HZ1       LYS   4  10.788  -2.385  -3.231
   35   2HZ   LYS   4          HZ2       LYS   4  12.217  -1.592  -3.449
   36   3HZ   LYS   4          HZ3       LYS   4  10.930  -0.829  -2.735
   37    H    ILE   5           H        ILE   5  12.122   2.608  -6.830
   38    HA   ILE   5           HA       ILE   5  11.688   5.027  -8.422
   39    HB   ILE   5           HB       ILE   5  13.933   4.748  -6.393
   40   1HG1  ILE   5          HG12      ILE   5  12.817   7.019  -5.506
   41   2HG1  ILE   5          HG13      ILE   5  11.354   6.206  -6.033
   42   1HG2  ILE   5          HG21      ILE   5  14.516   7.083  -7.014
   43   2HG2  ILE   5          HG22      ILE   5  14.583   6.025  -8.418
   44   3HG2  ILE   5          HG23      ILE   5  13.185   7.089  -8.190
   45   1HD1  ILE   5          HD11      ILE   5  13.463   5.158  -4.090
   46   2HD1  ILE   5          HD12      ILE   5  11.843   5.745  -3.664
   47   3HD1  ILE   5          HD13      ILE   5  12.042   4.232  -4.573
   48    H    ILE   6           H        ILE   6  13.166   4.897 -10.263
   49    HA   ILE   6           HA       ILE   6  15.192   2.771 -10.243
   50    HB   ILE   6           HB       ILE   6  13.214   1.538 -10.887
   51   1HG1  ILE   6          HG12      ILE   6  14.935   1.973 -13.364
   52   2HG1  ILE   6          HG13      ILE   6  15.447   1.057 -11.941
   53   1HG2  ILE   6          HG21      ILE   6  11.833   3.408 -11.799
   54   2HG2  ILE   6          HG22      ILE   6  12.889   3.446 -13.234
   55   3HG2  ILE   6          HG23      ILE   6  11.886   2.028 -12.883
   56   1HD1  ILE   6          HD11      ILE   6  14.668  -0.466 -13.639
   57   2HD1  ILE   6          HD12      ILE   6  13.541  -0.497 -12.264
   58   3HD1  ILE   6          HD13      ILE   6  13.115   0.371 -13.763
   59    H    TYR   7           H        TYR   7  16.799   3.064 -11.877
   60    HA   TYR   7           HA       TYR   7  16.680   5.676 -13.277
   61   1HB   TYR   7          HB2       TYR   7  17.813   5.540 -10.925
   62   2HB   TYR   7          HB3       TYR   7  19.079   4.644 -11.728
   63    HD1  TYR   7           HD1      TYR   7  20.582   6.307 -10.736
   64    HD2  TYR   7           HD2      TYR   7  17.557   7.527 -13.563
   65    HE1  TYR   7           HE1      TYR   7  21.545   8.594 -10.805
   66    HE2  TYR   7           HE2      TYR   7  18.506   9.787 -13.619
   67    HH   TYR   7           HH       TYR   7  20.058  11.248 -12.675
   68    H    PHE   8           H        PHE   8  17.436   5.564 -15.328
   69    HA   PHE   8           HA       PHE   8  18.984   3.148 -16.209
   70   1HB   PHE   8          HB2       PHE   8  17.167   4.962 -17.848
   71   2HB   PHE   8          HB3       PHE   8  18.059   3.577 -18.447
   72    HD1  PHE   8           HD1      PHE   8  17.463   1.232 -17.572
   73    HD2  PHE   8           HD2      PHE   8  15.002   4.699 -16.855
   74    HE1  PHE   8           HE1      PHE   8  15.595  -0.242 -16.908
   75    HE2  PHE   8           HE2      PHE   8  13.125   3.203 -16.238
   76    HZ   PHE   8           HZ       PHE   8  13.431   0.752 -16.183
   77    H    LEU   9           H        LEU   9  21.024   3.546 -16.926
   78    HA   LEU   9           HA       LEU   9  21.862   6.391 -17.240
   79   1HB   LEU   9          HB2       LEU   9  23.281   4.040 -15.948
   80   2HB   LEU   9          HB3       LEU   9  23.995   5.630 -16.211
   81    HG   LEU   9           HG       LEU   9  21.691   4.936 -14.343
   82   1HD1  LEU   9          HD11      LEU   9  23.256   5.671 -12.606
   83   2HD1  LEU   9          HD12      LEU   9  23.977   4.369 -13.567
   84   3HD1  LEU   9          HD13      LEU   9  24.486   6.049 -13.828
   85   1HD2  LEU   9          HD21      LEU   9  22.785   7.637 -15.191
   86   2HD2  LEU   9          HD22      LEU   9  21.098   7.091 -15.170
   87   3HD2  LEU   9          HD23      LEU   9  21.928   7.386 -13.651
   88    H    CYS  10           H        CYS  10  23.244   6.903 -18.874
   89    HA   CYS  10           HA       CYS  10  24.345   4.718 -20.594
   90   1HB   CYS  10          HB2       CYS  10  22.516   7.036 -21.332
   91   2HB   CYS  10          HB3       CYS  10  23.598   6.326 -22.543
   92    HG   CYS  10           HG       CYS  10  21.861   4.389 -20.576
   93    H    THR  11           H        THR  11  25.830   5.537 -22.239
   94    HA   THR  11           HA       THR  11  27.755   7.455 -21.296
   95    HB   THR  11           HB       THR  11  28.846   6.683 -23.464
   96    HG1  THR  11           HG1      THR  11  27.718   4.674 -24.262
   97   1HG2  THR  11          HG21      THR  11  29.283   4.407 -22.700
   98   2HG2  THR  11          HG22      THR  11  29.217   5.488 -21.282
   99   3HG2  THR  11          HG23      THR  11  27.854   4.415 -21.661
  100    H    GLY  12           H        GLY  12  25.150   8.580 -21.664
  101   1HA   GLY  12          HA1       GLY  12  25.082  10.931 -22.832
  102   2HA   GLY  12          HA2       GLY  12  25.007   9.931 -24.294
  103    H    ASN  13           H        ASN  13  23.162  11.333 -21.799
  104    HA   ASN  13           HA       ASN  13  21.022   9.387 -21.692
  105   1HB   ASN  13          HB2       ASN  13  21.582  10.948 -19.824
  106   2HB   ASN  13          HB3       ASN  13  21.015  12.289 -20.816
  107   1HD2  ASN  13          HD22      ASN  13  19.394   8.995 -20.556
  108   2HD2  ASN  13          HD21      ASN  13  17.967   9.645 -19.768
  109    H    SER  14           H        SER  14  21.281   9.684 -24.352
  110    HA   SER  14           HA       SER  14  19.271  11.754 -25.174
  111   1HB   SER  14          HB2       SER  14  21.604  10.708 -26.782
  112   2HB   SER  14          HB3       SER  14  20.559  12.093 -27.148
  113    HG   SER  14           HG       SER  14  22.580  12.695 -26.200
  114    H    CYS  15           H        CYS  15  19.969   8.313 -25.344
  115    HA   CYS  15           HA       CYS  15  17.801   8.034 -27.384
  116   1HB   CYS  15          HB2       CYS  15  20.488   6.590 -27.443
  117   2HB   CYS  15          HB3       CYS  15  19.173   6.439 -28.617
  118    HG   CYS  15           HG       CYS  15  21.412   7.724 -29.334
  119    H    ARG  16           H        ARG  16  19.831   5.416 -26.169
  120    HA   ARG  16           HA       ARG  16  17.529   3.837 -25.771
  121   1HB   ARG  16          HB2       ARG  16  19.048   2.103 -25.144
  122   2HB   ARG  16          HB3       ARG  16  19.774   3.056 -26.437
  123   1HG   ARG  16          HG2       ARG  16  20.894   4.343 -24.394
  124   2HG   ARG  16          HG3       ARG  16  20.536   2.858 -23.534
  125   1HD   ARG  16          HD2       ARG  16  22.448   2.004 -24.301
  126   2HD   ARG  16          HD3       ARG  16  21.804   2.031 -25.946
  127    HE   ARG  16           HE       ARG  16  22.590   4.469 -25.998
  128   1HH1  ARG  16          HH21      ARG  16  24.438   2.065 -24.092
  129   2HH1  ARG  16          HH22      ARG  16  25.906   3.019 -24.266
  130   1HH2  ARG  16          HH11      ARG  16  24.263   5.727 -25.835
  131   2HH2  ARG  16          HH12      ARG  16  25.711   5.289 -24.931
  132    H    SER  17           H        SER  17  19.406   5.644 -23.340
  133    HA   SER  17           HA       SER  17  18.120   4.592 -20.994
  134   1HB   SER  17          HB2       SER  17  18.703   6.972 -20.128
  135   2HB   SER  17          HB3       SER  17  20.002   5.869 -20.497
  136    HG   SER  17           HG       SER  17  20.543   7.068 -22.227
  137    H    GLN  18           H        GLN  18  17.396   7.370 -23.094
  138    HA   GLN  18           HA       GLN  18  15.127   8.323 -21.693
  139   1HB   GLN  18          HB2       GLN  18  16.149   8.595 -24.548
  140   2HB   GLN  18          HB3       GLN  18  14.653   9.338 -24.055
  141   1HG   GLN  18          HG2       GLN  18  17.265   9.820 -22.548
  142   2HG   GLN  18          HG3       GLN  18  16.805  10.770 -23.956
  143   1HE2  GLN  18          HE22      GLN  18  17.068  11.702 -21.043
  144   2HE2  GLN  18          HE21      GLN  18  15.466  12.373 -20.727
  145    H    MET  19           H        MET  19  15.332   6.189 -24.561
  146    HA   MET  19           HA       MET  19  12.580   5.570 -24.742
  147   1HB   MET  19          HB2       MET  19  14.971   3.815 -25.458
  148   2HB   MET  19          HB3       MET  19  13.294   3.495 -25.909
  149   1HG   MET  19          HG2       MET  19  13.313   5.860 -26.967
  150   2HG   MET  19          HG3       MET  19  15.067   5.764 -26.851
  151   1HE   MET  19          HE1       MET  19  15.866   2.724 -29.251
  152   2HE   MET  19          HE2       MET  19  16.556   3.951 -28.163
  153   3HE   MET  19          HE3       MET  19  15.596   2.603 -27.501
  154    H    ALA  20           H        ALA  20  15.116   3.878 -22.769
  155    HA   ALA  20           HA       ALA  20  13.408   1.818 -21.838
  156   1HB   ALA  20          HB1       ALA  20  15.082   1.519 -20.054
  157   2HB   ALA  20          HB2       ALA  20  15.878   1.758 -21.621
  158   3HB   ALA  20          HB3       ALA  20  15.811   3.088 -20.442
  159    H    GLU  21           H        GLU  21  14.136   5.005 -20.366
  160    HA   GLU  21           HA       GLU  21  12.421   4.748 -18.143
  161   1HB   GLU  21          HB2       GLU  21  14.062   6.572 -18.552
  162   2HB   GLU  21          HB3       GLU  21  12.974   7.254 -19.761
  163   1HG   GLU  21          HG2       GLU  21  11.222   7.416 -17.889
  164   2HG   GLU  21          HG3       GLU  21  12.513   6.981 -16.773
  165    H    GLY  22           H        GLY  22  11.606   5.730 -21.521
  166   1HA   GLY  22          HA1       GLY  22   8.877   6.371 -21.145
  167   2HA   GLY  22          HA2       GLY  22   9.633   5.750 -22.642
  168    H    TRP  23           H        TRP  23  10.358   3.233 -22.140
  169    HA   TRP  23           HA       TRP  23   7.889   1.781 -22.180
  170   1HB   TRP  23          HB2       TRP  23  10.785   0.918 -21.805
  171   2HB   TRP  23          HB3       TRP  23   9.449  -0.222 -21.846
  172    HD1  TRP  23           HD1      TRP  23  11.764   1.552 -24.118
  173    HE1  TRP  23           HE1      TRP  23  11.148   1.151 -26.546
  174    HE3  TRP  23           HE3      TRP  23   7.107  -0.441 -23.425
  175    HZ2  TRP  23           HZ2      TRP  23   8.870   0.066 -28.049
  176    HZ3  TRP  23           HZ3      TRP  23   5.783  -1.243 -25.353
  177    HH2  TRP  23           HH2      TRP  23   6.665  -1.029 -27.659
  178    H    ALA  24           H        ALA  24  10.317   2.290 -19.597
  179    HA   ALA  24           HA       ALA  24   9.179   0.466 -17.786
  180   1HB   ALA  24          HB1       ALA  24  11.468   1.279 -17.586
  181   2HB   ALA  24          HB2       ALA  24  10.894   2.927 -17.321
  182   3HB   ALA  24          HB3       ALA  24  10.589   1.664 -16.104
  183    H    LYS  25           H        LYS  25   8.533   4.015 -18.133
  184    HA   LYS  25           HA       LYS  25   6.708   4.179 -15.981
  185   1HB   LYS  25          HB2       LYS  25   6.692   5.600 -18.669
  186   2HB   LYS  25          HB3       LYS  25   5.573   5.989 -17.346
  187   1HG   LYS  25          HG2       LYS  25   7.309   6.718 -15.904
  188   2HG   LYS  25          HG3       LYS  25   8.578   6.047 -16.941
  189   1HD   LYS  25          HD2       LYS  25   8.066   7.644 -18.711
  190   2HD   LYS  25          HD3       LYS  25   6.743   8.349 -17.746
  191   1HE   LYS  25          HE2       LYS  25   8.261   9.176 -16.078
  192   2HE   LYS  25          HE3       LYS  25   9.566   8.132 -16.659
  193   1HZ   LYS  25          HZ1       LYS  25   8.567  10.553 -18.038
  194   2HZ   LYS  25          HZ2       LYS  25  10.091  10.205 -17.417
  195   3HZ   LYS  25          HZ3       LYS  25   9.565   9.436 -18.723
  196    H    GLN  26           H        GLN  26   6.179   2.843 -19.236
  197    HA   GLN  26           HA       GLN  26   3.336   2.672 -18.892
  198   1HB   GLN  26          HB2       GLN  26   4.895   0.828 -20.725
  199   2HB   GLN  26          HB3       GLN  26   3.212   1.318 -20.822
  200   1HG   GLN  26          HG2       GLN  26   5.689   2.831 -21.563
  201   2HG   GLN  26          HG3       GLN  26   4.261   2.490 -22.520
  202   1HE2  GLN  26          HE22      GLN  26   5.882   4.948 -20.983
  203   2HE2  GLN  26          HE21      GLN  26   4.545   6.062 -20.729
  204    H    TYR  27           H        TYR  27   5.856   0.125 -18.722
  205    HA   TYR  27           HA       TYR  27   3.913  -1.851 -17.925
  206   1HB   TYR  27          HB2       TYR  27   6.950  -1.959 -17.820
  207   2HB   TYR  27          HB3       TYR  27   5.868  -3.324 -17.603
  208    HD1  TYR  27           HD1      TYR  27   7.883  -1.706 -19.954
  209    HD2  TYR  27           HD2      TYR  27   4.072  -3.683 -19.578
  210    HE1  TYR  27           HE1      TYR  27   7.987  -2.350 -22.345
  211    HE2  TYR  27           HE2      TYR  27   4.104  -4.224 -21.989
  212    HH   TYR  27           HH       TYR  27   5.305  -4.099 -23.984
  213    H    LEU  28           H        LEU  28   6.444  -0.050 -16.110
  214    HA   LEU  28           HA       LEU  28   5.987  -1.484 -13.630
  215   1HB   LEU  28          HB2       LEU  28   7.260   1.250 -14.116
  216   2HB   LEU  28          HB3       LEU  28   7.354   0.325 -12.665
  217    HG   LEU  28           HG       LEU  28   8.591  -0.521 -15.292
  218   1HD1  LEU  28          HD11      LEU  28   9.894   0.385 -12.691
  219   2HD1  LEU  28          HD12      LEU  28  10.703   0.008 -14.227
  220   3HD1  LEU  28          HD13      LEU  28   9.643   1.431 -14.096
  221   1HD2  LEU  28          HD21      LEU  28   9.672  -2.310 -13.997
  222   2HD2  LEU  28          HD22      LEU  28   8.784  -1.822 -12.539
  223   3HD2  LEU  28          HD23      LEU  28   7.922  -2.494 -13.934
  224    H    GLY  29           H        GLY  29   4.836   1.559 -15.013
  225   1HA   GLY  29          HA1       GLY  29   2.949   2.807 -14.497
  226   2HA   GLY  29          HA2       GLY  29   2.679   1.842 -13.032
  227    H    ASP  30           H        ASP  30   2.602   4.481 -12.690
  228    HA   ASP  30           HA       ASP  30   5.073   5.711 -11.949
  229   1HB   ASP  30          HB2       ASP  30   3.000   6.961 -12.475
  230   2HB   ASP  30          HB3       ASP  30   2.228   6.290 -11.035
  231    H    GLU  31           H        GLU  31   3.709   2.988 -10.677
  232    HA   GLU  31           HA       GLU  31   4.041   3.346  -7.840
  233   1HB   GLU  31          HB2       GLU  31   4.422   0.719  -9.316
  234   2HB   GLU  31          HB3       GLU  31   3.954   0.989  -7.640
  235   1HG   GLU  31          HG2       GLU  31   1.824   2.100  -8.624
  236   2HG   GLU  31          HG3       GLU  31   2.331   1.368 -10.161
  237    H    TRP  32           H        TRP  32   6.194   3.423 -10.426
  238    HA   TRP  32           HA       TRP  32   8.534   3.167  -8.662
  239   1HB   TRP  32          HB2       TRP  32   8.388   2.352 -11.592
  240   2HB   TRP  32          HB3       TRP  32   9.799   2.268 -10.552
  241    HD1  TRP  32           HD1      TRP  32   6.217   0.765 -10.532
  242    HE1  TRP  32           HE1      TRP  32   6.318  -1.698  -9.885
  243    HE3  TRP  32           HE3      TRP  32  11.285   0.318  -9.901
  244    HZ2  TRP  32           HZ2      TRP  32   8.338  -3.659  -9.334
  245    HZ3  TRP  32           HZ3      TRP  32  12.276  -1.893  -9.383
  246    HH2  TRP  32           HH2      TRP  32  10.823  -3.896  -9.121
  247    H    LYS  33           H        LYS  33   9.314   5.215  -8.514
  248    HA   LYS  33           HA       LYS  33   8.693   7.318 -10.381
  249   1HB   LYS  33          HB2       LYS  33  10.745   7.113  -8.126
  250   2HB   LYS  33          HB3       LYS  33  10.370   8.592  -9.021
  251   1HG   LYS  33          HG2       LYS  33   8.690   7.095  -7.014
  252   2HG   LYS  33          HG3       LYS  33   9.246   8.751  -6.952
  253   1HD   LYS  33          HD2       LYS  33   7.059   7.650  -8.773
  254   2HD   LYS  33          HD3       LYS  33   6.844   8.651  -7.339
  255   1HE   LYS  33          HE2       LYS  33   8.071  10.515  -8.431
  256   2HE   LYS  33          HE3       LYS  33   8.294   9.525  -9.879
  257   1HZ   LYS  33          HZ1       LYS  33   5.687  10.414  -8.796
  258   2HZ   LYS  33          HZ2       LYS  33   6.409  10.975 -10.146
  259   3HZ   LYS  33          HZ3       LYS  33   5.857   9.431 -10.098
  260    H    VAL  34           H        VAL  34   9.323   6.646 -12.402
  261    HA   VAL  34           HA       VAL  34  11.885   5.477 -12.886
  262    HB   VAL  34           HB       VAL  34  10.100   6.629 -15.041
  263   1HG1  VAL  34          HG11      VAL  34  12.333   5.312 -15.395
  264   2HG1  VAL  34          HG12      VAL  34  11.374   3.890 -14.955
  265   3HG1  VAL  34          HG13      VAL  34  10.900   4.886 -16.350
  266   1HG2  VAL  34          HG21      VAL  34   8.807   4.445 -15.063
  267   2HG2  VAL  34          HG22      VAL  34   9.425   4.131 -13.433
  268   3HG2  VAL  34          HG23      VAL  34   8.387   5.542 -13.753
  269    H    TYR  35           H        TYR  35  13.734   6.476 -13.619
  270    HA   TYR  35           HA       TYR  35  13.659   9.233 -14.713
  271   1HB   TYR  35          HB2       TYR  35  15.489   8.253 -12.474
  272   2HB   TYR  35          HB3       TYR  35  15.662   9.784 -13.312
  273    HD1  TYR  35           HD1      TYR  35  13.838  11.556 -13.085
  274    HD2  TYR  35           HD2      TYR  35  14.051   8.050 -10.577
  275    HE1  TYR  35           HE1      TYR  35  12.417  12.684 -11.403
  276    HE2  TYR  35           HE2      TYR  35  12.660   9.187  -8.872
  277    HH   TYR  35           HH       TYR  35  11.376  12.512  -9.320
  278    H    SER  36           H        SER  36  15.813   9.729 -15.801
  279    HA   SER  36           HA       SER  36  17.652   7.513 -16.079
  280   1HB   SER  36          HB2       SER  36  17.729   7.541 -18.481
  281   2HB   SER  36          HB3       SER  36  16.111   7.093 -17.956
  282    HG   SER  36           HG       SER  36  15.370   9.111 -18.472
  283    H    ALA  37           H        ALA  37  19.693   8.227 -17.113
  284    HA   ALA  37           HA       ALA  37  20.262  11.022 -17.457
  285   1HB   ALA  37          HB1       ALA  37  20.109  11.030 -14.990
  286   2HB   ALA  37          HB2       ALA  37  21.303   9.714 -14.903
  287   3HB   ALA  37          HB3       ALA  37  21.749  11.318 -15.532
  288    H    GLY  38           H        GLY  38  23.036  10.969 -17.038
  289   1HA   GLY  38          HA1       GLY  38  24.291   8.525 -17.771
  290   2HA   GLY  38          HA2       GLY  38  24.071   9.550 -19.203
  291    H    ILE  39           H        ILE  39  26.546   9.076 -18.772
