*HEADER    RNA BINDING PROTEIN/RNA                 09-FEB-17   5X3Z              
*TITLE     SOLUTION STRUCTURE OF MUSASHI1 RBD2 IN COMPLEX WITH RNA               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RNA-BINDING PROTEIN MUSASHI HOMOLOG 1;                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 109-200;                                      
*COMPND   5 SYNONYM: MUSASHI-1;                                                  
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: RNA (5'-R(*GP*UP*AP*GP*U)-3');                             
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   4 ORGANISM_TAXID: 10090;                                               
*SOURCE   5 GENE: MSI1, MSI1H;                                                   
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET15B;                                   
*SOURCE  10 MOL_ID: 2;                                                           
*SOURCE  11 SYNTHETIC: YES;                                                      
*SOURCE  12 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE  13 ORGANISM_TAXID: 10090                                                
*KEYWDS    RNA-BINDING PROTEIN, RRM, RBD, RNA BINDING PROTEIN-RNA COMPLEX        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    R.IWAOKA,T.NAGATA,K.TSUDA,T.IMAI,H.OKANO,N.KOBAYASHI,M.KATAHIRA       
*REVDAT   1   13-DEC-17 5X3Z    0                                                
# Restraints file 1: RST.disang
#
#  chirality for residue 1 atoms:  N C HA2 HA3
 &rst iat=1,8,6,7, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 250., rk3 = 250.,  &end
#
#  chirality for residue 2 atoms:  CA OG HB2 HB3
 &rst iat=12,17,15,16, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=10,19,13,14, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=23,28,26,27, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=21,36,24,25, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=40,45,43,44, &end
#
#  chirality for residue 4 atoms:  CB SD HG2 HG3
 &rst iat=42,48,46,47, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=38,53,41,42, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=57,62,60,61, &end
#
#  chirality for residue 5 atoms:  CB CD HG2 HG3
 &rst iat=59,65,63,64, &end
#
#  chirality for residue 5 atoms:  CD NZ HE2 HE3
 &rst iat=65,71,69,70, &end
#
#  chirality for residue 5 atoms:  CG CE HD2 HD3
 &rst iat=62,68,66,67, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=55,75,58,59, &end
#
#  chirality for residue 6 atoms:  CA CG HB2 HB3
 &rst iat=79,84,82,83, &end
#
#  chirality for residue 6 atoms:  CB CD HG2 HG3
 &rst iat=81,87,85,86, &end
#
#  chirality for residue 6 atoms:  CD NZ HE2 HE3
 &rst iat=87,93,91,92, &end
#
#  chirality for residue 6 atoms:  CG CE HD2 HD3
 &rst iat=84,90,88,89, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=77,97,80,81, &end
#
#  chirality for residue 7 atoms:  CA CG2 CG1 HB
 &rst iat=101,105,109,104, &end
#
#  chirality for residue 7 atoms:  CB CD1 HG12 HG13
 &rst iat=103,112,110,111, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=99,116,102,103, &end
#
#  chirality for residue 8 atoms:  CA CG HB2 HB3
 &rst iat=120,125,123,124, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=118,136,121,122, &end
#
#  chirality for residue 9 atoms:  CA CG1 CG2 HB
 &rst iat=140,144,148,143, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=138,152,141,142, &end
#
#  chirality for residue 10 atoms:  N C HA2 HA3
 &rst iat=154,159,157,158, &end
#
#  chirality for residue 11 atoms:  N C HA2 HA3
 &rst iat=161,166,164,165, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=170,175,173,174, &end
#
#  chirality for residue 12 atoms:  CB CD1 CD2 HG
 &rst iat=172,177,181,176, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=168,185,171,172, &end
#
#  chirality for residue 13 atoms:  CA OG HB2 HB3
 &rst iat=189,194,192,193, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=187,196,190,191, &end
#
#  chirality for residue 14 atoms:  CA CG1 CG2 HB
 &rst iat=200,204,208,203, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=198,212,201,202, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=216,221,219,220, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=214,226,217,218, &end
#
#  chirality for residue 16 atoms:  CA CG2 OG1 HB
 &rst iat=230,234,238,233, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=228,240,231,232, &end
#
#  chirality for residue 17 atoms:  CA CG2 OG1 HB
 &rst iat=244,248,252,247, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=242,254,245,246, &end
#
#  chirality for residue 18 atoms:  CA CG1 CG2 HB
 &rst iat=258,262,266,261, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=256,270,259,260, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=274,279,277,278, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=276,282,280,281, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=272,285,275,276, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=289,294,292,293, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=287,297,290,291, &end
#
#  chirality for residue 21 atoms:  CA CG1 CG2 HB
 &rst iat=301,305,309,304, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=299,313,302,303, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=317,322,320,321, &end
#
#  chirality for residue 22 atoms:  CB CD HG2 HG3
 &rst iat=319,325,323,324, &end
#
#  chirality for residue 22 atoms:  CD NZ HE2 HE3
 &rst iat=325,331,329,330, &end
#
#  chirality for residue 22 atoms:  CG CE HD2 HD3
 &rst iat=322,328,326,327, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=315,335,318,319, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=339,344,342,343, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=337,352,340,341, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=356,361,359,360, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=354,373,357,358, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=377,382,380,381, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=375,393,378,379, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=397,402,400,401, &end
#
#  chirality for residue 26 atoms:  CB CD HG2 HG3
 &rst iat=399,405,403,404, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=395,408,398,399, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=412,417,415,416, &end