  292    HA   ILE  39           HA       ILE  39  28.077  10.789 -17.095
  293    HB   ILE  39           HB       ILE  39  28.430   9.158 -19.578
  294   1HG1  ILE  39          HG12      ILE  39  30.211   9.452 -17.120
  295   2HG1  ILE  39          HG13      ILE  39  28.772   8.444 -17.135
  296   1HG2  ILE  39          HG21      ILE  39  30.720   9.920 -20.025
  297   2HG2  ILE  39          HG22      ILE  39  29.544  11.176 -20.355
  298   3HG2  ILE  39          HG23      ILE  39  30.509  11.246 -18.858
  299   1HD1  ILE  39          HD11      ILE  39  29.714   7.108 -19.017
  300   2HD1  ILE  39          HD12      ILE  39  31.214   8.069 -18.923
  301   3HD1  ILE  39          HD13      ILE  39  30.731   7.063 -17.561
  302    H    GLU  40           H        GLU  40  26.170  11.480 -19.973
  303    HA   GLU  40           HA       GLU  40  26.597  14.296 -19.621
  304   1HB   GLU  40          HB2       GLU  40  27.196  14.782 -21.912
  305   2HB   GLU  40          HB3       GLU  40  28.443  13.822 -21.124
  306   1HG   GLU  40          HG2       GLU  40  27.515  11.754 -22.254
  307   2HG   GLU  40          HG3       GLU  40  26.342  12.780 -23.081
  308    H    ALA  41           H        ALA  41  25.018  15.484 -21.084
  309    HA   ALA  41           HA       ALA  41  22.855  13.892 -22.257
  310   1HB   ALA  41          HB1       ALA  41  22.474  15.960 -20.025
  311   2HB   ALA  41          HB2       ALA  41  21.170  15.344 -21.048
  312   3HB   ALA  41          HB3       ALA  41  22.043  14.237 -19.963
  313    H    HIS  42           H        HIS  42  22.141  14.964 -24.078
  314    HA   HIS  42           HA       HIS  42  22.772  17.863 -24.420
  315   1HB   HIS  42          HB2       HIS  42  23.120  15.595 -26.426
  316   2HB   HIS  42          HB3       HIS  42  23.069  17.290 -26.883
  317    HD1  HIS  42           HD1      HIS  42  25.053  17.319 -23.816
  318    HD2  HIS  42           HD2      HIS  42  25.600  16.299 -27.865
  319    HE1  HIS  42           HE1      HIS  42  27.563  17.435 -24.252
  320    H    GLY  43           H        GLY  43  20.338  15.850 -23.776
  321   1HA   GLY  43          HA1       GLY  43  18.036  16.367 -23.978
  322   2HA   GLY  43          HA2       GLY  43  18.338  17.289 -25.453
  323    H    LEU  44           H        LEU  44  16.487  15.053 -24.998
  324    HA   LEU  44           HA       LEU  44  17.539  12.654 -26.029
  325   1HB   LEU  44          HB2       LEU  44  15.382  11.797 -26.028
  326   2HB   LEU  44          HB3       LEU  44  15.512  12.848 -24.627
  327    HG   LEU  44           HG       LEU  44  14.042  13.454 -27.237
  328   1HD1  LEU  44          HD11      LEU  44  13.020  11.767 -25.760
  329   2HD1  LEU  44          HD12      LEU  44  13.094  12.884 -24.390
  330   3HD1  LEU  44          HD13      LEU  44  12.046  13.250 -25.776
  331   1HD2  LEU  44          HD21      LEU  44  13.072  15.414 -26.012
  332   2HD2  LEU  44          HD22      LEU  44  14.231  15.149 -24.695
  333   3HD2  LEU  44          HD23      LEU  44  14.790  15.613 -26.327
  334    H    ASN  45           H        ASN  45  17.344  11.624 -27.984
  335    HA   ASN  45           HA       ASN  45  17.848  13.312 -30.261
  336   1HB   ASN  45          HB2       ASN  45  18.972  11.148 -29.693
  337   2HB   ASN  45          HB3       ASN  45  17.475  10.288 -30.032
  338   1HD2  ASN  45          HD22      ASN  45  20.330  10.506 -31.325
  339   2HD2  ASN  45          HD21      ASN  45  19.960  10.671 -33.027
  340    HA   PRO  46           HA       PRO  46  13.521  13.561 -31.634
  341   1HB   PRO  46          HB2       PRO  46  14.855  13.606 -34.350
  342   2HB   PRO  46          HB3       PRO  46  13.490  14.602 -33.752
  343   1HG   PRO  46          HG2       PRO  46  15.993  15.635 -33.819
  344   2HG   PRO  46          HG3       PRO  46  14.951  15.913 -32.386
  345   1HD   PRO  46          HD2       PRO  46  17.197  13.920 -32.720
  346   2HD   PRO  46          HD3       PRO  46  16.792  14.951 -31.315
  347    H    ASN  47           H        ASN  47  15.835  11.213 -33.060
  348    HA   ASN  47           HA       ASN  47  13.745   9.569 -34.253
  349   1HB   ASN  47          HB2       ASN  47  16.688   9.093 -33.677
  350   2HB   ASN  47          HB3       ASN  47  15.633   7.836 -34.309
  351   1HD2  ASN  47          HD22      ASN  47  17.971   8.854 -35.670
  352   2HD2  ASN  47          HD21      ASN  47  17.400   9.546 -37.165
  353    H    ALA  48           H        ALA  48  15.232   9.828 -31.054
  354    HA   ALA  48           HA       ALA  48  14.303   7.284 -30.082
  355   1HB   ALA  48          HB1       ALA  48  16.097   8.740 -28.958
  356   2HB   ALA  48          HB2       ALA  48  14.795   9.812 -28.432
  357   3HB   ALA  48          HB3       ALA  48  14.816   8.132 -27.889
  358    H    VAL  49           H        VAL  49  13.049  10.674 -30.042
  359    HA   VAL  49           HA       VAL  49  10.607  10.064 -28.745
  360    HB   VAL  49           HB       VAL  49  11.005  12.254 -30.833
  361   1HG1  VAL  49          HG11      VAL  49   8.651  11.923 -30.115
  362   2HG1  VAL  49          HG12      VAL  49   9.145  12.056 -28.414
  363   3HG1  VAL  49          HG13      VAL  49   9.292  13.450 -29.499
  364   1HG2  VAL  49          HG21      VAL  49  11.589  13.725 -28.897
  365   2HG2  VAL  49          HG22      VAL  49  11.645  12.285 -27.862
  366   3HG2  VAL  49          HG23      VAL  49  12.807  12.486 -29.191
  367    H    LYS  50           H        LYS  50  11.378  10.175 -32.284
  368    HA   LYS  50           HA       LYS  50   8.791   9.406 -33.117
  369   1HB   LYS  50          HB2       LYS  50  10.559  10.429 -34.549
  370   2HB   LYS  50          HB3       LYS  50  11.476   8.926 -34.482
  371   1HG   LYS  50          HG2       LYS  50  10.299   9.147 -36.592
  372   2HG   LYS  50          HG3       LYS  50   9.729   7.752 -35.701
  373   1HD   LYS  50          HD2       LYS  50   8.061  10.104 -35.123
  374   2HD   LYS  50          HD3       LYS  50   8.182   9.840 -36.852
  375   1HE   LYS  50          HE2       LYS  50   7.405   7.670 -34.851
  376   2HE   LYS  50          HE3       LYS  50   6.242   8.658 -35.736
  377   1HZ   LYS  50          HZ1       LYS  50   8.256   6.985 -37.107
  378   2HZ   LYS  50          HZ2       LYS  50   6.778   6.431 -36.727
  379   3HZ   LYS  50          HZ3       LYS  50   6.936   7.696 -37.766
  380    H    ALA  51           H        ALA  51  11.622   7.326 -32.244
  381    HA   ALA  51           HA       ALA  51  10.431   4.859 -32.933
  382   1HB   ALA  51          HB1       ALA  51  12.060   3.874 -31.376
  383   2HB   ALA  51          HB2       ALA  51  12.825   5.127 -32.368
  384   3HB   ALA  51          HB3       ALA  51  12.398   5.473 -30.682
  385    H    MET  52           H        MET  52  10.265   6.726 -29.824
  386    HA   MET  52           HA       MET  52   8.571   4.760 -28.583
  387   1HB   MET  52          HB2       MET  52   8.976   7.706 -27.923
  388   2HB   MET  52          HB3       MET  52   8.125   6.543 -26.911
  389   1HG   MET  52          HG2       MET  52  11.064   6.614 -27.598
  390   2HG   MET  52          HG3       MET  52  10.303   6.714 -26.023
  391   1HE   MET  52          HE1       MET  52   8.214   4.095 -26.397
  392   2HE   MET  52          HE2       MET  52   9.181   3.045 -25.353
  393   3HE   MET  52          HE3       MET  52   9.017   4.754 -24.936
  394    H    LYS  53           H        LYS  53   7.812   7.709 -30.499
  395    HA   LYS  53           HA       LYS  53   5.002   7.484 -30.118
  396   1HB   LYS  53          HB2       LYS  53   6.653   8.620 -32.386
  397   2HB   LYS  53          HB3       LYS  53   4.906   8.793 -32.307
  398   1HG   LYS  53          HG2       LYS  53   6.476   9.673 -29.878
  399   2HG   LYS  53          HG3       LYS  53   6.626  10.643 -31.341
  400   1HD   LYS  53          HD2       LYS  53   4.933  11.605 -29.962
  401   2HD   LYS  53          HD3       LYS  53   4.167  10.944 -31.411
  402   1HE   LYS  53          HE2       LYS  53   3.453   8.944 -30.114
  403   2HE   LYS  53          HE3       LYS  53   4.260   9.588 -28.675
  404   1HZ   LYS  53          HZ1       LYS  53   1.891  10.063 -28.649
  405   2HZ   LYS  53          HZ2       LYS  53   2.715  11.466 -28.741
  406   3HZ   LYS  53          HZ3       LYS  53   1.970  10.863 -30.065
  407    H    GLU  54           H        GLU  54   7.210   5.603 -32.131
  408    HA   GLU  54           HA       GLU  54   5.254   4.594 -33.928
  409   1HB   GLU  54          HB2       GLU  54   7.827   4.571 -34.121
  410   2HB   GLU  54          HB3       GLU  54   7.767   3.144 -33.089
  411   1HG   GLU  54          HG2       GLU  54   7.899   2.527 -35.444
  412   2HG   GLU  54          HG3       GLU  54   6.397   1.964 -34.719
  413    H    VAL  55           H        VAL  55   5.835   3.978 -30.557
  414    HA   VAL  55           HA       VAL  55   4.052   1.579 -30.677
  415    HB   VAL  55           HB       VAL  55   5.138   0.900 -28.559
  416   1HG1  VAL  55          HG11      VAL  55   7.044   1.314 -30.907
  417   2HG1  VAL  55          HG12      VAL  55   7.206   0.100 -29.627
  418   3HG1  VAL  55          HG13      VAL  55   5.852   0.009 -30.756
  419   1HG2  VAL  55          HG21      VAL  55   7.168   1.952 -27.771
  420   2HG2  VAL  55          HG22      VAL  55   7.206   3.063 -29.136
  421   3HG2  VAL  55          HG23      VAL  55   5.947   3.211 -27.883
  422    H    GLY  56           H        GLY  56   3.964   4.839 -29.955
  423   1HA   GLY  56          HA1       GLY  56   2.014   5.931 -29.322
  424   2HA   GLY  56          HA2       GLY  56   1.370   4.439 -28.615
  425    H    ILE  57           H        ILE  57   4.624   5.818 -27.985
  426    HA   ILE  57           HA       ILE  57   3.832   6.470 -25.189
  427    HB   ILE  57           HB       ILE  57   6.331   5.128 -26.285
  428   1HG1  ILE  57          HG12      ILE  57   4.346   4.195 -24.174
  429   2HG1  ILE  57          HG13      ILE  57   4.338   3.662 -25.849
  430   1HG2  ILE  57          HG21      ILE  57   7.161   5.167 -23.869
  431   2HG2  ILE  57          HG22      ILE  57   7.129   6.733 -24.656
  432   3HG2  ILE  57          HG23      ILE  57   5.847   6.289 -23.508
  433   1HD1  ILE  57          HD11      ILE  57   6.606   2.679 -25.570
  434   2HD1  ILE  57          HD12      ILE  57   6.537   3.071 -23.839
  435   3HD1  ILE  57          HD13      ILE  57   5.369   1.948 -24.549
  436    H    ASP  58           H        ASP  58   5.197   8.195 -24.344
  437    HA   ASP  58           HA       ASP  58   6.426   9.981 -26.371
  438   1HB   ASP  58          HB2       ASP  58   4.341  11.091 -25.826
  439   2HB   ASP  58          HB3       ASP  58   4.576  10.794 -24.090
  440    H    ILE  59           H        ILE  59   8.299  10.875 -25.680
  441    HA   ILE  59           HA       ILE  59   9.153  10.544 -22.874
  442    HB   ILE  59           HB       ILE  59  11.496  10.089 -23.706
  443   1HG1  ILE  59          HG12      ILE  59  10.134   9.195 -26.285
  444   2HG1  ILE  59          HG13      ILE  59  10.989  10.723 -26.129
  445   1HG2  ILE  59          HG21      ILE  59   9.408   7.930 -24.262
  446   2HG2  ILE  59          HG22      ILE  59  11.105   7.674 -23.810
  447   3HG2  ILE  59          HG23      ILE  59   9.988   8.399 -22.658
  448   1HD1  ILE  59          HD11      ILE  59  12.237   7.961 -25.732
  449   2HD1  ILE  59          HD12      ILE  59  12.443   9.037 -27.119
  450   3HD1  ILE  59          HD13      ILE  59  13.073   9.513 -25.544
  451    H    SER  60           H        SER  60   8.226  12.721 -25.137
  452    HA   SER  60           HA       SER  60  10.276  14.711 -24.964
  453   1HB   SER  60          HB2       SER  60   7.317  15.313 -25.140
  454   2HB   SER  60          HB3       SER  60   8.682  16.201 -25.846
  455    HG   SER  60           HG       SER  60   7.481  13.764 -26.574
  456    H    ASN  61           H        ASN  61   7.756  13.620 -22.786
  457    HA   ASN  61           HA       ASN  61   7.712  15.718 -20.901
  458   1HB   ASN  61          HB2       ASN  61   6.642  14.095 -19.429
  459   2HB   ASN  61          HB3       ASN  61   6.019  13.913 -21.059
  460   1HD2  ASN  61          HD22      ASN  61   6.537  12.014 -22.263
  461   2HD2  ASN  61          HD21      ASN  61   7.199  10.583 -21.508
  462    H    GLN  62           H        GLN  62  10.516  13.883 -21.520
  463    HA   GLN  62           HA       GLN  62  11.459  14.197 -18.723
  464   1HB   GLN  62          HB2       GLN  62  12.404  11.833 -18.908
  465   2HB   GLN  62          HB3       GLN  62  10.651  11.958 -18.735
  466   1HG   GLN  62          HG2       GLN  62  10.270  11.519 -21.056
  467   2HG   GLN  62          HG3       GLN  62  11.983  11.763 -21.437
  468   1HE2  GLN  62          HE22      GLN  62  13.222  10.075 -21.656
  469   2HE2  GLN  62          HE21      GLN  62  12.734   8.409 -21.315
  470    H    THR  63           H        THR  63  12.155  16.018 -20.517
  471    HA   THR  63           HA       THR  63  14.301  15.634 -22.206
  472    HB   THR  63           HB       THR  63  14.816  18.092 -21.519
  473    HG1  THR  63           HG1      THR  63  13.830  18.039 -19.460
  474   1HG2  THR  63          HG21      THR  63  13.407  17.452 -23.462
  475   2HG2  THR  63          HG22      THR  63  11.993  17.321 -22.394
  476   3HG2  THR  63          HG23      THR  63  12.776  18.896 -22.654
  477    H    SER  64           H        SER  64  16.445  15.292 -22.061
  478    HA   SER  64           HA       SER  64  17.410  13.848 -20.042
  479   1HB   SER  64          HB2       SER  64  19.059  15.477 -21.999
  480   2HB   SER  64          HB3       SER  64  19.438  13.877 -21.341
  481    HG   SER  64           HG       SER  64  18.417  13.097 -22.946
  482    H    ASP  65           H        ASP  65  19.231  13.986 -18.702
  483    HA   ASP  65           HA       ASP  65  20.499  16.514 -18.080
  484   1HB   ASP  65          HB2       ASP  65  18.406  16.581 -16.654
  485   2HB   ASP  65          HB3       ASP  65  18.941  15.091 -15.875
  486    H    ILE  66           H        ILE  66  22.310  16.145 -16.564
  487    HA   ILE  66           HA       ILE  66  23.569  13.514 -16.889
  488    HB   ILE  66           HB       ILE  66  25.298  14.783 -15.309
  489   1HG1  ILE  66          HG12      ILE  66  23.771  16.889 -15.186
  490   2HG1  ILE  66          HG13      ILE  66  25.502  17.044 -15.401
  491   1HG2  ILE  66          HG21      ILE  66  26.476  15.466 -17.361
  492   2HG2  ILE  66          HG22      ILE  66  25.780  13.846 -17.439
  493   3HG2  ILE  66          HG23      ILE  66  24.971  15.183 -18.282
  494   1HD1  ILE  66          HD11      ILE  66  24.256  18.628 -16.830
  495   2HD1  ILE  66          HD12      ILE  66  25.275  17.540 -17.784
  496   3HD1  ILE  66          HD13      ILE  66  23.526  17.277 -17.715
  497    H    ILE  67           H        ILE  67  24.535  12.520 -14.960
  498    HA   ILE  67           HA       ILE  67  22.551  11.542 -13.280
  499    HB   ILE  67           HB       ILE  67  25.577  11.410 -13.328
  500   1HG1  ILE  67          HG12      ILE  67  23.449   9.264 -13.704
  501   2HG1  ILE  67          HG13      ILE  67  23.999  10.270 -15.030
  502   1HG2  ILE  67          HG21      ILE  67  23.788   9.893 -11.387
  503   2HG2  ILE  67          HG22      ILE  67  25.516   9.580 -11.672
  504   3HG2  ILE  67          HG23      ILE  67  25.021  11.097 -10.942
  505   1HD1  ILE  67          HD11      ILE  67  26.331   9.447 -14.685
  506   2HD1  ILE  67          HD12      ILE  67  25.703   8.295 -13.479
  507   3HD1  ILE  67          HD13      ILE  67  25.159   8.202 -15.161
  508    H    ASP  68           H        ASP  68  22.115  11.706 -11.114
  509    HA   ASP  68           HA       ASP  68  23.423  13.825  -9.514
  510   1HB   ASP  68          HB2       ASP  68  21.300  14.736 -10.580
  511   2HB   ASP  68          HB3       ASP  68  20.399  13.547  -9.632
  512    H    SER  69           H        SER  69  23.763  13.214  -7.443
  513    HA   SER  69           HA       SER  69  23.677  10.594  -6.601
  514   1HB   SER  69          HB2       SER  69  23.669  13.047  -4.825
  515   2HB   SER  69          HB3       SER  69  24.391  11.463  -4.483
  516    HG   SER  69           HG       SER  69  25.942  13.006  -5.197
  517    H    ASP  70           H        ASP  70  21.109  12.986  -6.398
  518    HA   ASP  70           HA       ASP  70  19.715  11.867  -4.156
  519   1HB   ASP  70          HB2       ASP  70  19.547  14.233  -4.905
  520   2HB   ASP  70          HB3       ASP  70  18.717  13.693  -6.371
  521    H    ILE  71           H        ILE  71  20.056  10.746  -7.341
  522    HA   ILE  71           HA       ILE  71  17.608   9.065  -7.117
  523    HB   ILE  71           HB       ILE  71  19.097   9.892  -9.621
  524   1HG1  ILE  71          HG12      ILE  71  16.261  10.802  -9.053
  525   2HG1  ILE  71          HG13      ILE  71  17.579  11.725  -8.350
  526   1HG2  ILE  71          HG21      ILE  71  17.134   8.857 -10.761
  527   2HG2  ILE  71          HG22      ILE  71  17.999   7.697  -9.745
  528   3HG2  ILE  71          HG23      ILE  71  16.466   8.390  -9.184
  529   1HD1  ILE  71          HD11      ILE  71  16.945  12.680 -10.488
  530   2HD1  ILE  71          HD12      ILE  71  18.616  12.085 -10.504
  531   3HD1  ILE  71          HD13      ILE  71  17.327  11.153 -11.316
  532    H    LEU  72           H        LEU  72  21.090   9.211  -8.078
  533    HA   LEU  72           HA       LEU  72  21.674   6.552  -8.529
  534   1HB   LEU  72          HB2       LEU  72  23.248   8.558  -6.863
  535   2HB   LEU  72          HB3       LEU  72  23.859   6.965  -7.217
  536    HG   LEU  72           HG       LEU  72  23.245   9.053  -9.307
  537   1HD1  LEU  72          HD11      LEU  72  25.131   9.709  -7.921
  538   2HD1  LEU  72          HD12      LEU  72  25.838   8.087  -8.010
  539   3HD1  LEU  72          HD13      LEU  72  25.781   9.111  -9.448
  540   1HD2  LEU  72          HD21      LEU  72  24.565   6.293  -9.489
  541   2HD2  LEU  72          HD22      LEU  72  23.030   6.765 -10.236
  542   3HD2  LEU  72          HD23      LEU  72  24.536   7.481 -10.805
  543    H    ASN  73           H        ASN  73  21.837   8.021  -5.290
  544    HA   ASN  73           HA       ASN  73  22.148   5.414  -4.079
  545   1HB   ASN  73          HB2       ASN  73  22.943   6.473  -2.244
  546   2HB   ASN  73          HB3       ASN  73  23.218   7.771  -3.389
  547   1HD2  ASN  73          HD22      ASN  73  21.221   9.435  -3.521
  548   2HD2  ASN  73          HD21      ASN  73  20.460   9.779  -1.988
  549    H    ASN  74           H        ASN  74  19.423   6.781  -5.157
  550    HA   ASN  74           HA       ASN  74  17.696   6.173  -2.789
  551   1HB   ASN  74          HB2       ASN  74  17.930   8.543  -3.473
  552   2HB   ASN  74          HB3       ASN  74  17.469   8.107  -5.114
  553   1HD2  ASN  74          HD22      ASN  74  15.938   9.850  -4.795
  554   2HD2  ASN  74          HD21      ASN  74  14.376   9.490  -4.068
  555    H    ALA  75           H        ALA  75  18.178   5.722  -6.269
  556    HA   ALA  75           HA       ALA  75  15.771   4.492  -6.993
  557   1HB   ALA  75          HB1       ALA  75  17.411   5.382  -8.553
  558   2HB   ALA  75          HB2       ALA  75  18.541   4.082  -8.104
  559   3HB   ALA  75          HB3       ALA  75  16.987   3.702  -8.899
  560    H    ASP  76           H        ASP  76  14.921   2.554  -6.644
  561    HA   ASP  76           HA       ASP  76  16.028   0.662  -4.794
  562   1HB   ASP  76          HB2       ASP  76  13.602   0.930  -5.193
  563   2HB   ASP  76          HB3       ASP  76  13.803   0.359  -6.851
  564    H    LEU  77           H        LEU  77  16.239   1.180  -8.248
  565    HA   LEU  77           HA       LEU  77  18.327  -0.875  -8.485
  566   1HB   LEU  77          HB2       LEU  77  16.296  -2.120  -9.140
  567   2HB   LEU  77          HB3       LEU  77  15.818  -0.811 -10.223
  568    HG   LEU  77           HG       LEU  77  17.826  -1.250 -11.642
  569   1HD1  LEU  77          HD11      LEU  77  19.328  -2.288  -9.957
  570   2HD1  LEU  77          HD12      LEU  77  18.227  -3.679  -9.836
  571   3HD1  LEU  77          HD13      LEU  77  19.100  -3.338 -11.346
  572   1HD2  LEU  77          HD21      LEU  77  16.059  -3.675 -11.167
  573   2HD2  LEU  77          HD22      LEU  77  15.671  -2.272 -12.187
  574   3HD2  LEU  77          HD23      LEU  77  17.009  -3.337 -12.631
  575    H    VAL  78           H        VAL  78  19.908  -0.185  -9.873
  576    HA   VAL  78           HA       VAL  78  19.331   2.123 -11.671
  577    HB   VAL  78           HB       VAL  78  21.964   1.335 -10.343
  578   1HG1  VAL  78          HG11      VAL  78  22.395   2.360 -12.519
  579   2HG1  VAL  78          HG12      VAL  78  21.245   3.672 -12.174
  580   3HG1  VAL  78          HG13      VAL  78  22.754   3.537 -11.253
  581   1HG2  VAL  78          HG21      VAL  78  20.138   3.726  -9.816
  582   2HG2  VAL  78          HG22      VAL  78  20.427   2.371  -8.710
  583   3HG2  VAL  78          HG23      VAL  78  21.741   3.472  -9.091
  584    H    VAL  79           H        VAL  79  20.047   1.805 -13.855
  585    HA   VAL  79           HA       VAL  79  21.078  -0.912 -14.528
  586    HB   VAL  79           HB       VAL  79  18.928   0.592 -16.062
  587   1HG1  VAL  79          HG11      VAL  79  19.809  -2.322 -16.170
  588   2HG1  VAL  79          HG12      VAL  79  18.584  -1.554 -17.196
  589   3HG1  VAL  79          HG13      VAL  79  20.281  -1.078 -17.336
  590   1HG2  VAL  79          HG21      VAL  79  18.486  -1.609 -14.014
  591   2HG2  VAL  79          HG22      VAL  79  17.833   0.042 -13.984
  592   3HG2  VAL  79          HG23      VAL  79  17.285  -1.094 -15.214
  593    H    THR  80           H        THR  80  22.943  -0.671 -15.717
  594    HA   THR  80           HA       THR  80  23.336   1.905 -17.185
  595    HB   THR  80           HB       THR  80  25.715   0.835 -17.464
  596    HG1  THR  80           HG1      THR  80  25.056  -1.141 -16.334
  597   1HG2  THR  80          HG21      THR  80  24.748   2.028 -14.838
  598   2HG2  THR  80          HG22      THR  80  26.435   1.990 -15.412
  599   3HG2  THR  80          HG23      THR  80  25.233   2.918 -16.305
  600    H    LEU  81           H        LEU  81  23.245   1.925 -19.337
  601    HA   LEU  81           HA       LEU  81  22.640  -0.666 -20.697
  602   1HB   LEU  81          HB2       LEU  81  21.868   2.168 -21.400
  603   2HB   LEU  81          HB3       LEU  81  21.529   0.767 -22.389
  604    HG   LEU  81           HG       LEU  81  20.025  -0.149 -20.670
  605   1HD1  LEU  81          HD11      LEU  81  20.561   2.475 -19.199
  606   2HD1  LEU  81          HD12      LEU  81  19.172   1.418 -18.887
  607   3HD1  LEU  81          HD13      LEU  81  20.785   0.822 -18.577
  608   1HD2  LEU  81          HD21      LEU  81  19.374   2.721 -21.477
  609   2HD2  LEU  81          HD22      LEU  81  19.089   1.269 -22.463
  610   3HD2  LEU  81          HD23      LEU  81  18.195   1.507 -20.967
  611    H    CYS  82           H        CYS  82  25.394   0.426 -20.136
  612    HA   CYS  82           HA       CYS  82  26.468   1.502 -22.575
  613   1HB   CYS  82          HB2       CYS  82  28.646   1.043 -21.447
  614   2HB   CYS  82          HB3       CYS  82  27.560   2.131 -20.589
  615    H    GLY  83           H        GLY  83  26.494   0.224 -24.411
  616   1HA   GLY  83          HA1       GLY  83  28.284  -2.049 -24.373
  617   2HA   GLY  83          HA2       GLY  83  26.623  -2.473 -24.808
  618    H    ASP  84           H        ASP  84  27.953   0.705 -25.417
  619    HA   ASP  84           HA       ASP  84  27.648   0.434 -28.334
  620   1HB   ASP  84          HB2       ASP  84  26.914   2.728 -28.216
  621   2HB   ASP  84          HB3       ASP  84  26.110   1.903 -26.878
  622    H    ALA  85           H        ALA  85  28.782   2.591 -29.320
  623    HA   ALA  85           HA       ALA  85  31.463   1.874 -29.596
  624   1HB   ALA  85          HB1       ALA  85  31.698   3.996 -30.825
  625   2HB   ALA  85          HB2       ALA  85  30.176   3.189 -31.249
  626   3HB   ALA  85          HB3       ALA  85  30.170   4.582 -30.138
  627    H    ALA  86           H        ALA  86  30.051   4.127 -27.235
  628    HA   ALA  86           HA       ALA  86  32.666   5.208 -26.454
  629   1HB   ALA  86          HB1       ALA  86  29.910   5.530 -25.201
  630   2HB   ALA  86          HB2       ALA  86  31.364   6.467 -24.798
  631   3HB   ALA  86          HB3       ALA  86  30.634   6.618 -26.406
  632    H    ASP  87           H        ASP  87  30.171   3.089 -25.041
  633    HA   ASP  87           HA       ASP  87  30.099   1.771 -23.203
  634   1HB   ASP  87          HB2       ASP  87  31.111   0.387 -24.922
  635   2HB   ASP  87          HB3       ASP  87  32.731   0.825 -24.370
  636    H    LYS  88           H        LYS  88  31.292   4.375 -22.509
  637    HA   LYS  88           HA       LYS  88  33.436   4.012 -20.689
  638   1HB   LYS  88          HB2       LYS  88  31.296   6.181 -20.748
  639   2HB   LYS  88          HB3       LYS  88  32.758   6.252 -19.789
  640   1HG   LYS  88          HG2       LYS  88  32.615   6.179 -22.831
  641   2HG   LYS  88          HG3       LYS  88  32.930   7.594 -21.840
  642   1HD   LYS  88          HD2       LYS  88  34.747   5.160 -22.115
  643   2HD   LYS  88          HD3       LYS  88  34.982   6.748 -22.848
  644   1HE   LYS  88          HE2       LYS  88  35.107   7.779 -20.576
  645   2HE   LYS  88          HE3       LYS  88  34.934   6.178 -19.848
  646   1HZ   LYS  88          HZ1       LYS  88  37.178   7.021 -21.592
  647   2HZ   LYS  88          HZ2       LYS  88  37.247   6.842 -19.976
  648   3HZ   LYS  88          HZ3       LYS  88  37.019   5.537 -20.923
  649    H    CYS  89           H        CYS  89  30.084   3.282 -20.280
  650    HA   CYS  89           HA       CYS  89  28.738   2.720 -18.599
  651   1HB   CYS  89          HB2       CYS  89  31.255   1.413 -17.578
  652   2HB   CYS  89          HB3       CYS  89  29.649   1.134 -16.927
  653    HA   PRO  90           HA       PRO  90  29.327   6.378 -15.941
  654   1HB   PRO  90          HB2       PRO  90  26.466   5.633 -15.402
  655   2HB   PRO  90          HB3       PRO  90  27.198   7.248 -15.688
  656   1HG   PRO  90          HG2       PRO  90  25.819   5.968 -17.660
  657   2HG   PRO  90          HG3       PRO  90  27.303   6.899 -18.022
  658   1HD   PRO  90          HD2       PRO  90  26.963   3.933 -17.769
  659   2HD   PRO  90          HD3       PRO  90  27.973   4.879 -18.905
  660    H    MET  91           H        MET  91  29.928   6.456 -13.829
  661    HA   MET  91           HA       MET  91  30.114   4.061 -12.299
  662   1HB   MET  91          HB2       MET  91  31.801   5.888 -12.298
  663   2HB   MET  91          HB3       MET  91  30.629   6.971 -11.529
  664   1HG   MET  91          HG2       MET  91  30.559   5.513  -9.549
  665   2HG   MET  91          HG3       MET  91  31.643   4.358 -10.337
  666   1HE   MET  91          HE1       MET  91  33.786   5.819  -7.399
  667   2HE   MET  91          HE2       MET  91  32.034   5.521  -7.403
  668   3HE   MET  91          HE3       MET  91  33.138   4.350  -8.160
  669    H    THR  92           H        THR  92  28.955   3.433 -10.520
  670    HA   THR  92           HA       THR  92  26.666   5.044  -9.552
  671    HB   THR  92           HB       THR  92  25.708   2.736  -9.112
  672    HG1  THR  92           HG1      THR  92  27.500   1.451  -9.157
  673   1HG2  THR  92          HG21      THR  92  24.990   2.331 -11.386
  674   2HG2  THR  92          HG22      THR  92  25.170   4.083 -11.197
  675   3HG2  THR  92          HG23      THR  92  26.422   3.150 -12.045
  676    HA   PRO  93           HA       PRO  93  28.553   4.391  -5.497
  677   1HB   PRO  93          HB2       PRO  93  26.391   4.105  -3.821
  678   2HB   PRO  93          HB3       PRO  93  26.884   5.672  -4.530
  679   1HG   PRO  93          HG2       PRO  93  24.738   3.776  -5.503
  680   2HG   PRO  93          HG3       PRO  93  24.632   5.550  -5.292
  681   1HD   PRO  93          HD2       PRO  93  25.125   4.392  -7.719
  682   2HD   PRO  93          HD3       PRO  93  25.885   5.943  -7.255
  683    HA   PRO  94           HA       PRO  94  28.693  -0.020  -5.381
  684   1HB   PRO  94          HB2       PRO  94  29.760  -0.609  -2.935
  685   2HB   PRO  94          HB3       PRO  94  30.678   0.229  -4.223
  686   1HG   PRO  94          HG2       PRO  94  29.230   1.459  -1.864
  687   2HG   PRO  94          HG3       PRO  94  30.892   1.801  -2.444
  688   1HD   PRO  94          HD2       PRO  94  28.727   3.361  -3.110
  689   2HD   PRO  94          HD3       PRO  94  30.093   3.095  -4.243
  690    H    HIS  95           H        HIS  95  26.835   1.619  -2.866
  691    HA   HIS  95           HA       HIS  95  25.775  -0.749  -1.658
  692   1HB   HIS  95          HB2       HIS  95  24.765   2.120  -1.501
  693   2HB   HIS  95          HB3       HIS  95  24.420   0.818  -0.365
  694    HD1  HIS  95           HD1      HIS  95  26.581   3.717  -0.511
  695    HD2  HIS  95           HD2      HIS  95  27.001  -0.312   0.647
  696    HE1  HIS  95           HE1      HIS  95  28.632   3.614   0.990
  697    H    VAL  96           H        VAL  96  24.731   1.105  -4.480
  698    HA   VAL  96           HA       VAL  96  21.946   0.345  -4.118
  699    HB   VAL  96           HB       VAL  96  22.751   2.529  -5.161
  700   1HG1  VAL  96          HG11      VAL  96  23.207   2.688  -7.475
  701   2HG1  VAL  96          HG12      VAL  96  24.366   1.529  -6.814
  702   3HG1  VAL  96          HG13      VAL  96  22.968   0.946  -7.737
  703   1HG2  VAL  96          HG21      VAL  96  20.429   1.729  -5.110
  704   2HG2  VAL  96          HG22      VAL  96  20.804   2.729  -6.505
  705   3HG2  VAL  96          HG23      VAL  96  20.667   0.971  -6.703
  706    H    LYS  97           H        LYS  97  20.781  -1.072  -5.434
  707    HA   LYS  97           HA       LYS  97  22.166  -3.427  -6.447
  708   1HB   LYS  97          HB2       LYS  97  19.854  -3.447  -5.395
  709   2HB   LYS  97          HB3       LYS  97  19.259  -2.545  -6.800
  710   1HG   LYS  97          HG2       LYS  97  19.975  -4.436  -8.280
  711   2HG   LYS  97          HG3       LYS  97  20.534  -5.316  -6.845
  712   1HD   LYS  97          HD2       LYS  97  18.208  -5.305  -5.941
  713   2HD   LYS  97          HD3       LYS  97  17.673  -4.373  -7.342
  714   1HE   LYS  97          HE2       LYS  97  17.050  -6.644  -7.731
  715   2HE   LYS  97          HE3       LYS  97  18.360  -6.250  -8.846
  716   1HZ   LYS  97          HZ1       LYS  97  18.663  -7.775  -6.316
  717   2HZ   LYS  97          HZ2       LYS  97  18.655  -8.418  -7.810
  718   3HZ   LYS  97          HZ3       LYS  97  19.879  -7.444  -7.361
  719    H    ARG  98           H        ARG  98  22.654  -3.789  -8.618
  720    HA   ARG  98           HA       ARG  98  21.924  -1.683 -10.559
  721   1HB   ARG  98          HB2       ARG  98  24.114  -1.114  -9.634
  722   2HB   ARG  98          HB3       ARG  98  24.741  -2.706 -10.090
  723   1HG   ARG  98          HG2       ARG  98  24.475  -2.193 -12.460
  724   2HG   ARG  98          HG3       ARG  98  23.650  -0.657 -12.085
  725   1HD   ARG  98          HD2       ARG  98  25.650   0.246 -11.112
  726   2HD   ARG  98          HD3       ARG  98  26.481  -1.313 -11.196
  727    HE   ARG  98           HE       ARG  98  25.649  -0.560 -13.824
  728   1HH1  ARG  98          HH21      ARG  98  27.928   0.726 -11.443
  729   2HH1  ARG  98          HH22      ARG  98  29.277   0.749 -12.532
  730   1HH2  ARG  98          HH11      ARG  98  27.296  -0.347 -15.284
  731   2HH2  ARG  98          HH12      ARG  98  28.901   0.161 -14.821
  732    H    GLU  99           H        GLU  99  21.837  -2.328 -12.694
  733    HA   GLU  99           HA       GLU  99  22.249  -5.190 -13.409
  734   1HB   GLU  99          HB2       GLU  99  19.915  -3.316 -13.800
  735   2HB   GLU  99          HB3       GLU  99  20.317  -4.376 -15.135
  736   1HG   GLU  99          HG2       GLU  99  19.928  -5.500 -12.350
  737   2HG   GLU  99          HG3       GLU  99  18.559  -5.150 -13.405
  738    H    HIS 100           H        HIS 100  22.764  -5.417 -15.722
  739    HA   HIS 100           HA       HIS 100  23.893  -3.000 -17.024
  740   1HB   HIS 100          HB2       HIS 100  25.777  -4.059 -15.986
  741   2HB   HIS 100          HB3       HIS 100  25.252  -5.663 -16.504
  742    HD1  HIS 100           HD1      HIS 100  26.871  -2.482 -17.992
  743    HD2  HIS 100           HD2      HIS 100  25.890  -6.465 -18.944
  744    HE1  HIS 100           HE1      HIS 100  28.024  -2.996 -20.199
  745    H    TRP 101           H        TRP 101  22.836  -2.784 -18.848
  746    HA   TRP 101           HA       TRP 101  21.788  -5.145 -20.361
  747   1HB   TRP 101          HB2       TRP 101  20.516  -2.418 -19.877
  748   2HB   TRP 101          HB3       TRP 101  19.944  -3.590 -21.046
  749    HD1  TRP 101           HD1      TRP 101  20.712  -5.040 -17.606
  750    HE1  TRP 101           HE1      TRP 101  18.580  -5.596 -16.404
  751    HE3  TRP 101           HE3      TRP 101  17.416  -2.969 -20.932
  752    HZ2  TRP 101           HZ2      TRP 101  15.727  -5.024 -16.721
  753    HZ3  TRP 101           HZ3      TRP 101  14.972  -3.105 -20.507
  754    HH2  TRP 101           HH2      TRP 101  14.131  -4.085 -18.383
  755    H    GLY 102           H        GLY 102  24.331  -4.485 -21.024
  756   1HA   GLY 102          HA1       GLY 102  24.664  -2.153 -22.600
  757   2HA   GLY 102          HA2       GLY 102  25.713  -3.578 -22.582
  758    H    PHE 103           H        PHE 103  24.172  -1.706 -24.638
  759    HA   PHE 103           HA       PHE 103  24.363  -3.596 -26.765
  760   1HB   PHE 103          HB2       PHE 103  22.008  -2.780 -27.660
  761   2HB   PHE 103          HB3       PHE 103  22.170  -4.207 -26.666
  762    HD1  PHE 103           HD1      PHE 103  20.470  -4.516 -25.122
  763    HD2  PHE 103           HD2      PHE 103  21.747  -0.492 -26.025
  764    HE1  PHE 103           HE1      PHE 103  18.881  -3.634 -23.439
  765    HE2  PHE 103           HE2      PHE 103  20.195   0.368 -24.306
  766    HZ   PHE 103           HZ       PHE 103  18.789  -1.188 -22.980
  767    H    ASP 104           H        ASP 104  24.231  -2.322 -28.840
  768    HA   ASP 104           HA       ASP 104  25.737   0.046 -28.483
  769   1HB   ASP 104          HB2       ASP 104  26.052  -1.503 -30.390
  770   2HB   ASP 104          HB3       ASP 104  24.474  -1.013 -31.022
  771    H    ASP 105           H        ASP 105  25.290   2.138 -28.906
  772    HA   ASP 105           HA       ASP 105  22.603   3.039 -28.279
  773   1HB   ASP 105          HB2       ASP 105  24.765   4.287 -27.724
  774   2HB   ASP 105          HB3       ASP 105  24.840   4.747 -29.411
  775    HA   PRO 106           HA       PRO 106  21.435   2.633 -32.542
  776   1HB   PRO 106          HB2       PRO 106  19.016   3.916 -32.598
  777   2HB   PRO 106          HB3       PRO 106  19.276   2.303 -31.871
  778   1HG   PRO 106          HG2       PRO 106  19.189   4.966 -30.446
  779   2HG   PRO 106          HG3       PRO 106  18.356   3.440 -29.999
  780   1HD   PRO 106          HD2       PRO 106  20.714   4.199 -28.863
  781   2HD   PRO 106          HD3       PRO 106  20.384   2.480 -29.231
  782    H    ALA 107           H        ALA 107  21.812   5.833 -31.075
  783    HA   ALA 107           HA       ALA 107  21.797   7.178 -33.655
  784   1HB   ALA 107          HB1       ALA 107  21.132   8.372 -31.617
  785   2HB   ALA 107          HB2       ALA 107  22.774   8.163 -30.949
  786   3HB   ALA 107          HB3       ALA 107  22.522   9.145 -32.404
  787    H    ARG 108           H        ARG 108  23.966   5.064 -32.118
  788    HA   ARG 108           HA       ARG 108  26.332   6.256 -33.505
  789   1HB   ARG 108          HB2       ARG 108  26.288   4.388 -31.097
  790   2HB   ARG 108          HB3       ARG 108  27.723   5.048 -31.882
  791   1HG   ARG 108          HG2       ARG 108  27.011   7.347 -31.335
  792   2HG   ARG 108          HG3       ARG 108  25.563   6.730 -30.535
  793   1HD   ARG 108          HD2       ARG 108  26.964   5.576 -28.848
  794   2HD   ARG 108          HD3       ARG 108  28.424   6.211 -29.630
  795    HE   ARG 108           HE       ARG 108  27.092   8.492 -29.240
  796   1HH1  ARG 108          HH21      ARG 108  27.781   5.876 -26.868
  797   2HH1  ARG 108          HH22      ARG 108  27.540   6.924 -25.519
  798   1HH2  ARG 108          HH12      ARG 108  26.904   9.838 -27.374
  799   2HH2  ARG 108          HH11      ARG 108  27.140   9.149 -25.794
  800    H    ALA 109           H        ALA 109  23.984   4.009 -33.981
  801    HA   ALA 109           HA       ALA 109  25.434   1.834 -35.140
  802   1HB   ALA 109          HB1       ALA 109  22.571   2.806 -35.556
  803   2HB   ALA 109          HB2       ALA 109  23.218   1.230 -36.039
  804   3HB   ALA 109          HB3       ALA 109  23.113   1.653 -34.315
  805    H    GLN 110           H        GLN 110  26.968   3.494 -36.160
  806    HA   GLN 110           HA       GLN 110  26.226   5.329 -38.133
  807   1HB   GLN 110          HB2       GLN 110  28.823   3.858 -37.544
  808   2HB   GLN 110          HB3       GLN 110  28.719   5.164 -38.724
  809   1HG   GLN 110          HG2       GLN 110  28.427   6.814 -37.135
  810   2HG   GLN 110          HG3       GLN 110  27.624   5.763 -35.984
  811   1HE2  GLN 110          HE22      GLN 110  28.868   4.425 -34.546
  812   2HE2  GLN 110          HE21      GLN 110  30.584   4.706 -34.314
  813    H    GLY 111           H        GLY 111  26.036   5.297 -40.256
  814   1HA   GLY 111          HA1       GLY 111  27.044   3.631 -42.195
  815   2HA   GLY 111          HA2       GLY 111  25.499   2.875 -41.739
  816    H    THR 112           H        THR 112  23.705   4.689 -41.326
  817    HA   THR 112           HA       THR 112  23.861   7.181 -42.596
  818    HB   THR 112           HB       THR 112  23.691   6.013 -44.719
  819    HG1  THR 112           HG1      THR 112  21.990   7.060 -45.514
  820   1HG2  THR 112          HG21      THR 112  21.721   4.612 -45.311
  821   2HG2  THR 112          HG22      THR 112  22.766   3.862 -44.103
  822   3HG2  THR 112          HG23      THR 112  21.234   4.610 -43.604
  823    H    GLU 113           H        GLU 113  21.550   8.176 -42.542
  824    HA   GLU 113           HA       GLU 113  20.627   7.909 -39.853
  825   1HB   GLU 113          HB2       GLU 113  18.910   9.514 -40.473
  826   2HB   GLU 113          HB3       GLU 113  20.493  10.012 -41.068
  827   1HG   GLU 113          HG2       GLU 113  19.880   9.163 -43.347
  828   2HG   GLU 113          HG3       GLU 113  18.281   8.731 -42.738
  829    H    GLU 114           H        GLU 114  19.626   6.375 -42.877
  830    HA   GLU 114           HA       GLU 114  17.162   5.334 -41.870
  831   1HB   GLU 114          HB2       GLU 114  17.741   5.590 -44.278
  832   2HB   GLU 114          HB3       GLU 114  18.916   4.276 -44.126
  833   1HG   GLU 114          HG2       GLU 114  17.114   2.702 -43.533
  834   2HG   GLU 114          HG3       GLU 114  15.934   4.015 -43.534
  835    H    GLU 115           H        GLU 115  20.529   4.172 -41.791
  836    HA   GLU 115           HA       GLU 115  19.858   1.548 -40.763
  837   1HB   GLU 115          HB2       GLU 115  22.458   3.128 -40.872
  838   2HB   GLU 115          HB3       GLU 115  22.343   1.539 -40.130
  839   1HG   GLU 115          HG2       GLU 115  21.581   2.098 -43.026
  840   2HG   GLU 115          HG3       GLU 115  23.176   1.568 -42.510
  841    H    LYS 116           H        LYS 116  20.944   4.681 -39.374
  842    HA   LYS 116           HA       LYS 116  20.915   3.891 -36.654
  843   1HB   LYS 116          HB2       LYS 116  20.410   6.577 -37.996
  844   2HB   LYS 116          HB3       LYS 116  20.463   6.360 -36.236
  845   1HG   LYS 116          HG2       LYS 116  22.769   5.402 -36.461
  846   2HG   LYS 116          HG3       LYS 116  22.723   5.765 -38.196
  847   1HD   LYS 116          HD2       LYS 116  22.365   8.191 -37.630
  848   2HD   LYS 116          HD3       LYS 116  22.493   7.768 -35.911
  849   1HE   LYS 116          HE2       LYS 116  24.785   6.723 -36.523
  850   2HE   LYS 116          HE3       LYS 116  24.633   7.571 -38.071
  851   1HZ   LYS 116          HZ1       LYS 116  24.726   8.774 -35.368
  852   2HZ   LYS 116          HZ2       LYS 116  25.867   8.918 -36.528
  853   3HZ   LYS 116          HZ3       LYS 116  24.426   9.654 -36.731
  854    H    TRP 117           H        TRP 117  18.220   5.240 -38.660
  855    HA   TRP 117           HA       TRP 117  16.282   5.163 -36.610
  856   1HB   TRP 117          HB2       TRP 117  15.911   6.432 -38.602
  857   2HB   TRP 117          HB3       TRP 117  16.109   5.016 -39.628
  858    HD1  TRP 117           HD1      TRP 117  13.955   4.236 -40.608
  859    HE1  TRP 117           HE1      TRP 117  11.527   3.999 -39.896
  860    HE3  TRP 117           HE3      TRP 117  14.299   6.271 -35.908
  861    HZ2  TRP 117           HZ2      TRP 117   9.917   4.557 -37.538
  862    HZ3  TRP 117           HZ3      TRP 117  12.329   6.320 -34.434
  863    HH2  TRP 117           HH2      TRP 117  10.147   5.410 -35.209
  864    H    ALA 118           H        ALA 118  17.307   2.556 -38.896
  865    HA   ALA 118           HA       ALA 118  15.243   0.760 -38.037
  866   1HB   ALA 118          HB1       ALA 118  16.391   0.492 -40.172
  867   2HB   ALA 118          HB2       ALA 118  17.933   0.179 -39.332
  868   3HB   ALA 118          HB3       ALA 118  16.575  -0.960 -39.167
  869    H    PHE 119           H        PHE 119  18.611   1.319 -36.983
  870    HA   PHE 119           HA       PHE 119  18.591  -0.753 -35.039
  871   1HB   PHE 119          HB2       PHE 119  20.552   0.760 -36.065
  872   2HB   PHE 119          HB3       PHE 119  20.293   1.671 -34.587
  873    HD1  PHE 119           HD1      PHE 119  21.478  -1.463 -36.104
  874    HD2  PHE 119           HD2      PHE 119  20.683   0.510 -32.352
  875    HE1  PHE 119           HE1      PHE 119  22.806  -3.185 -34.910
  876    HE2  PHE 119           HE2      PHE 119  22.009  -1.208 -31.167
  877    HZ   PHE 119           HZ       PHE 119  23.075  -3.062 -32.438
  878    H    PHE 120           H        PHE 120  17.504   2.628 -34.912
  879    HA   PHE 120           HA       PHE 120  16.946   2.779 -32.132
  880   1HB   PHE 120          HB2       PHE 120  16.016   4.212 -34.577
  881   2HB   PHE 120          HB3       PHE 120  14.856   4.178 -33.272
  882    HD1  PHE 120           HD1      PHE 120  17.833   5.802 -34.515
  883    HD2  PHE 120           HD2      PHE 120  15.588   4.925 -30.943
  884    HE1  PHE 120           HE1      PHE 120  18.989   7.648 -33.334
  885    HE2  PHE 120           HE2      PHE 120  16.767   6.744 -29.759
  886    HZ   PHE 120           HZ       PHE 120  18.441   8.146 -30.966
  887    H    GLN 121           H        GLN 121  14.792   1.611 -34.779
  888    HA   GLN 121           HA       GLN 121  12.757   0.645 -33.067
  889   1HB   GLN 121          HB2       GLN 121  13.664   0.107 -35.873
  890   2HB   GLN 121          HB3       GLN 121  12.801  -1.227 -35.118
  891   1HG   GLN 121          HG2       GLN 121  11.381   0.375 -36.441
  892   2HG   GLN 121          HG3       GLN 121  10.844   0.012 -34.804
  893   1HE2  GLN 121          HE22      GLN 121  13.182   2.423 -36.287
  894   2HE2  GLN 121          HE21      GLN 121  12.390   3.795 -35.566
  895    H    ARG 122           H        ARG 122  15.749  -1.091 -34.140
  896    HA   ARG 122           HA       ARG 122  15.054  -3.516 -32.834
  897   1HB   ARG 122          HB2       ARG 122  17.819  -2.333 -33.383
  898   2HB   ARG 122          HB3       ARG 122  17.536  -3.973 -32.803
  899   1HG   ARG 122          HG2       ARG 122  16.254  -4.525 -34.827
  900   2HG   ARG 122          HG3       ARG 122  16.464  -2.880 -35.442
  901   1HD   ARG 122          HD2       ARG 122  18.925  -3.183 -35.448
  902   2HD   ARG 122          HD3       ARG 122  18.736  -4.830 -34.851
  903    HE   ARG 122           HE       ARG 122  18.237  -3.800 -37.552
  904   1HH1  ARG 122          HH21      ARG 122  17.748  -6.563 -35.369
  905   2HH1  ARG 122          HH22      ARG 122  17.458  -7.692 -36.638
  906   1HH2  ARG 122          HH11      ARG 122  17.850  -5.307 -39.239
  907   2HH2  ARG 122          HH12      ARG 122  17.520  -6.960 -38.883
  908    H    VAL 123           H        VAL 123  16.948  -0.721 -31.529
  909    HA   VAL 123           HA       VAL 123  17.300  -2.060 -28.987
  910    HB   VAL 123           HB       VAL 123  17.680   0.828 -29.904
  911   1HG1  VAL 123          HG11      VAL 123  19.117   1.099 -27.872
  912   2HG1  VAL 123          HG12      VAL 123  17.407   0.899 -27.486
  913   3HG1  VAL 123          HG13      VAL 123  18.529  -0.465 -27.274
  914   1HG2  VAL 123          HG21      VAL 123  19.715  -1.382 -29.327
  915   2HG2  VAL 123          HG22      VAL 123  19.192  -0.889 -30.948
  916   3HG2  VAL 123          HG23      VAL 123  20.064   0.252 -29.923
  917    H    ARG 124           H        ARG 124  14.892   0.264 -30.279
  918    HA   ARG 124           HA       ARG 124  13.557   0.918 -27.868
  919   1HB   ARG 124          HB2       ARG 124  13.158   2.048 -30.037
  920   2HB   ARG 124          HB3       ARG 124  12.591   0.549 -30.742
  921   1HG   ARG 124          HG2       ARG 124  10.822   0.851 -28.637
  922   2HG   ARG 124          HG3       ARG 124  11.178   2.522 -29.053
  923   1HD   ARG 124          HD2       ARG 124   9.284   1.896 -30.346
  924   2HD   ARG 124          HD3       ARG 124  10.648   1.927 -31.474
  925    HE   ARG 124           HE       ARG 124  10.106  -0.706 -30.319
  926   1HH1  ARG 124          HH21      ARG 124   9.389   1.456 -33.050
  927   2HH1  ARG 124          HH22      ARG 124   8.373   0.312 -33.851
  928   1HH2  ARG 124          HH11      ARG 124   8.855  -2.304 -31.491
  929   2HH2  ARG 124          HH12      ARG 124   8.195  -1.874 -33.021
  930    H    ASP 125           H        ASP 125  12.885  -1.668 -30.285
  931    HA   ASP 125           HA       ASP 125  10.676  -2.637 -28.810
  932   1HB   ASP 125          HB2       ASP 125  11.258  -2.888 -31.323
  933   2HB   ASP 125          HB3       ASP 125  12.224  -4.287 -30.842
  934    H    GLU 126           H        GLU 126  14.110  -3.706 -28.964
  935    HA   GLU 126           HA       GLU 126  13.763  -6.051 -27.411
  936   1HB   GLU 126          HB2       GLU 126  15.664  -5.621 -28.874
  937   2HB   GLU 126          HB3       GLU 126  16.235  -4.326 -27.802
  938   1HG   GLU 126          HG2       GLU 126  16.626  -5.929 -26.000
  939   2HG   GLU 126          HG3       GLU 126  15.837  -7.218 -26.914
  940    H    ILE 127           H        ILE 127  14.578  -2.664 -26.470
  941    HA   ILE 127           HA       ILE 127  14.877  -3.171 -23.676
  942    HB   ILE 127           HB       ILE 127  14.139  -0.727 -25.321
  943   1HG1  ILE 127          HG12      ILE 127  16.561  -1.412 -23.587
  944   2HG1  ILE 127          HG13      ILE 127  16.502  -1.654 -25.326
  945   1HG2  ILE 127          HG21      ILE 127  14.537  -0.741 -22.298
  946   2HG2  ILE 127          HG22      ILE 127  14.325   0.675 -23.362
  947   3HG2  ILE 127          HG23      ILE 127  12.993  -0.440 -23.131
  948   1HD1  ILE 127          HD11      ILE 127  16.032   0.859 -25.551
  949   2HD1  ILE 127          HD12      ILE 127  16.501   0.990 -23.838
  950   3HD1  ILE 127          HD13      ILE 127  17.653   0.371 -25.021
  951    H    GLY 128           H        GLY 128  11.989  -2.126 -25.602
  952   1HA   GLY 128          HA1       GLY 128  10.082  -2.125 -23.600
  953   2HA   GLY 128          HA2       GLY 128   9.772  -2.620 -25.278
  954    H    ASN 129           H        ASN 129  11.169  -4.990 -25.507
  955    HA   ASN 129           HA       ASN 129   9.435  -6.832 -24.233
  956   1HB   ASN 129          HB2       ASN 129  12.043  -7.160 -25.753
  957   2HB   ASN 129          HB3       ASN 129  11.337  -8.528 -24.909
  958   1HD2  ASN 129          HD22      ASN 129  10.752  -6.196 -27.547
  959   2HD2  ASN 129          HD21      ASN 129   9.556  -7.175 -28.353
  960    H    ARG 130           H        ARG 130  12.832  -5.964 -23.374
  961    HA   ARG 130           HA       ARG 130  12.791  -7.932 -21.234
  962   1HB   ARG 130          HB2       ARG 130  14.913  -7.276 -22.260
  963   2HB   ARG 130          HB3       ARG 130  14.673  -5.602 -21.748
  964   1HG   ARG 130          HG2       ARG 130  16.249  -6.631 -20.265
  965   2HG   ARG 130          HG3       ARG 130  14.765  -6.311 -19.386
  966   1HD   ARG 130          HD2       ARG 130  14.123  -8.731 -19.646
  967   2HD   ARG 130          HD3       ARG 130  15.760  -9.029 -20.254
  968    HE   ARG 130           HE       ARG 130  14.886  -8.592 -17.516
  969   1HH1  ARG 130          HH21      ARG 130  17.765  -8.013 -19.563
  970   2HH1  ARG 130          HH22      ARG 130  18.790  -7.733 -18.201
  971   1HH2  ARG 130          HH11      ARG 130  16.253  -8.418 -15.813
  972   2HH2  ARG 130          HH12      ARG 130  17.893  -7.826 -16.006
  973    H    LEU 131           H        LEU 131  11.926  -4.456 -21.431
  974    HA   LEU 131           HA       LEU 131  11.767  -4.097 -18.590
  975   1HB   LEU 131          HB2       LEU 131  11.624  -2.380 -20.723
  976   2HB   LEU 131          HB3       LEU 131   9.934  -2.491 -20.280
  977    HG   LEU 131           HG       LEU 131  10.968  -0.637 -19.190
  978   1HD1  LEU 131          HD11      LEU 131  10.523  -1.056 -16.802
  979   2HD1  LEU 131          HD12      LEU 131   9.279  -1.821 -17.819
  980   3HD1  LEU 131          HD13      LEU 131  10.555  -2.792 -17.083
  981   1HD2  LEU 131          HD21      LEU 131  13.321  -1.579 -19.232
  982   2HD2  LEU 131          HD22      LEU 131  12.858  -0.640 -17.819
  983   3HD2  LEU 131          HD23      LEU 131  12.914  -2.394 -17.695
  984    H    LYS 132           H        LYS 132   9.422  -5.183 -21.095
  985    HA   LYS 132           HA       LYS 132   7.172  -5.431 -19.416
  986   1HB   LYS 132          HB2       LYS 132   7.118  -5.730 -21.874
  987   2HB   LYS 132          HB3       LYS 132   8.008  -7.241 -21.723
  988   1HG   LYS 132          HG2       LYS 132   6.191  -8.270 -20.460
  989   2HG   LYS 132          HG3       LYS 132   5.288  -6.737 -20.453
  990   1HD   LYS 132          HD2       LYS 132   5.171  -6.776 -22.917
  991   2HD   LYS 132          HD3       LYS 132   6.079  -8.287 -22.972
  992   1HE   LYS 132          HE2       LYS 132   3.388  -7.949 -21.560
  993   2HE   LYS 132          HE3       LYS 132   3.561  -8.471 -23.237
  994   1HZ   LYS 132          HZ1       LYS 132   4.869 -10.376 -22.413
  995   2HZ   LYS 132          HZ2       LYS 132   4.537  -9.954 -20.853
  996   3HZ   LYS 132          HZ3       LYS 132   3.338 -10.373 -21.865
  997    H    GLU 133           H        GLU 133   9.732  -7.846 -20.118
  998    HA   GLU 133           HA       GLU 133   8.666  -9.711 -18.270
  999   1HB   GLU 133          HB2       GLU 133  11.531  -9.530 -19.270
 1000   2HB   GLU 133          HB3       GLU 133  10.793 -10.879 -18.383
 1001   1HG   GLU 133          HG2       GLU 133   9.049 -11.031 -20.204
 1002   2HG   GLU 133          HG3       GLU 133   9.999  -9.871 -21.133
 1003    H    PHE 134           H        PHE 134  11.066  -7.124 -17.776
 1004    HA   PHE 134           HA       PHE 134  11.777  -7.871 -15.149
 1005   1HB   PHE 134          HB2       PHE 134  13.081  -6.248 -16.365
 1006   2HB   PHE 134          HB3       PHE 134  11.685  -5.202 -16.578
 1007    HD1  PHE 134           HD1      PHE 134  13.688  -6.740 -13.762
 1008    HD2  PHE 134           HD2      PHE 134  11.477  -3.335 -15.208
 1009    HE1  PHE 134           HE1      PHE 134  14.206  -5.498 -11.672
 1010    HE2  PHE 134           HE2      PHE 134  11.999  -2.094 -13.147
 1011    HZ   PHE 134           HZ       PHE 134  13.355  -3.181 -11.351
 1012    H    ALA 135           H        ALA 135   8.974  -6.079 -16.364
 1013    HA   ALA 135           HA       ALA 135   8.094  -5.321 -13.703
 1014   1HB   ALA 135          HB1       ALA 135   6.639  -5.237 -16.389
 1015   2HB   ALA 135          HB2       ALA 135   6.166  -4.375 -14.909
 1016   3HB   ALA 135          HB3       ALA 135   7.668  -3.937 -15.756
 1017    H    GLU 136           H        GLU 136   7.290  -7.785 -16.109
 1018    HA   GLU 136           HA       GLU 136   4.924  -8.676 -14.694
 1019   1HB   GLU 136          HB2       GLU 136   4.911  -8.477 -17.099
 1020   2HB   GLU 136          HB3       GLU 136   6.324  -9.536 -17.250
 1021   1HG   GLU 136          HG2       GLU 136   5.075 -11.464 -16.515
 1022   2HG   GLU 136          HG3       GLU 136   3.680 -10.461 -16.088
 1023    H    THR 137           H        THR 137   8.155  -9.955 -15.391
 1024    HA   THR 137           HA       THR 137   7.505 -12.440 -13.910
 1025    HB   THR 137           HB       THR 137   9.000 -13.619 -15.303
 1026    HG1  THR 137           HG1      THR 137   9.761 -11.066 -16.234
 1027   1HG2  THR 137          HG21      THR 137   7.456 -11.773 -17.163
 1028   2HG2  THR 137          HG22      THR 137   8.038 -13.411 -17.501
 1029   3HG2  THR 137          HG23      THR 137   6.755 -13.170 -16.299
 1030    H    GLY 138           H        GLY 138   9.586  -9.633 -13.955
 1031   1HA   GLY 138          HA1       GLY 138  10.953  -8.888 -12.234
 1032   2HA   GLY 138          HA2       GLY 138  10.882 -10.469 -11.455
 1033    H    LYS 139           H        LYS 139  11.674 -10.544 -14.878
 1034    HA   LYS 139           HA       LYS 139  14.266 -11.675 -14.311
 1035   1HB   LYS 139          HB2       LYS 139  12.801 -10.924 -16.862
 1036   2HB   LYS 139          HB3       LYS 139  14.447 -11.576 -16.866
 1037   1HG   LYS 139          HG2       LYS 139  13.716 -13.652 -15.811
 1038   2HG   LYS 139          HG3       LYS 139  12.085 -13.015 -15.588
 1039   1HD   LYS 139          HD2       LYS 139  12.075 -12.679 -18.170
 1040   2HD   LYS 139          HD3       LYS 139  13.486 -13.752 -18.183
 1041   1HE   LYS 139          HE2       LYS 139  12.090 -15.489 -17.014
 1042   2HE   LYS 139          HE3       LYS 139  10.724 -14.357 -17.041
 1043   1HZ   LYS 139          HZ1       LYS 139  10.516 -15.837 -18.884
 1044   2HZ   LYS 139          HZ2       LYS 139  10.916 -14.363 -19.502
 1045   3HZ   LYS 139          HZ3       LYS 139  12.037 -15.555 -19.404
  Start of MODEL   20
    1   1H    MET   1           H1       MET   1   9.380   6.410   2.816
    2   2H    MET   1           H2       MET   1   8.611   4.970   2.940
    3   3H    MET   1           H3       MET   1  10.152   5.023   2.401
    4    HA   MET   1           HA       MET   1   7.815   6.149   1.027
    5   1HB   MET   1          HB2       MET   1   9.844   7.478   0.633
    6   2HB   MET   1          HB3       MET   1  10.724   6.038   0.110
    7   1HG   MET   1          HG2       MET   1   9.222   5.787  -1.810
    8   2HG   MET   1          HG3       MET   1   8.231   7.141  -1.253
    9   1HE   MET   1          HE1       MET   1   9.598   6.698  -4.205
   10   2HE   MET   1          HE2       MET   1   8.481   8.031  -3.815
   11   3HE   MET   1          HE3       MET   1  10.054   8.376  -4.567
   12    H    GLU   2           H        GLU   2   6.533   4.391   0.611
   13    HA   GLU   2           HA       GLU   2   7.648   1.747   0.217
   14   1HB   GLU   2          HB2       GLU   2   5.498   2.252   1.364
   15   2HB   GLU   2          HB3       GLU   2   4.814   2.798  -0.172
   16   1HG   GLU   2          HG2       GLU   2   5.062   0.536  -1.116
   17   2HG   GLU   2          HG3       GLU   2   5.905  -0.006   0.338
   18    H    ASN   3           H        ASN   3   6.689   4.386  -1.928
   19    HA   ASN   3           HA       ASN   3   6.295   2.890  -4.321
   20   1HB   ASN   3          HB2       ASN   3   5.712   5.391  -3.653
   21   2HB   ASN   3          HB3       ASN   3   7.348   5.738  -4.223
   22   1HD2  ASN   3          HD22      ASN   3   7.835   5.119  -6.554
   23   2HD2  ASN   3          HD21      ASN   3   6.450   5.197  -7.660
   24    H    LYS   4           H        LYS   4   7.819   2.186  -5.797
   25    HA   LYS   4           HA       LYS   4  10.657   2.133  -4.999
   26   1HB   LYS   4          HB2       LYS   4   8.963   0.941  -7.223
   27   2HB   LYS   4          HB3       LYS   4  10.683   1.106  -7.490
   28   1HG   LYS   4          HG2       LYS   4  10.100  -1.115  -6.749
   29   2HG   LYS   4          HG3       LYS   4  11.236  -0.340  -5.665
   30   1HD   LYS   4          HD2       LYS   4   8.284  -0.263  -5.009
   31   2HD   LYS   4          HD3       LYS   4   9.154  -1.769  -4.789
   32   1HE   LYS   4          HE2       LYS   4  10.035   0.856  -3.510
   33   2HE   LYS   4          HE3       LYS   4   8.955  -0.301  -2.744
   34   1HZ   LYS   4          HZ1       LYS   4  11.201  -0.665  -2.024
   35   2HZ   LYS   4          HZ2       LYS   4  10.708  -1.965  -2.864
   36   3HZ   LYS   4          HZ3       LYS   4  11.767  -0.906  -3.534
   37    H    ILE   5           H        ILE   5  12.242   2.629  -6.771
   38    HA   ILE   5           HA       ILE   5  11.687   5.026  -8.347
   39    HB   ILE   5           HB       ILE   5  14.002   4.807  -6.380
   40   1HG1  ILE   5          HG12      ILE   5  12.845   7.070  -5.495
   41   2HG1  ILE   5          HG13      ILE   5  11.393   6.212  -5.985
   42   1HG2  ILE   5          HG21      ILE   5  14.518   7.146  -7.039
   43   2HG2  ILE   5          HG22      ILE   5  14.594   6.055  -8.418
   44   3HG2  ILE   5          HG23      ILE   5  13.175   7.093  -8.201
   45   1HD1  ILE   5          HD11      ILE   5  11.941   5.799  -3.617
   46   2HD1  ILE   5          HD12      ILE   5  12.136   4.280  -4.508
   47   3HD1  ILE   5          HD13      ILE   5  13.556   5.232  -4.069
   48    H    ILE   6           H        ILE   6  13.081   4.876 -10.253
   49    HA   ILE   6           HA       ILE   6  15.128   2.749 -10.249
   50    HB   ILE   6           HB       ILE   6  13.097   1.579 -10.911
   51   1HG1  ILE   6          HG12      ILE   6  14.915   1.936 -13.330
   52   2HG1  ILE   6          HG13      ILE   6  15.347   1.018 -11.884
   53   1HG2  ILE   6          HG21      ILE   6  12.905   3.492 -13.277
   54   2HG2  ILE   6          HG22      ILE   6  11.856   2.099 -12.964
   55   3HG2  ILE   6          HG23      ILE   6  11.805   3.474 -11.872
   56   1HD1  ILE   6          HD11      ILE   6  14.576  -0.504 -13.587
   57   2HD1  ILE   6          HD12      ILE   6  13.393  -0.474 -12.262
   58   3HD1  ILE   6          HD13      ILE   6  13.062   0.386 -13.786
   59    H    TYR   7           H        TYR   7  16.741   3.051 -11.844
   60    HA   TYR   7           HA       TYR   7  16.635   5.656 -13.252
   61   1HB   TYR   7          HB2       TYR   7  17.848   5.489 -10.928
   62   2HB   TYR   7          HB3       TYR   7  19.069   4.589 -11.794
   63    HD1  TYR   7           HD1      TYR   7  17.524   7.482 -13.574
   64    HD2  TYR   7           HD2      TYR   7  20.608   6.245 -10.822
   65    HE1  TYR   7           HE1      TYR   7  18.480   9.738 -13.649
   66    HE2  TYR   7           HE2      TYR   7  21.579   8.528 -10.911
   67    HH   TYR   7           HH       TYR   7  20.044  11.193 -12.726
   68    H    PHE   8           H        PHE   8  17.436   5.558 -15.301
   69    HA   PHE   8           HA       PHE   8  18.849   3.070 -16.205
   70   1HB   PHE   8          HB2       PHE   8  17.023   4.916 -17.800
   71   2HB   PHE   8          HB3       PHE   8  17.876   3.520 -18.428
   72    HD1  PHE   8           HD1      PHE   8  17.251   1.180 -17.584
   73    HD2  PHE   8           HD2      PHE   8  14.884   4.686 -16.756
   74    HE1  PHE   8           HE1      PHE   8  15.349  -0.265 -16.951
   75    HE2  PHE   8           HE2      PHE   8  12.972   3.225 -16.172
   76    HZ   PHE   8           HZ       PHE   8  13.216   0.756 -16.194
   77    H    LEU   9           H        LEU   9  20.870   3.415 -17.037
   78    HA   LEU   9           HA       LEU   9  21.733   6.243 -17.428
   79   1HB   LEU   9          HB2       LEU   9  23.230   3.890 -16.217
   80   2HB   LEU   9          HB3       LEU   9  23.893   5.496 -16.502
   81    HG   LEU   9           HG       LEU   9  21.684   4.781 -14.533
   82   1HD1  LEU   9          HD11      LEU   9  23.331   5.490 -12.863
   83   2HD1  LEU   9          HD12      LEU   9  23.984   4.180 -13.864
   84   3HD1  LEU   9          HD13      LEU   9  24.511   5.855 -14.136
   85   1HD2  LEU   9          HD21      LEU   9  21.100   6.968 -15.329
   86   2HD2  LEU   9          HD22      LEU   9  21.951   7.208 -13.813
   87   3HD2  LEU   9          HD23      LEU   9  22.795   7.487 -15.355
   88    H    CYS  10           H        CYS  10  22.982   6.733 -19.131
   89    HA   CYS  10           HA       CYS  10  23.936   4.571 -20.959
   90   1HB   CYS  10          HB2       CYS  10  21.690   5.434 -21.656
   91   2HB   CYS  10          HB3       CYS  10  22.359   7.077 -21.695
   92    HG   CYS  10           HG       CYS  10  22.348   6.781 -24.053
   93    H    THR  11           H        THR  11  25.424   5.592 -22.675
   94    HA   THR  11           HA       THR  11  27.525   7.139 -21.537
   95    HB   THR  11           HB       THR  11  28.251   7.238 -23.978
   96    HG1  THR  11           HG1      THR  11  26.092   7.058 -24.858
   97   1HG2  THR  11          HG21      THR  11  27.483   4.450 -22.995
   98   2HG2  THR  11          HG22      THR  11  28.804   4.878 -24.099
   99   3HG2  THR  11          HG23      THR  11  28.864   5.380 -22.390
  100    H    GLY  12           H        GLY  12  24.482   8.038 -23.087
  101   1HA   GLY  12          HA1       GLY  12  24.840  10.739 -22.152
  102   2HA   GLY  12          HA2       GLY  12  24.682  10.623 -23.919
  103    H    ASN  13           H        ASN  13  22.791  11.534 -21.649
  104    HA   ASN  13           HA       ASN  13  20.675   9.555 -21.566
  105   1HB   ASN  13          HB2       ASN  13  21.227  11.148 -19.687
  106   2HB   ASN  13          HB3       ASN  13  20.616  12.461 -20.684
  107   1HD2  ASN  13          HD22      ASN  13  19.153   9.082 -20.268
  108   2HD2  ASN  13          HD21      ASN  13  17.678   9.721 -19.580
  109    H    SER  14           H        SER  14  20.977   9.845 -24.172
  110    HA   SER  14           HA       SER  14  18.854  11.754 -25.060
  111   1HB   SER  14          HB2       SER  14  21.373  10.998 -26.559
  112   2HB   SER  14          HB3       SER  14  20.205  12.265 -26.975
  113    HG   SER  14           HG       SER  14  22.116  13.047 -25.917
  114    H    CYS  15           H        CYS  15  19.831   8.440 -25.043
  115    HA   CYS  15           HA       CYS  15  17.939   7.819 -27.263
  116   1HB   CYS  15          HB2       CYS  15  20.798   6.774 -27.027
  117   2HB   CYS  15          HB3       CYS  15  19.606   6.279 -28.238
  118    HG   CYS  15           HG       CYS  15  21.523   7.772 -29.178
  119    H    ARG  16           H        ARG  16  20.150   5.493 -25.790
  120    HA   ARG  16           HA       ARG  16  18.138   3.601 -25.426
  121   1HB   ARG  16          HB2       ARG  16  20.846   3.922 -24.058
  122   2HB   ARG  16          HB3       ARG  16  19.839   2.500 -23.849
  123   1HG   ARG  16          HG2       ARG  16  19.944   1.904 -26.153
  124   2HG   ARG  16          HG3       ARG  16  20.757   3.410 -26.591
  125   1HD   ARG  16          HD2       ARG  16  21.943   1.344 -24.680
  126   2HD   ARG  16          HD3       ARG  16  22.272   1.389 -26.417
  127    HE   ARG  16           HE       ARG  16  22.784   3.980 -25.494
  128   1HH1  ARG  16          HH21      ARG  16  24.242   0.708 -25.292
  129   2HH1  ARG  16          HH22      ARG  16  25.843   1.425 -25.095
  130   1HH2  ARG  16          HH11      ARG  16  24.936   4.713 -24.968
  131   2HH2  ARG  16          HH12      ARG  16  26.214   3.544 -24.841
  132    H    SER  17           H        SER  17  19.535   5.719 -22.833
  133    HA   SER  17           HA       SER  17  17.935   4.456 -20.814
  134   1HB   SER  17          HB2       SER  17  18.783   6.395 -19.436
  135   2HB   SER  17          HB3       SER  17  20.001   5.403 -20.211
  136    HG   SER  17           HG       SER  17  20.608   7.446 -20.654
  137    H    GLN  18           H        GLN  18  17.451   7.344 -22.820
  138    HA   GLN  18           HA       GLN  18  15.125   8.369 -21.530
  139   1HB   GLN  18          HB2       GLN  18  16.328   8.550 -24.313
  140   2HB   GLN  18          HB3       GLN  18  14.743   9.222 -24.015
  141   1HG   GLN  18          HG2       GLN  18  17.173   9.951 -22.327
  142   2HG   GLN  18          HG3       GLN  18  16.746  10.812 -23.803
  143   1HE2  GLN  18          HE22      GLN  18  16.734  11.789 -20.863
  144   2HE2  GLN  18          HE21      GLN  18  15.085  12.400 -20.700
  145    H    MET  19           H        MET  19  15.415   6.229 -24.388
  146    HA   MET  19           HA       MET  19  12.663   5.681 -24.680
  147   1HB   MET  19          HB2       MET  19  15.035   3.888 -25.370
  148   2HB   MET  19          HB3       MET  19  13.368   3.630 -25.892
  149   1HG   MET  19          HG2       MET  19  13.504   6.045 -26.852
  150   2HG   MET  19          HG3       MET  19  15.249   5.859 -26.702
  151   1HE   MET  19          HE1       MET  19  15.946   2.880 -29.216
  152   2HE   MET  19          HE2       MET  19  16.670   3.993 -28.027
  153   3HE   MET  19          HE3       MET  19  15.594   2.679 -27.488
  154    H    ALA  20           H        ALA  20  15.096   3.890 -22.685
  155    HA   ALA  20           HA       ALA  20  13.312   1.862 -21.812
  156   1HB   ALA  20          HB1       ALA  20  15.762   1.749 -21.547
  157   2HB   ALA  20          HB2       ALA  20  15.707   3.072 -20.356
  158   3HB   ALA  20          HB3       ALA  20  14.935   1.514 -19.993
  159    H    GLU  21           H        GLU  21  14.054   5.037 -20.312
  160    HA   GLU  21           HA       GLU  21  12.348   4.781 -18.104
  161   1HB   GLU  21          HB2       GLU  21  14.069   6.607 -18.725
  162   2HB   GLU  21          HB3       GLU  21  12.749   7.374 -19.611
  163   1HG   GLU  21          HG2       GLU  21  11.483   7.087 -17.286
  164   2HG   GLU  21          HG3       GLU  21  13.116   6.928 -16.656
  165    H    GLY  22           H        GLY  22  11.503   5.568 -21.489
  166   1HA   GLY  22          HA1       GLY  22   8.771   6.367 -20.974
  167   2HA   GLY  22          HA2       GLY  22   9.476   5.820 -22.524
  168    H    TRP  23           H        TRP  23  10.263   3.279 -22.078
  169    HA   TRP  23           HA       TRP  23   7.811   1.793 -22.141
  170   1HB   TRP  23          HB2       TRP  23  10.720   0.970 -21.776
  171   2HB   TRP  23          HB3       TRP  23   9.401  -0.189 -21.816
  172    HD1  TRP  23           HD1      TRP  23  11.678   1.629 -24.095
  173    HE1  TRP  23           HE1      TRP  23  11.074   1.198 -26.522
  174    HE3  TRP  23           HE3      TRP  23   7.064  -0.463 -23.393
  175    HZ2  TRP  23           HZ2      TRP  23   8.832   0.049 -28.016
  176    HZ3  TRP  23           HZ3      TRP  23   5.766  -1.315 -25.321
  177    HH2  TRP  23           HH2      TRP  23   6.660  -1.105 -27.625
  178    H    ALA  24           H        ALA  24  10.213   2.353 -19.558
  179    HA   ALA  24           HA       ALA  24   9.164   0.492 -17.747
  180   1HB   ALA  24          HB1       ALA  24  10.524   1.740 -16.072
  181   2HB   ALA  24          HB2       ALA  24  11.401   1.442 -17.574
  182   3HB   ALA  24          HB3       ALA  24  10.732   3.045 -17.273
  183    H    LYS  25           H        LYS  25   8.301   4.016 -18.070
  184    HA   LYS  25           HA       LYS  25   6.485   4.022 -15.894
  185   1HB   LYS  25          HB2       LYS  25   6.221   5.441 -18.573
  186   2HB   LYS  25          HB3       LYS  25   5.162   5.726 -17.179
  187   1HG   LYS  25          HG2       LYS  25   7.018   6.527 -15.836
  188   2HG   LYS  25          HG3       LYS  25   8.161   6.140 -17.129
  189   1HD   LYS  25          HD2       LYS  25   6.819   7.760 -18.630
  190   2HD   LYS  25          HD3       LYS  25   5.932   8.228 -17.168
  191   1HE   LYS  25          HE2       LYS  25   7.719   9.826 -17.484
  192   2HE   LYS  25          HE3       LYS  25   8.126   8.819 -16.089
  193   1HZ   LYS  25          HZ1       LYS  25   9.285   8.665 -18.815
  194   2HZ   LYS  25          HZ2       LYS  25  10.055   8.973 -17.427
  195   3HZ   LYS  25          HZ3       LYS  25   9.477   7.457 -17.733
  196    H    GLN  26           H        GLN  26   6.029   2.794 -19.192
  197    HA   GLN  26           HA       GLN  26   3.208   2.491 -18.939
  198   1HB   GLN  26          HB2       GLN  26   4.874   0.688 -20.720
  199   2HB   GLN  26          HB3       GLN  26   3.189   1.149 -20.890
  200   1HG   GLN  26          HG2       GLN  26   5.667   2.731 -21.497
  201   2HG   GLN  26          HG3       GLN  26   4.312   2.346 -22.540
  202   1HE2  GLN  26          HE22      GLN  26   5.757   4.870 -20.975
  203   2HE2  GLN  26          HE21      GLN  26   4.367   5.929 -20.780
  204    H    TYR  27           H        TYR  27   5.812   0.070 -18.548
  205    HA   TYR  27           HA       TYR  27   3.878  -1.981 -17.813
  206   1HB   TYR  27          HB2       TYR  27   6.916  -2.026 -17.690
  207   2HB   TYR  27          HB3       TYR  27   5.847  -3.406 -17.495
  208    HD1  TYR  27           HD1      TYR  27   4.095  -3.802 -19.490
  209    HD2  TYR  27           HD2      TYR  27   7.839  -1.698 -19.811
  210    HE1  TYR  27           HE1      TYR  27   4.164  -4.305 -21.915
  211    HE2  TYR  27           HE2      TYR  27   7.994  -2.311 -22.205
  212    HH   TYR  27           HH       TYR  27   6.910  -3.329 -24.009
  213    H    LEU  28           H        LEU  28   6.380  -0.106 -16.019
  214    HA   LEU  28           HA       LEU  28   5.970  -1.557 -13.548
  215   1HB   LEU  28          HB2       LEU  28   7.202   1.196 -14.031
  216   2HB   LEU  28          HB3       LEU  28   7.334   0.264 -12.581
  217    HG   LEU  28           HG       LEU  28   8.518  -0.569 -15.246
  218   1HD1  LEU  28          HD11      LEU  28   9.892   0.373 -12.693
  219   2HD1  LEU  28          HD12      LEU  28  10.649   0.007 -14.258
  220   3HD1  LEU  28          HD13      LEU  28   9.569   1.411 -14.091
  221   1HD2  LEU  28          HD21      LEU  28   7.902  -2.533 -13.831
  222   2HD2  LEU  28          HD22      LEU  28   9.641  -2.342 -14.006
  223   3HD2  LEU  28          HD23      LEU  28   8.845  -1.847 -12.497
  224    H    GLY  29           H        GLY  29   4.726   1.481 -14.866
  225   1HA   GLY  29          HA1       GLY  29   2.836   2.688 -14.265
  226   2HA   GLY  29          HA2       GLY  29   2.646   1.708 -12.795
  227    H    ASP  30           H        ASP  30   2.516   4.286 -12.333
  228    HA   ASP  30           HA       ASP  30   5.003   5.603 -11.766
  229   1HB   ASP  30          HB2       ASP  30   2.867   6.802 -12.143
  230   2HB   ASP  30          HB3       ASP  30   2.205   6.088 -10.668
  231    H    GLU  31           H        GLU  31   3.750   2.849 -10.469
  232    HA   GLU  31           HA       GLU  31   4.136   3.096  -7.640
  233   1HB   GLU  31          HB2       GLU  31   4.282   0.727  -9.534
  234   2HB   GLU  31          HB3       GLU  31   4.415   0.575  -7.784
  235   1HG   GLU  31          HG2       GLU  31   2.028   1.755  -9.247
  236   2HG   GLU  31          HG3       GLU  31   2.159   0.081  -8.703
  237    H    TRP  32           H        TRP  32   6.276   3.268 -10.261
  238    HA   TRP  32           HA       TRP  32   8.653   3.003  -8.540
  239   1HB   TRP  32          HB2       TRP  32   8.451   2.213 -11.474
  240   2HB   TRP  32          HB3       TRP  32   9.880   2.129 -10.462
  241    HD1  TRP  32           HD1      TRP  32   6.306   0.594 -10.386
  242    HE1  TRP  32           HE1      TRP  32   6.457  -1.887  -9.801
  243    HE3  TRP  32           HE3      TRP  32  11.394   0.194  -9.871
  244    HZ2  TRP  32           HZ2      TRP  32   8.507  -3.820  -9.280
  245    HZ3  TRP  32           HZ3      TRP  32  12.421  -2.008  -9.391
  246    HH2  TRP  32           HH2      TRP  32  10.996  -4.029  -9.112
  247    H    LYS  33           H        LYS  33   9.384   5.101  -8.402
  248    HA   LYS  33           HA       LYS  33   8.617   7.188 -10.230
  249   1HB   LYS  33          HB2       LYS  33  10.755   7.056  -8.055
  250   2HB   LYS  33          HB3       LYS  33  10.314   8.518  -8.945
  251   1HG   LYS  33          HG2       LYS  33   8.730   6.991  -6.884
  252   2HG   LYS  33          HG3       LYS  33   9.259   8.658  -6.843
  253   1HD   LYS  33          HD2       LYS  33   7.038   7.524  -8.600
  254   2HD   LYS  33          HD3       LYS  33   6.846   8.507  -7.149
  255   1HE   LYS  33          HE2       LYS  33   8.015  10.402  -8.256
  256   2HE   LYS  33          HE3       LYS  33   8.206   9.432  -9.722
  257   1HZ   LYS  33          HZ1       LYS  33   5.621  10.268  -8.548
  258   2HZ   LYS  33          HZ2       LYS  33   6.294  10.860  -9.909
  259   3HZ   LYS  33          HZ3       LYS  33   5.769   9.308  -9.870
  260    H    VAL  34           H        VAL  34   9.240   6.730 -12.309
  261    HA   VAL  34           HA       VAL  34  11.760   5.508 -12.872
  262    HB   VAL  34           HB       VAL  34   9.997   6.768 -14.983
  263   1HG1  VAL  34          HG11      VAL  34  12.172   5.407 -15.395
  264   2HG1  VAL  34          HG12      VAL  34  11.222   3.995 -14.910
  265   3HG1  VAL  34          HG13      VAL  34  10.712   4.972 -16.306
  266   1HG2  VAL  34          HG21      VAL  34   9.253   4.222 -13.477
  267   2HG2  VAL  34          HG22      VAL  34   8.257   5.683 -13.685
  268   3HG2  VAL  34          HG23      VAL  34   8.619   4.660 -15.071
  269    H    TYR  35           H        TYR  35  13.644   6.472 -13.536
  270    HA   TYR  35           HA       TYR  35  13.666   9.263 -14.555
  271   1HB   TYR  35          HB2       TYR  35  15.449   8.124 -12.354
  272   2HB   TYR  35          HB3       TYR  35  15.728   9.652 -13.167
  273    HD1  TYR  35           HD1      TYR  35  13.891   7.958 -10.524
  274    HD2  TYR  35           HD2      TYR  35  14.137  11.579 -12.859
  275    HE1  TYR  35           HE1      TYR  35  12.562   9.157  -8.809
  276    HE2  TYR  35           HE2      TYR  35  12.788  12.776 -11.166
  277    HH   TYR  35           HH       TYR  35  11.662  12.620  -9.127
  278    H    SER  36           H        SER  36  15.766   9.707 -15.713
  279    HA   SER  36           HA       SER  36  17.544   7.441 -16.106
  280   1HB   SER  36          HB2       SER  36  17.552   7.645 -18.530
  281   2HB   SER  36          HB3       SER  36  15.973   7.124 -17.949
  282    HG   SER  36           HG       SER  36  15.194   9.201 -18.295
  283    H    ALA  37           H        ALA  37  19.590   8.121 -17.105
  284    HA   ALA  37           HA       ALA  37  20.163  10.917 -17.476
  285   1HB   ALA  37          HB1       ALA  37  20.150  10.905 -15.022
  286   2HB   ALA  37          HB2       ALA  37  21.302   9.550 -15.000
  287   3HB   ALA  37          HB3       ALA  37  21.771  11.143 -15.636
  288    H    GLY  38           H        GLY  38  22.924  10.842 -17.209
  289   1HA   GLY  38          HA1       GLY  38  24.178   8.455 -18.037
  290   2HA   GLY  38          HA2       GLY  38  23.855   9.468 -19.462
  291    H    ILE  39           H        ILE  39  26.358   9.105 -19.173
  292    HA   ILE  39           HA       ILE  39  27.917  10.745 -17.478
  293    HB   ILE  39           HB       ILE  39  28.174   9.290 -20.086
  294   1HG1  ILE  39          HG12      ILE  39  30.065   9.278 -17.715
  295   2HG1  ILE  39          HG13      ILE  39  28.554   8.387 -17.699
  296   1HG2  ILE  39          HG21      ILE  39  29.326  11.313 -20.732
  297   2HG2  ILE  39          HG22      ILE  39  30.321  11.255 -19.250
  298   3HG2  ILE  39          HG23      ILE  39  30.476  10.005 -20.510
  299   1HD1  ILE  39          HD11      ILE  39  30.837   7.973 -19.676
  300   2HD1  ILE  39          HD12      ILE  39  30.345   6.889 -18.374
  301   3HD1  ILE  39          HD13      ILE  39  29.269   7.137 -19.761
  302    H    GLU  40           H        GLU  40  25.900  11.620 -20.221
  303    HA   GLU  40           HA       GLU  40  26.353  14.407 -19.687
  304   1HB   GLU  40          HB2       GLU  40  26.733  15.058 -21.998
  305   2HB   GLU  40          HB3       GLU  40  28.063  14.090 -21.367
  306   1HG   GLU  40          HG2       GLU  40  27.209  12.093 -22.549
  307   2HG   GLU  40          HG3       GLU  40  25.816  13.002 -23.132
  308    H    ALA  41           H        ALA  41  24.684  15.678 -21.091
  309    HA   ALA  41           HA       ALA  41  22.478  14.094 -22.180
  310   1HB   ALA  41          HB1       ALA  41  20.835  15.560 -20.922
  311   2HB   ALA  41          HB2       ALA  41  21.721  14.420 -19.884
  312   3HB   ALA  41          HB3       ALA  41  22.172  16.140 -19.920
  313    H    HIS  42           H        HIS  42  21.776  15.129 -24.004
  314    HA   HIS  42           HA       HIS  42  22.336  18.040 -24.363
  315   1HB   HIS  42          HB2       HIS  42  22.769  15.767 -26.345
  316   2HB   HIS  42          HB3       HIS  42  22.666  17.454 -26.822
  317    HD1  HIS  42           HD1      HIS  42  24.630  17.596 -23.747
  318    HD2  HIS  42           HD2      HIS  42  25.232  16.526 -27.774
  319    HE1  HIS  42           HE1      HIS  42  27.136  17.804 -24.178
  320    H    GLY  43           H        GLY  43  19.944  15.924 -23.769
  321   1HA   GLY  43          HA1       GLY  43  17.631  16.386 -24.004
  322   2HA   GLY  43          HA2       GLY  43  17.934  17.333 -25.462
  323    H    LEU  44           H        LEU  44  16.207  14.935 -24.956
  324    HA   LEU  44           HA       LEU  44  17.314  12.634 -26.042
  325   1HB   LEU  44          HB2       LEU  44  15.162  11.742 -26.248
  326   2HB   LEU  44          HB3       LEU  44  15.259  12.649 -24.747
  327    HG   LEU  44           HG       LEU  44  13.901  13.668 -27.295
  328   1HD1  LEU  44          HD11      LEU  44  12.832  11.678 -26.458
  329   2HD1  LEU  44          HD12      LEU  44  12.804  12.317 -24.795
  330   3HD1  LEU  44          HD13      LEU  44  11.816  13.071 -26.061
  331   1HD2  LEU  44          HD21      LEU  44  14.452  15.565 -25.816
  332   2HD2  LEU  44          HD22      LEU  44  12.731  15.229 -25.707
  333   3HD2  LEU  44          HD23      LEU  44  13.799  14.682 -24.403
  334    H    ASN  45           H        ASN  45  17.323  11.618 -27.954
  335    HA   ASN  45           HA       ASN  45  17.884  13.242 -30.243
  336   1HB   ASN  45          HB2       ASN  45  18.986  11.091 -29.543
  337   2HB   ASN  45          HB3       ASN  45  17.513  10.219 -29.936
  338   1HD2  ASN  45          HD22      ASN  45  20.491  10.675 -31.063
  339   2HD2  ASN  45          HD21      ASN  45  20.202  10.646 -32.788
  340    HA   PRO  46           HA       PRO  46  13.670  13.344 -31.784
  341   1HB   PRO  46          HB2       PRO  46  14.063  13.668 -34.516
  342   2HB   PRO  46          HB3       PRO  46  14.164  14.971 -33.295
  343   1HG   PRO  46          HG2       PRO  46  16.426  13.342 -34.481
  344   2HG   PRO  46          HG3       PRO  46  16.341  15.118 -34.247
  345   1HD   PRO  46          HD2       PRO  46  17.662  13.549 -32.492
  346   2HD   PRO  46          HD3       PRO  46  16.661  14.908 -31.900
  347    H    ASN  47           H        ASN  47  16.019  10.970 -33.083
  348    HA   ASN  47           HA       ASN  47  13.938   9.335 -34.331
  349   1HB   ASN  47          HB2       ASN  47  16.817   8.768 -33.564
  350   2HB   ASN  47          HB3       ASN  47  15.748   7.570 -34.280
  351   1HD2  ASN  47          HD22      ASN  47  18.289   9.147 -35.231
  352   2HD2  ASN  47          HD21      ASN  47  17.839   9.596 -36.857
  353    H    ALA  48           H        ALA  48  15.353   9.708 -31.102
  354    HA   ALA  48           HA       ALA  48  14.311   7.253 -30.031
  355   1HB   ALA  48          HB1       ALA  48  16.118   8.722 -28.933
  356   2HB   ALA  48          HB2       ALA  48  14.819   9.826 -28.469
  357   3HB   ALA  48          HB3       ALA  48  14.810   8.165 -27.874
  358    H    VAL  49           H        VAL  49  13.138  10.663 -30.231
  359    HA   VAL  49           HA       VAL  49  10.618  10.232 -29.021
  360    HB   VAL  49           HB       VAL  49  11.281  12.201 -31.259
  361   1HG1  VAL  49          HG11      VAL  49   9.045  12.218 -29.182
  362   2HG1  VAL  49          HG12      VAL  49   9.411  13.529 -30.326
  363   3HG1  VAL  49          HG13      VAL  49   8.843  11.972 -30.934
  364   1HG2  VAL  49          HG21      VAL  49  11.352  12.586 -28.247
  365   2HG2  VAL  49          HG22      VAL  49  12.787  12.496 -29.291
  366   3HG2  VAL  49          HG23      VAL  49  11.656  13.838 -29.466
  367    H    LYS  50           H        LYS  50  11.474  10.065 -32.561
  368    HA   LYS  50           HA       LYS  50   8.900   9.198 -33.369
  369   1HB   LYS  50          HB2       LYS  50  11.657   8.696 -34.582
  370   2HB   LYS  50          HB3       LYS  50  10.174   8.209 -35.374
  371   1HG   LYS  50          HG2       LYS  50  10.908  11.078 -34.652
  372   2HG   LYS  50          HG3       LYS  50  11.072  10.345 -36.240
  373   1HD   LYS  50          HD2       LYS  50   8.457  10.880 -34.763
  374   2HD   LYS  50          HD3       LYS  50   9.110  11.772 -36.137
  375   1HE   LYS  50          HE2       LYS  50   8.993   9.683 -37.524
  376   2HE   LYS  50          HE3       LYS  50   8.230   8.848 -36.165
  377   1HZ   LYS  50          HZ1       LYS  50   7.109  11.205 -37.571
  378   2HZ   LYS  50          HZ2       LYS  50   6.591   9.671 -37.729
  379   3HZ   LYS  50          HZ3       LYS  50   6.398  10.445 -36.308
  380    H    ALA  51           H        ALA  51  11.691   7.215 -32.276
  381    HA   ALA  51           HA       ALA  51  10.556   4.713 -32.916
  382   1HB   ALA  51          HB1       ALA  51  12.928   5.048 -32.293
  383   2HB   ALA  51          HB2       ALA  51  12.455   5.473 -30.640
  384   3HB   ALA  51          HB3       ALA  51  12.175   3.831 -31.248
  385    H    MET  52           H        MET  52  10.325   6.670 -29.887
  386    HA   MET  52           HA       MET  52   8.611   4.724 -28.609
  387   1HB   MET  52          HB2       MET  52   9.093   7.661 -27.989
  388   2HB   MET  52          HB3       MET  52   8.214   6.538 -26.954
  389   1HG   MET  52          HG2       MET  52  11.154   6.496 -27.670
  390   2HG   MET  52          HG3       MET  52  10.413   6.680 -26.091
  391   1HE   MET  52          HE1       MET  52   8.226   4.099 -26.389
  392   2HE   MET  52          HE2       MET  52   9.154   3.106 -25.259
  393   3HE   MET  52          HE3       MET  52   9.013   4.843 -24.961
  394    H    LYS  53           H        LYS  53   7.972   7.655 -30.583
  395    HA   LYS  53           HA       LYS  53   5.185   7.684 -30.202
  396   1HB   LYS  53          HB2       LYS  53   6.903   9.220 -31.654
  397   2HB   LYS  53          HB3       LYS  53   6.211   8.246 -32.942
  398   1HG   LYS  53          HG2       LYS  53   4.493   9.712 -32.940
  399   2HG   LYS  53          HG3       LYS  53   3.940   8.963 -31.450
  400   1HD   LYS  53          HD2       LYS  53   5.728  11.395 -31.756
  401   2HD   LYS  53          HD3       LYS  53   4.041  11.375 -31.236
  402   1HE   LYS  53          HE2       LYS  53   4.692  10.258 -29.106
  403   2HE   LYS  53          HE3       LYS  53   6.371  10.203 -29.641
  404   1HZ   LYS  53          HZ1       LYS  53   4.800  12.695 -29.250
  405   2HZ   LYS  53          HZ2       LYS  53   5.952  12.174 -28.229
  406   3HZ   LYS  53          HZ3       LYS  53   6.354  12.647 -29.737
  407    H    GLU  54           H        GLU  54   7.221   5.563 -32.182
  408    HA   GLU  54           HA       GLU  54   5.179   4.576 -33.883
  409   1HB   GLU  54          HB2       GLU  54   7.745   4.543 -34.179
  410   2HB   GLU  54          HB3       GLU  54   7.732   3.128 -33.135
  411   1HG   GLU  54          HG2       GLU  54   7.792   2.419 -35.426
  412   2HG   GLU  54          HG3       GLU  54   6.229   1.977 -34.762
  413    H    VAL  55           H        VAL  55   5.839   3.978 -30.538
  414    HA   VAL  55           HA       VAL  55   4.037   1.590 -30.583
  415    HB   VAL  55           HB       VAL  55   5.145   0.962 -28.447
  416   1HG1  VAL  55          HG11      VAL  55   7.188   0.098 -29.552
  417   2HG1  VAL  55          HG12      VAL  55   5.782  -0.036 -30.611
  418   3HG1  VAL  55          HG13      VAL  55   6.972   1.251 -30.875
  419   1HG2  VAL  55          HG21      VAL  55   7.215   2.003 -27.748
  420   2HG2  VAL  55          HG22      VAL  55   7.239   3.063 -29.156
  421   3HG2  VAL  55          HG23      VAL  55   6.015   3.283 -27.879
  422    H    GLY  56           H        GLY  56   3.957   4.861 -29.995
  423   1HA   GLY  56          HA1       GLY  56   2.025   5.979 -29.381
  424   2HA   GLY  56          HA2       GLY  56   1.395   4.525 -28.588
  425    H    ILE  57           H        ILE  57   4.677   5.872 -28.069
  426    HA   ILE  57           HA       ILE  57   3.932   6.663 -25.302
  427    HB   ILE  57           HB       ILE  57   6.387   5.187 -26.314
  428   1HG1  ILE  57          HG12      ILE  57   4.264   4.285 -24.317
  429   2HG1  ILE  57          HG13      ILE  57   4.341   3.760 -25.993
  430   1HG2  ILE  57          HG21      ILE  57   7.086   6.775 -24.607
  431   2HG2  ILE  57          HG22      ILE  57   5.754   6.272 -23.535
  432   3HG2  ILE  57          HG23      ILE  57   7.100   5.179 -23.885
  433   1HD1  ILE  57          HD11      ILE  57   6.388   3.105 -23.851
  434   2HD1  ILE  57          HD12      ILE  57   5.259   2.015 -24.669
  435   3HD1  ILE  57          HD13      ILE  57   6.584   2.741 -25.576
  436    H    ASP  58           H        ASP  58   5.223   8.431 -24.556
  437    HA   ASP  58           HA       ASP  58   6.289  10.208 -26.683
  438   1HB   ASP  58          HB2       ASP  58   3.912  10.674 -26.483
  439   2HB   ASP  58          HB3       ASP  58   4.063  10.876 -24.729
  440    H    ILE  59           H        ILE  59   8.321   9.673 -25.763
  441    HA   ILE  59           HA       ILE  59   8.950  10.458 -23.058
  442    HB   ILE  59           HB       ILE  59  11.327  10.006 -23.770
  443   1HG1  ILE  59          HG12      ILE  59  10.145   8.997 -26.382
  444   2HG1  ILE  59          HG13      ILE  59  10.884  10.576 -26.242
  445   1HG2  ILE  59          HG21      ILE  59  10.994   7.600 -23.816
  446   2HG2  ILE  59          HG22      ILE  59   9.798   8.329 -22.750
  447   3HG2  ILE  59          HG23      ILE  59   9.314   7.793 -24.367
  448   1HD1  ILE  59          HD11      ILE  59  12.516   8.958 -27.073
  449   2HD1  ILE  59          HD12      ILE  59  13.011   9.533 -25.475
  450   3HD1  ILE  59          HD13      ILE  59  12.288   7.924 -25.655
  451    H    SER  60           H        SER  60   8.118  12.576 -25.520
  452    HA   SER  60           HA       SER  60  10.238  14.476 -25.294
  453   1HB   SER  60          HB2       SER  60   8.689  16.081 -26.211
  454   2HB   SER  60          HB3       SER  60   8.564  14.552 -27.091
  455    HG   SER  60           HG       SER  60   6.628  14.134 -26.154
  456    H    ASN  61           H        ASN  61   7.822  13.489 -23.062
  457    HA   ASN  61           HA       ASN  61   7.642  15.937 -21.533
  458   1HB   ASN  61          HB2       ASN  61   6.724  13.098 -20.880
  459   2HB   ASN  61          HB3       ASN  61   6.256  14.553 -20.010
  460   1HD2  ASN  61          HD22      ASN  61   5.613  12.588 -22.832
  461   2HD2  ASN  61          HD21      ASN  61   4.483  13.653 -23.612
  462    H    GLN  62           H        GLN  62  10.254  13.853 -21.719
  463    HA   GLN  62           HA       GLN  62  10.955  14.173 -18.833
  464   1HB   GLN  62          HB2       GLN  62  11.901  11.827 -18.942
  465   2HB   GLN  62          HB3       GLN  62  10.139  11.933 -18.947
  466   1HG   GLN  62          HG2       GLN  62   9.981  11.458 -21.260
  467   2HG   GLN  62          HG3       GLN  62  11.703  11.772 -21.526
  468   1HE2  GLN  62          HE22      GLN  62  13.007  10.105 -21.690
  469   2HE2  GLN  62          HE21      GLN  62  12.578   8.435 -21.307
  470    H    THR  63           H        THR  63  11.810  16.044 -20.421
  471    HA   THR  63           HA       THR  63  13.965  15.702 -22.101
  472    HB   THR  63           HB       THR  63  14.485  18.138 -21.301
  473    HG1  THR  63           HG1      THR  63  13.417  18.032 -19.293
  474   1HG2  THR  63          HG21      THR  63  12.500  18.987 -22.496
  475   2HG2  THR  63          HG22      THR  63  13.170  17.575 -23.327
  476   3HG2  THR  63          HG23      THR  63  11.705  17.405 -22.336
  477    H    SER  64           H        SER  64  16.131  15.484 -21.963
  478    HA   SER  64           HA       SER  64  17.091  13.926 -20.021
  479   1HB   SER  64          HB2       SER  64  18.709  15.673 -21.905
  480   2HB   SER  64          HB3       SER  64  19.140  14.063 -21.304
  481    HG   SER  64           HG       SER  64  18.073  13.256 -22.862
  482    H    ASP  65           H        ASP  65  18.935  14.001 -18.693
  483    HA   ASP  65           HA       ASP  65  20.196  16.499 -17.951
  484   1HB   ASP  65          HB2       ASP  65  18.125  16.474 -16.489
  485   2HB   ASP  65          HB3       ASP  65  18.683  14.948 -15.800
  486    H    ILE  66           H        ILE  66  22.033  16.079 -16.492
  487    HA   ILE  66           HA       ILE  66  23.351  13.509 -17.007
  488    HB   ILE  66           HB       ILE  66  25.070  14.758 -15.368
  489   1HG1  ILE  66          HG12      ILE  66  23.498  16.802 -15.133
  490   2HG1  ILE  66          HG13      ILE  66  25.216  17.020 -15.383
  491   1HG2  ILE  66          HG21      ILE  66  26.222  15.545 -17.387
  492   2HG2  ILE  66          HG22      ILE  66  25.565  13.911 -17.536
  493   3HG2  ILE  66          HG23      ILE  66  24.725  15.270 -18.320
  494   1HD1  ILE  66          HD11      ILE  66  23.887  18.623 -16.708
  495   2HD1  ILE  66          HD12      ILE  66  24.915  17.612 -17.732
  496   3HD1  ILE  66          HD13      ILE  66  23.176  17.291 -17.636
  497    H    ILE  67           H        ILE  67  24.448  12.471 -15.114
  498    HA   ILE  67           HA       ILE  67  22.526  11.422 -13.366
  499    HB   ILE  67           HB       ILE  67  25.557  11.319 -13.455
  500   1HG1  ILE  67          HG12      ILE  67  23.425   9.190 -13.928
  501   2HG1  ILE  67          HG13      ILE  67  24.047  10.206 -15.218
  502   1HG2  ILE  67          HG21      ILE  67  25.469   9.448 -11.827
  503   2HG2  ILE  67          HG22      ILE  67  24.958  10.952 -11.082
  504   3HG2  ILE  67          HG23      ILE  67  23.735   9.756 -11.569
  505   1HD1  ILE  67          HD11      ILE  67  26.344   9.328 -14.797
  506   2HD1  ILE  67          HD12      ILE  67  25.643   8.168 -13.636
  507   3HD1  ILE  67          HD13      ILE  67  25.161   8.118 -15.336
  508    H    ASP  68           H        ASP  68  22.115  11.666 -11.212
  509    HA   ASP  68           HA       ASP  68  23.486  13.802  -9.685
  510   1HB   ASP  68          HB2       ASP  68  21.367  14.721 -10.761
  511   2HB   ASP  68          HB3       ASP  68  20.456  13.581  -9.764
  512    H    SER  69           H        SER  69  23.830  13.244  -7.599
  513    HA   SER  69           HA       SER  69  23.695  10.650  -6.683
  514   1HB   SER  69          HB2       SER  69  23.737  13.154  -4.978
  515   2HB   SER  69          HB3       SER  69  24.425  11.566  -4.588
  516    HG   SER  69           HG       SER  69  26.009  13.055  -5.346
  517    H    ASP  70           H        ASP  70  21.164  13.084  -6.578
  518    HA   ASP  70           HA       ASP  70  19.739  12.079  -4.299
  519   1HB   ASP  70          HB2       ASP  70  19.589  14.407  -5.143
  520   2HB   ASP  70          HB3       ASP  70  18.787  13.815  -6.604
  521    H    ILE  71           H        ILE  71  20.076  10.857  -7.461
  522    HA   ILE  71           HA       ILE  71  17.623   9.193  -7.181
  523    HB   ILE  71           HB       ILE  71  19.116   9.937  -9.708
  524   1HG1  ILE  71          HG12      ILE  71  16.262  10.823  -9.197
  525   2HG1  ILE  71          HG13      ILE  71  17.551  11.781  -8.486
  526   1HG2  ILE  71          HG21      ILE  71  17.158   8.849 -10.814
  527   2HG2  ILE  71          HG22      ILE  71  18.054   7.730  -9.780
  528   3HG2  ILE  71          HG23      ILE  71  16.511   8.405  -9.221
  529   1HD1  ILE  71          HD11      ILE  71  17.369  11.142 -11.444
  530   2HD1  ILE  71          HD12      ILE  71  16.936  12.677 -10.660
  531   3HD1  ILE  71          HD13      ILE  71  18.620  12.122 -10.630
  532    H    LEU  72           H        LEU  72  21.122   9.276  -8.115
  533    HA   LEU  72           HA       LEU  72  21.635   6.565  -8.423
  534   1HB   LEU  72          HB2       LEU  72  23.303   8.598  -6.887
  535   2HB   LEU  72          HB3       LEU  72  23.858   6.978  -7.224
  536    HG   LEU  72           HG       LEU  72  23.221   9.033  -9.351
  537   1HD1  LEU  72          HD11      LEU  72  25.747   9.065  -9.559
  538   2HD1  LEU  72          HD12      LEU  72  25.145   9.701  -8.026
  539   3HD1  LEU  72          HD13      LEU  72  25.836   8.070  -8.100
  540   1HD2  LEU  72          HD21      LEU  72  24.431   7.417 -10.849
  541   2HD2  LEU  72          HD22      LEU  72  24.532   6.267  -9.505
  542   3HD2  LEU  72          HD23      LEU  72  22.959   6.704 -10.190
  543    H    ASN  73           H        ASN  73  21.893   8.258  -5.279
  544    HA   ASN  73           HA       ASN  73  22.188   5.765  -3.887
  545   1HB   ASN  73          HB2       ASN  73  22.870   6.968  -2.104
  546   2HB   ASN  73          HB3       ASN  73  23.104   8.221  -3.308
  547   1HD2  ASN  73          HD22      ASN  73  21.050   9.753  -3.581
  548   2HD2  ASN  73          HD21      ASN  73  20.199  10.134  -2.100
  549    H    ASN  74           H        ASN  74  19.437   6.983  -5.125
  550    HA   ASN  74           HA       ASN  74  17.666   6.403  -2.786
  551   1HB   ASN  74          HB2       ASN  74  17.864   8.741  -3.597
  552   2HB   ASN  74          HB3       ASN  74  17.425   8.207  -5.214
  553   1HD2  ASN  74          HD22      ASN  74  15.900   9.993  -4.908
  554   2HD2  ASN  74          HD21      ASN  74  14.328   9.629  -4.209
  555    H    ALA  75           H        ALA  75  18.275   5.791  -6.222
  556    HA   ALA  75           HA       ALA  75  15.867   4.556  -6.955
  557   1HB   ALA  75          HB1       ALA  75  17.087   3.740  -8.845
  558   2HB   ALA  75          HB2       ALA  75  17.508   5.424  -8.516
  559   3HB   ALA  75          HB3       ALA  75  18.640   4.133  -8.050
  560    H    ASP  76           H        ASP  76  15.010   2.648  -6.632
  561    HA   ASP  76           HA       ASP  76  15.983   0.738  -4.740
  562   1HB   ASP  76          HB2       ASP  76  13.580   1.146  -5.367
  563   2HB   ASP  76          HB3       ASP  76  13.894   0.409  -6.938
  564    H    LEU  77           H        LEU  77  16.276   1.218  -8.206
  565    HA   LEU  77           HA       LEU  77  18.393  -0.807  -8.401
  566   1HB   LEU  77          HB2       LEU  77  16.370  -2.102  -9.005
  567   2HB   LEU  77          HB3       LEU  77  15.871  -0.834 -10.125
  568    HG   LEU  77           HG       LEU  77  17.885  -1.291 -11.535
  569   1HD1  LEU  77          HD11      LEU  77  19.398  -2.259  -9.820
  570   2HD1  LEU  77          HD12      LEU  77  18.314  -3.657  -9.655
  571   3HD1  LEU  77          HD13      LEU  77  19.181  -3.353 -11.177
  572   1HD2  LEU  77          HD21      LEU  77  17.081  -3.421 -12.450
  573   2HD2  LEU  77          HD22      LEU  77  16.124  -3.699 -10.977
  574   3HD2  LEU  77          HD23      LEU  77  15.747  -2.334 -12.056
  575    H    VAL  78           H        VAL  78  19.926  -0.161  -9.877
  576    HA   VAL  78           HA       VAL  78  19.287   2.120 -11.688
  577    HB   VAL  78           HB       VAL  78  21.949   1.370 -10.404
  578   1HG1  VAL  78          HG11      VAL  78  21.205   3.648 -12.298
  579   2HG1  VAL  78          HG12      VAL  78  22.740   3.518 -11.416
  580   3HG1  VAL  78          HG13      VAL  78  22.324   2.308 -12.633
  581   1HG2  VAL  78          HG21      VAL  78  20.487   2.451  -8.757
  582   2HG2  VAL  78          HG22      VAL  78  21.762   3.565  -9.245
  583   3HG2  VAL  78          HG23      VAL  78  20.121   3.757  -9.900
  584    H    VAL  79           H        VAL  79  19.859   1.749 -13.875
  585    HA   VAL  79           HA       VAL  79  20.784  -1.006 -14.556
  586    HB   VAL  79           HB       VAL  79  18.621   0.617 -15.947
  587   1HG1  VAL  79          HG11      VAL  79  18.093  -1.512 -17.081
  588   2HG1  VAL  79          HG12      VAL  79  19.768  -1.054 -17.388
  589   3HG1  VAL  79          HG13      VAL  79  19.405  -2.320 -16.201
  590   1HG2  VAL  79          HG21      VAL  79  18.246  -1.658 -13.961
  591   2HG2  VAL  79          HG22      VAL  79  17.677   0.018 -13.790
  592   3HG2  VAL  79          HG23      VAL  79  16.975  -1.023 -15.025
  593    H    THR  80           H        THR  80  22.332  -1.049 -16.115
  594    HA   THR  80           HA       THR  80  23.284   1.564 -17.180
  595    HB   THR  80           HB       THR  80  25.141  -0.764 -16.812
  596    HG1  THR  80           HG1      THR  80  24.035  -0.898 -14.895
  597   1HG2  THR  80          HG21      THR  80  25.347   2.191 -16.066
  598   2HG2  THR  80          HG22      THR  80  26.666   1.001 -16.057
  599   3HG2  THR  80          HG23      THR  80  25.918   1.478 -17.594
  600    H    LEU  81           H        LEU  81  22.791   1.683 -19.328
  601    HA   LEU  81           HA       LEU  81  22.197  -0.825 -20.735
  602   1HB   LEU  81          HB2       LEU  81  21.655   2.089 -21.409
  603   2HB   LEU  81          HB3       LEU  81  21.267   0.736 -22.463
  604    HG   LEU  81           HG       LEU  81  19.823  -0.260 -20.673
  605   1HD1  LEU  81          HD11      LEU  81  20.257   2.440 -19.307
  606   2HD1  LEU  81          HD12      LEU  81  18.923   1.334 -18.940
  607   3HD1  LEU  81          HD13      LEU  81  20.560   0.826 -18.617
  608   1HD2  LEU  81          HD21      LEU  81  19.050   2.532 -21.585
  609   2HD2  LEU  81          HD22      LEU  81  18.807   1.018 -22.496
  610   3HD2  LEU  81          HD23      LEU  81  17.936   1.290 -20.996
  611    H    CYS  82           H        CYS  82  25.077   0.457 -20.279
  612    HA   CYS  82           HA       CYS  82  26.125   1.069 -22.846
  613   1HB   CYS  82          HB2       CYS  82  28.306   0.737 -21.745
  614   2HB   CYS  82          HB3       CYS  82  27.249   1.863 -20.906
  615    H    GLY  83           H        GLY  83  26.374  -0.320 -24.535
  616   1HA   GLY  83          HA1       GLY  83  27.934  -2.706 -24.261
  617   2HA   GLY  83          HA2       GLY  83  26.261  -3.087 -24.681
  618    H    ASP  84           H        ASP  84  27.925  -0.138 -25.582
  619    HA   ASP  84           HA       ASP  84  27.547  -0.600 -28.479
  620   1HB   ASP  84          HB2       ASP  84  27.323   1.870 -28.507
  621   2HB   ASP  84          HB3       ASP  84  26.237   1.170 -27.309
  622    H    ALA  85           H        ALA  85  29.016   1.278 -29.639
  623    HA   ALA  85           HA       ALA  85  31.613   0.137 -29.608
  624   1HB   ALA  85          HB1       ALA  85  30.526   1.106 -31.616
  625   2HB   ALA  85          HB2       ALA  85  30.692   2.732 -30.909
  626   3HB   ALA  85          HB3       ALA  85  32.134   1.794 -31.330
  627    H    ALA  86           H        ALA  86  30.390   2.797 -27.663
  628    HA   ALA  86           HA       ALA  86  33.158   3.749 -27.088
  629   1HB   ALA  86          HB1       ALA  86  31.469   5.465 -27.734
  630   2HB   ALA  86          HB2       ALA  86  30.489   4.995 -26.323
  631   3HB   ALA  86          HB3       ALA  86  32.104   5.689 -26.094
  632    H    ASP  87           H        ASP  87  30.179   2.521 -25.596
  633    HA   ASP  87           HA       ASP  87  29.733   1.444 -23.657
  634   1HB   ASP  87          HB2       ASP  87  30.988  -0.173 -25.026
  635   2HB   ASP  87          HB3       ASP  87  32.469   0.234 -24.167
  636    H    LYS  88           H        LYS  88  30.707   4.011 -23.041
  637    HA   LYS  88           HA       LYS  88  32.873   3.947 -21.229
  638   1HB   LYS  88          HB2       LYS  88  30.742   6.104 -21.434
  639   2HB   LYS  88          HB3       LYS  88  32.340   6.253 -20.703
  640   1HG   LYS  88          HG2       LYS  88  33.375   5.750 -22.940
  641   2HG   LYS  88          HG3       LYS  88  31.756   5.716 -23.645
  642   1HD   LYS  88          HD2       LYS  88  32.710   7.842 -24.124
  643   2HD   LYS  88          HD3       LYS  88  31.412   8.089 -22.946
  644   1HE   LYS  88          HE2       LYS  88  33.071   8.271 -21.123
  645   2HE   LYS  88          HE3       LYS  88  34.379   7.877 -22.244
  646   1HZ   LYS  88          HZ1       LYS  88  33.927   9.939 -23.420
  647   2HZ   LYS  88          HZ2       LYS  88  32.698  10.313 -22.409
  648   3HZ   LYS  88          HZ3       LYS  88  34.228  10.252 -21.853
  649    H    CYS  89           H        CYS  89  29.758   2.849 -20.619
  650    HA   CYS  89           HA       CYS  89  28.434   2.525 -18.792
  651   1HB   CYS  89          HB2       CYS  89  31.069   1.329 -17.959
  652   2HB   CYS  89          HB3       CYS  89  29.522   0.990 -17.197
  653    HA   PRO  90           HA       PRO  90  29.257   6.334 -16.403
  654   1HB   PRO  90          HB2       PRO  90  26.394   5.742 -15.694
  655   2HB   PRO  90          HB3       PRO  90  27.166   7.304 -16.124
  656   1HG   PRO  90          HG2       PRO  90  25.656   5.922 -17.927
  657   2HG   PRO  90          HG3       PRO  90  27.140   6.784 -18.430
  658   1HD   PRO  90          HD2       PRO  90  26.732   3.861 -17.959
  659   2HD   PRO  90          HD3       PRO  90  27.726   4.697 -19.191
  660    H    MET  91           H        MET  91  29.814   6.636 -14.274
  661    HA   MET  91           HA       MET  91  30.177   4.336 -12.641
  662   1HB   MET  91          HB2       MET  91  31.749   6.261 -12.795
  663   2HB   MET  91          HB3       MET  91  30.550   7.294 -12.002
  664   1HG   MET  91          HG2       MET  91  30.669   5.880  -9.974
  665   2HG   MET  91          HG3       MET  91  31.771   4.778 -10.800
  666   1HE   MET  91          HE1       MET  91  31.725   8.812 -10.657
  667   2HE   MET  91          HE2       MET  91  31.276   8.220  -9.040
  668   3HE   MET  91          HE3       MET  91  32.834   9.038  -9.291
  669    H    THR  92           H        THR  92  29.023   3.621 -10.935
  670    HA   THR  92           HA       THR  92  26.774   5.168  -9.791
  671    HB   THR  92           HB       THR  92  25.798   2.783  -9.631
  672    HG1  THR  92           HG1      THR  92  27.697   1.611 -10.026
  673   1HG2  THR  92          HG21      THR  92  25.150   4.458 -11.403
  674   2HG2  THR  92          HG22      THR  92  26.406   3.755 -12.447
  675   3HG2  THR  92          HG23      THR  92  25.019   2.770 -11.933
  676    HA   PRO  93           HA       PRO  93  28.616   4.073  -5.862
  677   1HB   PRO  93          HB2       PRO  93  26.480   3.755  -4.171
  678   2HB   PRO  93          HB3       PRO  93  26.983   5.346  -4.821
  679   1HG   PRO  93          HG2       PRO  93  24.816   3.505  -5.871
  680   2HG   PRO  93          HG3       PRO  93  24.699   5.260  -5.538
  681   1HD   PRO  93          HD2       PRO  93  25.172   4.286  -8.043
  682   2HD   PRO  93          HD3       PRO  93  25.956   5.792  -7.475
  683    HA   PRO  94           HA       PRO  94  28.392  -0.440  -5.966
  684   1HB   PRO  94          HB2       PRO  94  29.981  -1.113  -3.864
  685   2HB   PRO  94          HB3       PRO  94  30.633  -0.360  -5.352
  686   1HG   PRO  94          HG2       PRO  94  29.919   0.995  -2.737
  687   2HG   PRO  94          HG3       PRO  94  31.417   1.176  -3.704
  688   1HD   PRO  94          HD2       PRO  94  29.291   2.927  -3.865
  689   2HD   PRO  94          HD3       PRO  94  30.347   2.565  -5.269
  690    H    HIS  95           H        HIS  95  27.376   1.513  -3.248
  691    HA   HIS  95           HA       HIS  95  26.306  -0.543  -1.586
  692   1HB   HIS  95          HB2       HIS  95  25.581   2.413  -1.685
  693   2HB   HIS  95          HB3       HIS  95  25.372   1.319  -0.321
  694    HD1  HIS  95           HD1      HIS  95  28.082   0.144   0.318
  695    HD2  HIS  95           HD2      HIS  95  27.592   3.997  -1.316
  696    HE1  HIS  95           HE1      HIS  95  30.224   1.417   0.831
  697    H    VAL  96           H        VAL  96  25.146   0.539  -4.599
  698    HA   VAL  96           HA       VAL  96  22.301   0.027  -3.841
  699    HB   VAL  96           HB       VAL  96  23.373   1.824  -6.030
  700   1HG1  VAL  96          HG11      VAL  96  21.014   2.598  -6.204
  701   2HG1  VAL  96          HG12      VAL  96  21.193   0.909  -6.667
  702   3HG1  VAL  96          HG13      VAL  96  20.520   1.323  -5.074
  703   1HG2  VAL  96          HG21      VAL  96  22.441   3.657  -4.626
  704   2HG2  VAL  96          HG22      VAL  96  22.044   2.491  -3.350
  705   3HG2  VAL  96          HG23      VAL  96  23.736   2.823  -3.775
  706    H    LYS  97           H        LYS  97  21.117  -1.391  -5.120
  707    HA   LYS  97           HA       LYS  97  22.498  -3.469  -6.494
  708   1HB   LYS  97          HB2       LYS  97  20.274  -3.664  -5.317
  709   2HB   LYS  97          HB3       LYS  97  19.540  -2.700  -6.611
  710   1HG   LYS  97          HG2       LYS  97  20.197  -4.449  -8.265
  711   2HG   LYS  97          HG3       LYS  97  20.952  -5.387  -6.964
  712   1HD   LYS  97          HD2       LYS  97  18.753  -5.588  -5.831
  713   2HD   LYS  97          HD3       LYS  97  17.995  -4.644  -7.133
  714   1HE   LYS  97          HE2       LYS  97  18.675  -6.367  -8.785
  715   2HE   LYS  97          HE3       LYS  97  19.468  -7.294  -7.505
  716   1HZ   LYS  97          HZ1       LYS  97  16.559  -6.739  -7.643
  717   2HZ   LYS  97          HZ2       LYS  97  17.273  -8.161  -7.987
  718   3HZ   LYS  97          HZ3       LYS  97  17.299  -7.595  -6.463
  719    H    ARG  98           H        ARG  98  22.880  -3.744  -8.655
  720    HA   ARG  98           HA       ARG  98  21.945  -1.649 -10.515
  721   1HB   ARG  98          HB2       ARG  98  24.364  -1.309  -9.601
  722   2HB   ARG  98          HB3       ARG  98  24.794  -2.662 -10.659
  723   1HG   ARG  98          HG2       ARG  98  23.808  -1.338 -12.604
  724   2HG   ARG  98          HG3       ARG  98  23.466  -0.035 -11.469
  725   1HD   ARG  98          HD2       ARG  98  25.449   0.633 -12.436
  726   2HD   ARG  98          HD3       ARG  98  25.991  -0.097 -10.912
  727    HE   ARG  98           HE       ARG  98  26.071  -2.139 -12.807
  728   1HH1  ARG  98          HH21      ARG  98  27.601   1.034 -12.397
  729   2HH1  ARG  98          HH22      ARG  98  28.875   0.735 -13.532
  730   1HH2  ARG  98          HH11      ARG  98  27.832  -2.597 -14.230
  731   2HH2  ARG  98          HH12      ARG  98  29.044  -1.415 -14.536
  732    H    GLU  99           H        GLU  99  21.850  -2.283 -12.695
  733    HA   GLU  99           HA       GLU  99  22.218  -5.158 -13.375
  734   1HB   GLU  99          HB2       GLU  99  19.882  -3.276 -13.723
  735   2HB   GLU  99          HB3       GLU  99  20.246  -4.346 -15.062
  736   1HG   GLU  99          HG2       GLU  99  19.904  -5.410 -12.242
  737   2HG   GLU  99          HG3       GLU  99  18.539  -5.145 -13.327
  738    H    HIS 100           H        HIS 100  22.683  -5.457 -15.654
  739    HA   HIS 100           HA       HIS 100  23.764  -3.106 -17.106
  740   1HB   HIS 100          HB2       HIS 100  25.738  -4.025 -16.264
  741   2HB   HIS 100          HB3       HIS 100  25.139  -5.681 -16.357
  742    HD1  HIS 100           HD1      HIS 100  26.307  -2.933 -18.887
  743    HD2  HIS 100           HD2      HIS 100  25.830  -7.091 -18.393
  744    HE1  HIS 100           HE1      HIS 100  27.395  -4.033 -20.906
  745    H    TRP 101           H        TRP 101  22.651  -2.980 -18.919
  746    HA   TRP 101           HA       TRP 101  21.407  -5.390 -20.183
  747   1HB   TRP 101          HB2       TRP 101  20.247  -2.599 -19.776
  748   2HB   TRP 101          HB3       TRP 101  19.584  -3.797 -20.867
  749    HD1  TRP 101           HD1      TRP 101  20.503  -5.180 -17.453
  750    HE1  TRP 101           HE1      TRP 101  18.437  -5.655 -16.116
  751    HE3  TRP 101           HE3      TRP 101  17.074  -3.047 -20.596
  752    HZ2  TRP 101           HZ2      TRP 101  15.587  -5.009 -16.266
  753    HZ3  TRP 101           HZ3      TRP 101  14.664  -3.113 -20.028
  754    HH2  TRP 101           HH2      TRP 101  13.918  -4.042 -17.835
  755    H    GLY 102           H        GLY 102  23.819  -5.039 -21.073
  756   1HA   GLY 102          HA1       GLY 102  24.306  -2.692 -22.607
  757   2HA   GLY 102          HA2       GLY 102  25.267  -4.177 -22.628
  758    H    PHE 103           H        PHE 103  23.915  -2.178 -24.650
  759    HA   PHE 103           HA       PHE 103  23.951  -4.022 -26.806
  760   1HB   PHE 103          HB2       PHE 103  21.623  -3.103 -27.671
  761   2HB   PHE 103          HB3       PHE 103  21.735  -4.552 -26.703
  762    HD1  PHE 103           HD1      PHE 103  21.309  -0.834 -26.174
  763    HD2  PHE 103           HD2      PHE 103  20.210  -4.827 -24.970
  764    HE1  PHE 103           HE1      PHE 103  19.820   0.092 -24.418
  765    HE2  PHE 103           HE2      PHE 103  18.697  -3.892 -23.245
  766    HZ   PHE 103           HZ       PHE 103  18.570  -1.434 -22.906
  767    H    ASP 104           H        ASP 104  23.831  -2.726 -28.855
  768    HA   ASP 104           HA       ASP 104  25.524  -0.504 -28.579
  769   1HB   ASP 104          HB2       ASP 104  25.528  -2.065 -30.504
  770   2HB   ASP 104          HB3       ASP 104  23.970  -1.404 -31.022
  771    H    ASP 105           H        ASP 105  25.216   1.663 -28.877
  772    HA   ASP 105           HA       ASP 105  22.569   2.705 -28.215
  773   1HB   ASP 105          HB2       ASP 105  24.759   3.833 -27.522
  774   2HB   ASP 105          HB3       ASP 105  24.903   4.385 -29.179
  775    HA   PRO 106           HA       PRO 106  21.483   2.555 -32.485
  776   1HB   PRO 106          HB2       PRO 106  19.109   3.893 -32.546
  777   2HB   PRO 106          HB3       PRO 106  19.322   2.257 -31.853
  778   1HG   PRO 106          HG2       PRO 106  19.266   4.892 -30.356
  779   2HG   PRO 106          HG3       PRO 106  18.387   3.378 -29.966
  780   1HD   PRO 106          HD2       PRO 106  20.750   4.052 -28.785
  781   2HD   PRO 106          HD3       PRO 106  20.373   2.348 -29.184
  782    H    ALA 107           H        ALA 107  22.007   5.681 -30.900
  783    HA   ALA 107           HA       ALA 107  22.078   7.123 -33.430
  784   1HB   ALA 107          HB1       ALA 107  23.135   7.922 -30.692
  785   2HB   ALA 107          HB2       ALA 107  22.990   8.973 -32.111
  786   3HB   ALA 107          HB3       ALA 107  21.529   8.317 -31.358
  787    H    ARG 108           H        ARG 108  24.093   4.853 -31.884
  788    HA   ARG 108           HA       ARG 108  26.579   5.882 -33.157
  789   1HB   ARG 108          HB2       ARG 108  26.348   5.538 -30.645
  790   2HB   ARG 108          HB3       ARG 108  26.287   3.801 -30.952
  791   1HG   ARG 108          HG2       ARG 108  28.542   3.752 -31.719
  792   2HG   ARG 108          HG3       ARG 108  28.621   5.512 -31.891
  793   1HD   ARG 108          HD2       ARG 108  28.250   4.064 -29.230
  794   2HD   ARG 108          HD3       ARG 108  29.811   4.626 -29.846
  795    HE   ARG 108           HE       ARG 108  28.694   6.927 -29.953
  796   1HH1  ARG 108          HH21      ARG 108  28.222   4.632 -27.247
  797   2HH1  ARG 108          HH22      ARG 108  27.428   5.797 -26.249
  798   1HH2  ARG 108          HH11      ARG 108  27.802   8.478 -28.546
  799   2HH2  ARG 108          HH12      ARG 108  27.311   8.045 -26.956
  800    H    ALA 109           H        ALA 109  24.075   3.766 -33.737
  801    HA   ALA 109           HA       ALA 109  25.367   1.530 -34.930
  802   1HB   ALA 109          HB1       ALA 109  22.568   2.675 -35.353
  803   2HB   ALA 109          HB2       ALA 109  23.134   1.066 -35.813
  804   3HB   ALA 109          HB3       ALA 109  23.035   1.498 -34.098
  805    H    GLN 110           H        GLN 110  26.900   3.364 -35.897
  806    HA   GLN 110           HA       GLN 110  26.231   4.948 -38.074
  807   1HB   GLN 110          HB2       GLN 110  28.679   5.047 -38.428
  808   2HB   GLN 110          HB3       GLN 110  28.194   5.262 -36.753
  809   1HG   GLN 110          HG2       GLN 110  28.708   2.591 -36.655
  810   2HG   GLN 110          HG3       GLN 110  29.732   3.010 -38.019
  811   1HE2  GLN 110          HE22      GLN 110  29.033   3.704 -34.555
  812   2HE2  GLN 110          HE21      GLN 110  30.629   4.323 -34.185
  813    H    GLY 111           H        GLY 111  26.174   4.754 -40.179
  814   1HA   GLY 111          HA1       GLY 111  27.201   2.896 -41.945
  815   2HA   GLY 111          HA2       GLY 111  25.617   2.239 -41.459
  816    H    THR 112           H        THR 112  23.863   4.102 -41.262
  817    HA   THR 112           HA       THR 112  24.187   6.499 -42.724
  818    HB   THR 112           HB       THR 112  23.931   5.051 -44.706
  819    HG1  THR 112           HG1      THR 112  23.021   6.940 -45.083
  820   1HG2  THR 112          HG21      THR 112  21.872   3.830 -45.187
  821   2HG2  THR 112          HG22      THR 112  22.687   3.155 -43.774
  822   3HG2  THR 112          HG23      THR 112  21.251   4.186 -43.566
  823    H    GLU 113           H        GLU 113  22.038   7.743 -42.652
  824    HA   GLU 113           HA       GLU 113  21.147   7.630 -39.950
  825   1HB   GLU 113          HB2       GLU 113  19.636   9.434 -40.545
  826   2HB   GLU 113          HB3       GLU 113  21.254   9.716 -41.187
  827   1HG   GLU 113          HG2       GLU 113  20.472   8.939 -43.440
  828   2HG   GLU 113          HG3       GLU 113  18.848   8.725 -42.783
  829    H    GLU 114           H        GLU 114  19.836   6.226 -42.920
  830    HA   GLU 114           HA       GLU 114  17.301   5.507 -41.804
  831   1HB   GLU 114          HB2       GLU 114  17.744   5.665 -44.220
  832   2HB   GLU 114          HB3       GLU 114  18.849   4.284 -44.124
  833   1HG   GLU 114          HG2       GLU 114  16.993   2.818 -43.439
  834   2HG   GLU 114          HG3       GLU 114  15.890   4.196 -43.388
  835    H    GLU 115           H        GLU 115  20.509   3.982 -41.816
  836    HA   GLU 115           HA       GLU 115  19.587   1.449 -40.780
  837   1HB   GLU 115          HB2       GLU 115  21.672   1.736 -42.133
  838   2HB   GLU 115          HB3       GLU 115  22.385   2.657 -40.808
  839   1HG   GLU 115          HG2       GLU 115  23.228   0.426 -40.727
  840   2HG   GLU 115          HG3       GLU 115  22.190   0.665 -39.334
  841    H    LYS 116           H        LYS 116  21.109   4.428 -39.407
  842    HA   LYS 116           HA       LYS 116  21.027   3.674 -36.682
  843   1HB   LYS 116          HB2       LYS 116  20.754   6.371 -38.068
  844   2HB   LYS 116          HB3       LYS 116  20.723   6.191 -36.303
  845   1HG   LYS 116          HG2       LYS 116  22.957   5.036 -36.443
  846   2HG   LYS 116          HG3       LYS 116  23.001   5.432 -38.176
  847   1HD   LYS 116          HD2       LYS 116  22.766   7.871 -37.553
  848   2HD   LYS 116          HD3       LYS 116  22.831   7.391 -35.843
  849   1HE   LYS 116          HE2       LYS 116  25.062   6.240 -36.410
  850   2HE   LYS 116          HE3       LYS 116  24.993   7.087 -37.967
  851   1HZ   LYS 116          HZ1       LYS 116  25.101   8.308 -35.268
  852   2HZ   LYS 116          HZ2       LYS 116  26.281   8.359 -36.395
  853   3HZ   LYS 116          HZ3       LYS 116  24.900   9.188 -36.649
  854    H    TRP 117           H        TRP 117  18.448   5.299 -38.642
  855    HA   TRP 117           HA       TRP 117  16.526   5.339 -36.578
  856   1HB   TRP 117          HB2       TRP 117  16.200   6.688 -38.503
  857   2HB   TRP 117          HB3       TRP 117  16.379   5.322 -39.595
  858    HD1  TRP 117           HD1      TRP 117  14.245   4.828 -40.755
  859    HE1  TRP 117           HE1      TRP 117  11.788   4.586 -40.159
  860    HE3  TRP 117           HE3      TRP 117  14.476   6.190 -35.820
  861    HZ2  TRP 117           HZ2      TRP 117  10.081   5.015 -37.841
  862    HZ3  TRP 117           HZ3      TRP 117  12.449   6.152 -34.426
  863    HH2  TRP 117           HH2      TRP 117  10.237   5.565 -35.417
  864    H    ALA 118           H        ALA 118  17.371   2.672 -38.843
  865    HA   ALA 118           HA       ALA 118  15.137   1.052 -38.071
  866   1HB   ALA 118          HB1       ALA 118  16.336  -0.763 -39.171
  867   2HB   ALA 118          HB2       ALA 118  16.372   0.700 -40.171
  868   3HB   ALA 118          HB3       ALA 118  17.818   0.218 -39.248
  869    H    PHE 119           H        PHE 119  18.529   1.295 -36.963
  870    HA   PHE 119           HA       PHE 119  18.246  -0.677 -34.929
  871   1HB   PHE 119          HB2       PHE 119  20.284   1.438 -35.520
  872   2HB   PHE 119          HB3       PHE 119  20.260   0.727 -33.913
  873    HD1  PHE 119           HD1      PHE 119  20.263  -1.835 -33.663
  874    HD2  PHE 119           HD2      PHE 119  21.360   0.201 -37.300
  875    HE1  PHE 119           HE1      PHE 119  21.434  -3.874 -34.454
  876    HE2  PHE 119           HE2      PHE 119  22.562  -1.828 -38.074
  877    HZ   PHE 119           HZ       PHE 119  22.592  -3.874 -36.658
  878    H    PHE 120           H        PHE 120  17.464   2.795 -34.890
  879    HA   PHE 120           HA       PHE 120  16.971   2.939 -32.086
  880   1HB   PHE 120          HB2       PHE 120  16.025   4.466 -34.499
  881   2HB   PHE 120          HB3       PHE 120  14.998   4.545 -33.093
  882    HD1  PHE 120           HD1      PHE 120  18.124   5.734 -34.553
  883    HD2  PHE 120           HD2      PHE 120  15.854   5.385 -30.902
  884    HE1  PHE 120           HE1      PHE 120  19.542   7.473 -33.506
  885    HE2  PHE 120           HE2      PHE 120  17.282   7.124 -29.863
  886    HZ   PHE 120           HZ       PHE 120  19.093   8.198 -31.175
  887    H    GLN 121           H        GLN 121  14.757   1.883 -34.719
  888    HA   GLN 121           HA       GLN 121  12.641   1.237 -32.887
  889   1HB   GLN 121          HB2       GLN 121  13.304   0.349 -35.719
  890   2HB   GLN 121          HB3       GLN 121  11.845  -0.177 -34.878
  891   1HG   GLN 121          HG2       GLN 121  10.931   1.987 -34.787
  892   2HG   GLN 121          HG3       GLN 121  12.484   2.781 -35.066
  893   1HE2  GLN 121          HE22      GLN 121  13.486   2.678 -37.181
  894   2HE2  GLN 121          HE21      GLN 121  12.501   2.413 -38.602
  895    H    ARG 122           H        ARG 122  15.388  -0.715 -34.151
  896    HA   ARG 122           HA       ARG 122  14.503  -3.178 -32.974
  897   1HB   ARG 122          HB2       ARG 122  17.325  -2.198 -33.599
  898   2HB   ARG 122          HB3       ARG 122  16.933  -3.846 -33.129
  899   1HG   ARG 122          HG2       ARG 122  15.673  -4.249 -35.140
  900   2HG   ARG 122          HG3       ARG 122  15.721  -2.548 -35.599
  901   1HD   ARG 122          HD2       ARG 122  18.258  -2.737 -35.682
  902   2HD   ARG 122          HD3       ARG 122  18.068  -4.482 -35.505
  903    HE   ARG 122           HE       ARG 122  16.589  -4.312 -37.584
  904   1HH1  ARG 122          HH21      ARG 122  19.470  -2.231 -37.127
  905   2HH1  ARG 122          HH22      ARG 122  19.584  -1.825 -38.810
  906   1HH2  ARG 122          HH11      ARG 122  16.888  -3.847 -39.829
  907   2HH2  ARG 122          HH12      ARG 122  18.180  -2.815 -40.329
  908    H    VAL 123           H        VAL 123  16.753  -0.627 -31.680
  909    HA   VAL 123           HA       VAL 123  17.165  -2.088 -29.239
  910    HB   VAL 123           HB       VAL 123  17.673   0.809 -30.035
  911   1HG1  VAL 123          HG11      VAL 123  18.508  -0.699 -27.517
  912   2HG1  VAL 123          HG12      VAL 123  19.263   0.806 -28.068
  913   3HG1  VAL 123          HG13      VAL 123  17.554   0.799 -27.623
  914   1HG2  VAL 123          HG21      VAL 123  19.017  -0.957 -31.255
  915   2HG2  VAL 123          HG22      VAL 123  20.005   0.091 -30.242
  916   3HG2  VAL 123          HG23      VAL 123  19.596  -1.545 -29.689
  917    H    ARG 124           H        ARG 124  14.841   0.464 -30.254
  918    HA   ARG 124           HA       ARG 124  13.555   0.926 -27.774
  919   1HB   ARG 124          HB2       ARG 124  13.057   2.288 -29.686
  920   2HB   ARG 124          HB3       ARG 124  12.731   0.899 -30.679
  921   1HG   ARG 124          HG2       ARG 124  10.720   0.683 -28.777
  922   2HG   ARG 124          HG3       ARG 124  10.916   2.420 -28.926
  923   1HD   ARG 124          HD2       ARG 124   9.216   1.587 -30.466
  924   2HD   ARG 124          HD3       ARG 124  10.587   2.245 -31.372
  925    HE   ARG 124           HE       ARG 124  11.165  -0.442 -31.186
  926   1HH1  ARG 124          HH21      ARG 124   8.484   1.430 -32.542
  927   2HH1  ARG 124          HH22      ARG 124   8.136   0.275 -33.785
  928   1HH2  ARG 124          HH11      ARG 124  10.795  -1.897 -32.870
  929   2HH2  ARG 124          HH12      ARG 124   9.469  -1.681 -33.955
  930    H    ASP 125           H        ASP 125  12.883  -1.589 -30.308
  931    HA   ASP 125           HA       ASP 125  10.706  -2.703 -28.857
  932   1HB   ASP 125          HB2       ASP 125  10.966  -3.096 -31.239
  933   2HB   ASP 125          HB3       ASP 125  12.514  -3.905 -30.993
  934    H    GLU 126           H        GLU 126  14.193  -3.688 -28.996
  935    HA   GLU 126           HA       GLU 126  13.847  -5.958 -27.322
  936   1HB   GLU 126          HB2       GLU 126  16.275  -4.254 -27.960
  937   2HB   GLU 126          HB3       GLU 126  16.334  -5.720 -26.964
  938   1HG   GLU 126          HG2       GLU 126  15.394  -7.052 -28.820
  939   2HG   GLU 126          HG3       GLU 126  15.363  -5.627 -29.852
  940    H    ILE 127           H        ILE 127  14.625  -2.538 -26.520
  941    HA   ILE 127           HA       ILE 127  14.981  -2.904 -23.710
  942    HB   ILE 127           HB       ILE 127  14.109  -0.576 -25.460
  943   1HG1  ILE 127          HG12      ILE 127  16.539  -0.998 -23.670
  944   2HG1  ILE 127          HG13      ILE 127  16.532  -1.361 -25.390
  945   1HG2  ILE 127          HG21      ILE 127  12.935  -0.276 -23.276
  946   2HG2  ILE 127          HG22      ILE 127  14.496  -0.418 -22.443
  947   3HG2  ILE 127          HG23      ILE 127  14.172   0.926 -23.570
  948   1HD1  ILE 127          HD11      ILE 127  15.958   1.082 -25.815
  949   2HD1  ILE 127          HD12      ILE 127  16.288   1.379 -24.091
  950   3HD1  ILE 127          HD13      ILE 127  17.571   0.774 -25.139
  951    H    GLY 128           H        GLY 128  12.031  -2.065 -25.638
  952   1HA   GLY 128          HA1       GLY 128  10.171  -2.045 -23.587
  953   2HA   GLY 128          HA2       GLY 128   9.838  -2.552 -25.259
  954    H    ASN 129           H        ASN 129  11.321  -4.906 -25.450
  955    HA   ASN 129           HA       ASN 129   9.613  -6.782 -24.182
  956   1HB   ASN 129          HB2       ASN 129  12.279  -7.082 -25.612
  957   2HB   ASN 129          HB3       ASN 129  11.544  -8.447 -24.790
  958   1HD2  ASN 129          HD22      ASN 129  11.086  -6.148 -27.467
  959   2HD2  ASN 129          HD21      ASN 129   9.913  -7.124 -28.314
  960    H    ARG 130           H        ARG 130  12.986  -5.828 -23.313
  961    HA   ARG 130           HA       ARG 130  12.946  -7.757 -21.142
  962   1HB   ARG 130          HB2       ARG 130  15.064  -7.095 -22.205
  963   2HB   ARG 130          HB3       ARG 130  14.839  -5.434 -21.648
  964   1HG   ARG 130          HG2       ARG 130  16.420  -6.534 -20.208
  965   2HG   ARG 130          HG3       ARG 130  14.953  -6.204 -19.308
  966   1HD   ARG 130          HD2       ARG 130  14.260  -8.615 -19.647
  967   2HD   ARG 130          HD3       ARG 130  15.894  -8.918 -20.258
  968    HE   ARG 130           HE       ARG 130  15.010  -8.564 -17.513
  969   1HH1  ARG 130          HH11      ARG 130  17.907  -7.949 -19.520
  970   2HH1  ARG 130          HH12      ARG 130  18.930  -7.742 -18.143
  971   1HH2  ARG 130          HH21      ARG 130  16.367  -8.490 -15.799
  972   2HH2  ARG 130          HH22      ARG 130  18.010  -7.903 -15.949
  973    H    LEU 131           H        LEU 131  12.023  -4.314 -21.431
  974    HA   LEU 131           HA       LEU 131  11.846  -3.853 -18.619
  975   1HB   LEU 131          HB2       LEU 131  11.441  -2.274 -20.903
  976   2HB   LEU 131          HB3       LEU 131   9.845  -2.424 -20.223
  977    HG   LEU 131           HG       LEU 131  10.786  -0.487 -19.323
  978   1HD1  LEU 131          HD11      LEU 131   9.580  -1.825 -17.623
  979   2HD1  LEU 131          HD12      LEU 131  11.112  -2.553 -17.125
  980   3HD1  LEU 131          HD13      LEU 131  10.863  -0.831 -16.896
  981   1HD2  LEU 131          HD21      LEU 131  13.233  -1.917 -18.305
  982   2HD2  LEU 131          HD22      LEU 131  13.167  -1.076 -19.873
  983   3HD2  LEU 131          HD23      LEU 131  12.908  -0.182 -18.382
  984    H    LYS 132           H        LYS 132   9.541  -5.102 -21.068
  985    HA   LYS 132           HA       LYS 132   7.301  -5.390 -19.387
  986   1HB   LYS 132          HB2       LYS 132   7.278  -5.663 -21.862
  987   2HB   LYS 132          HB3       LYS 132   8.152  -7.181 -21.707
  988   1HG   LYS 132          HG2       LYS 132   6.313  -8.205 -20.481
  989   2HG   LYS 132          HG3       LYS 132   5.425  -6.665 -20.457
  990   1HD   LYS 132          HD2       LYS 132   5.326  -6.664 -22.922
  991   2HD   LYS 132          HD3       LYS 132   6.220  -8.183 -22.995
  992   1HE   LYS 132          HE2       LYS 132   3.528  -7.850 -21.587
  993   2HE   LYS 132          HE3       LYS 132   3.696  -8.320 -23.280
  994   1HZ   LYS 132          HZ1       LYS 132   4.662  -9.887 -20.946
  995   2HZ   LYS 132          HZ2       LYS 132   3.449 -10.260 -21.961
  996   3HZ   LYS 132          HZ3       LYS 132   4.977 -10.267 -22.521
  997    H    GLU 133           H        GLU 133   9.866  -7.780 -20.156
  998    HA   GLU 133           HA       GLU 133   8.806  -9.690 -18.353
  999   1HB   GLU 133          HB2       GLU 133  11.675  -9.486 -19.337
 1000   2HB   GLU 133          HB3       GLU 133  10.924 -10.859 -18.497
 1001   1HG   GLU 133          HG2       GLU 133   9.192 -10.945 -20.336
 1002   2HG   GLU 133          HG3       GLU 133  10.159  -9.765 -21.223
 1003    H    PHE 134           H        PHE 134  11.207  -7.119 -17.794
 1004    HA   PHE 134           HA       PHE 134  11.922  -7.914 -15.181
 1005   1HB   PHE 134          HB2       PHE 134  13.226  -6.276 -16.344
 1006   2HB   PHE 134          HB3       PHE 134  11.826  -5.252 -16.623
 1007    HD1  PHE 134           HD1      PHE 134  13.944  -6.606 -13.815
 1008    HD2  PHE 134           HD2      PHE 134  11.341  -3.466 -15.203
 1009    HE1  PHE 134           HE1      PHE 134  14.420  -5.287 -11.764
 1010    HE2  PHE 134           HE2      PHE 134  11.870  -2.114 -13.208
 1011    HZ   PHE 134           HZ       PHE 134  13.390  -3.042 -11.453
 1012    H    ALA 135           H        ALA 135   9.113  -6.107 -16.365
 1013    HA   ALA 135           HA       ALA 135   8.239  -5.407 -13.687
 1014   1HB   ALA 135          HB1       ALA 135   6.313  -4.421 -14.876
 1015   2HB   ALA 135          HB2       ALA 135   7.822  -3.965 -15.701
 1016   3HB   ALA 135          HB3       ALA 135   6.795  -5.245 -16.374
 1017    H    GLU 136           H        GLU 136   7.436  -7.817 -16.141
 1018    HA   GLU 136           HA       GLU 136   5.055  -8.723 -14.756
 1019   1HB   GLU 136          HB2       GLU 136   5.041  -8.454 -17.152
 1020   2HB   GLU 136          HB3       GLU 136   6.451  -9.511 -17.336
 1021   1HG   GLU 136          HG2       GLU 136   5.197 -11.457 -16.660
 1022   2HG   GLU 136          HG3       GLU 136   3.805 -10.465 -16.201
 1023    H    THR 137           H        THR 137   8.278 -10.002 -15.490
 1024    HA   THR 137           HA       THR 137   7.609 -12.525 -14.082
 1025    HB   THR 137           HB       THR 137   9.105 -13.673 -15.501
 1026    HG1  THR 137           HG1      THR 137   9.884 -11.098 -16.353
 1027   1HG2  THR 137          HG21      THR 137   8.150 -13.399 -17.695
 1028   2HG2  THR 137          HG22      THR 137   6.865 -13.186 -16.491
 1029   3HG2  THR 137          HG23      THR 137   7.573 -11.769 -17.314
 1030    H    GLY 138           H        GLY 138   9.695  -9.726 -14.039
 1031   1HA   GLY 138          HA1       GLY 138  11.059  -9.029 -12.297
 1032   2HA   GLY 138          HA2       GLY 138  10.966 -10.625 -11.548
 1033    H    LYS 139           H        LYS 139  11.784 -10.606 -14.974
 1034    HA   LYS 139           HA       LYS 139  14.365 -11.777 -14.422
 1035   1HB   LYS 139          HB2       LYS 139  12.918 -10.945 -16.958
 1036   2HB   LYS 139          HB3       LYS 139  14.564 -11.598 -16.972
 1037   1HG   LYS 139          HG2       LYS 139  13.825 -13.705 -15.984
 1038   2HG   LYS 139          HG3       LYS 139  12.193 -13.073 -15.753
 1039   1HD   LYS 139          HD2       LYS 139  12.201 -12.661 -18.325
 1040   2HD   LYS 139          HD3       LYS 139  13.611 -13.734 -18.359
 1041   1HE   LYS 139          HE2       LYS 139  12.206 -15.504 -17.250
 1042   2HE   LYS 139          HE3       LYS 139  10.841 -14.371 -17.252
 1043   1HZ   LYS 139          HZ1       LYS 139  11.049 -14.306 -19.711
 1044   2HZ   LYS 139          HZ2       LYS 139  12.168 -15.501 -19.641
 1045   3HZ   LYS 139          HZ3       LYS 139  10.645 -15.796 -19.140