#
#  chirality for residue 27 atoms:  CB CD HG2 HG3
 &rst iat=414,420,418,419, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=410,425,413,414, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=429,434,432,433, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=427,445,430,431, &end
#
#  chirality for residue 29 atoms:  N C HA2 HA3
 &rst iat=447,452,450,451, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=456,461,459,460, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=458,464,462,463, &end
#
#  chirality for residue 30 atoms:  CD NZ HE2 HE3
 &rst iat=464,470,468,469, &end
#
#  chirality for residue 30 atoms:  CG CE HD2 HD3
 &rst iat=461,467,465,466, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=454,474,457,458, &end
#
#  chirality for residue 31 atoms:  CA CG1 CG2 HB
 &rst iat=478,482,486,481, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=476,490,479,480, &end
#
#  chirality for residue 32 atoms:  CA CG HB2 HB3
 &rst iat=494,499,497,498, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=492,502,495,496, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=506,511,509,510, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=504,514,507,508, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=516,524,519,520, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=528,533,531,532, &end
#
#  chirality for residue 35 atoms:  CB SD HG2 HG3
 &rst iat=530,536,534,535, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=526,541,529,530, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=545,550,548,549, &end
#
#  chirality for residue 36 atoms:  CB CD1 CD2 HG
 &rst iat=547,552,556,551, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=543,560,546,547, &end
#
#  chirality for residue 37 atoms:  CA CG HB2 HB3
 &rst iat=564,569,567,568, &end
#
#  chirality for residue 37 atoms:  CB SD HG2 HG3
 &rst iat=566,572,570,571, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=562,577,565,566, &end
#
#  chirality for residue 38 atoms:  CA CG HB2 HB3
 &rst iat=581,586,584,585, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=579,597,582,583, &end
#
#  chirality for residue 39 atoms:  CA CG HB2 HB3
 &rst iat=601,606,604,605, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=599,609,602,603, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=613,618,616,617, &end
#
#  chirality for residue 40 atoms:  CB CD HG2 HG3
 &rst iat=615,621,619,620, &end
#
#  chirality for residue 40 atoms:  CD NZ HE2 HE3
 &rst iat=621,627,625,626, &end
#
#  chirality for residue 40 atoms:  CG CE HD2 HD3
 &rst iat=618,624,622,623, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=611,631,614,615, &end
#
#  chirality for residue 41 atoms:  CA CG2 OG1 HB
 &rst iat=635,639,643,638, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=633,645,636,637, &end
#
#  chirality for residue 42 atoms:  CA CG2 OG1 HB
 &rst iat=649,653,657,652, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=647,659,650,651, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=663,668,666,667, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=661,673,664,665, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=677,682,680,681, &end
#
#  chirality for residue 44 atoms:  CB CD HG2 HG3
 &rst iat=679,685,683,684, &end
#
#  chirality for residue 44 atoms:  CG NE HD2 HD3
 &rst iat=682,688,686,687, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=675,697,678,679, &end
#
#  chirality for residue 45 atoms:  CA CG HB2 HB3
 &rst iat=701,706,704,705, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=699,714,702,703, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=718,723,721,722, &end
#
#  chirality for residue 46 atoms:  CB CD HG2 HG3
 &rst iat=720,726,724,725, &end
#
#  chirality for residue 46 atoms:  CG NE HD2 HD3
 &rst iat=723,729,727,728, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=716,738,719,720, &end
#
#  chirality for residue 47 atoms:  N C HA2 HA3
 &rst iat=740,745,743,744, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=749,754,752,753, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=747,765,750,751, &end
#
#  chirality for residue 49 atoms:  N C HA2 HA3
 &rst iat=767,772,770,771, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=776,781,779,780, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=774,792,777,778, &end
#
#  chirality for residue 51 atoms:  CA CG1 CG2 HB
 &rst iat=796,800,804,799, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=794,808,797,798, &end
#
#  chirality for residue 52 atoms:  CA CG2 OG1 HB
 &rst iat=812,816,820,815, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=810,822,813,814, &end
#
#  chirality for residue 53 atoms:  CA CG HB2 HB3
 &rst iat=826,831,829,830, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=824,842,827,828, &end
#
#  chirality for residue 54 atoms:  CA CG HB2 HB3
 &rst iat=846,851,849,850, &end
#
#  chirality for residue 54 atoms:  CB CD HG2 HG3
 &rst iat=848,854,852,853, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=844,857,847,848, &end
#
#  chirality for residue 55 atoms:  CA OG HB2 HB3
 &rst iat=861,866,864,865, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=859,868,862,863, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=872,877,875,876, &end
#
#  chirality for residue 56 atoms:  CB CD HG2 HG3
 &rst iat=874,880,878,879, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=870,883,873,874, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=887,892,890,891, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=885,895,888,889, &end
#
#  chirality for residue 58 atoms:  CA CG2 CG1 HB
 &rst iat=899,903,907,902, &end
#
#  chirality for residue 58 atoms:  CB CD1 HG12 HG13
 &rst iat=901,910,908,909, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=897,914,900,901, &end
#
#  chirality for residue 59 atoms:  CA CG1 CG2 HB
 &rst iat=918,922,926,921, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=916,930,919,920, &end
#
#  chirality for residue 60 atoms:  CA CG HB2 HB3
 &rst iat=934,939,937,938, &end
#
#  chirality for residue 60 atoms:  CB CD HG2 HG3
 &rst iat=936,942,940,941, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=932,945,935,936, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=949,954,952,953, &end
#
#  chirality for residue 61 atoms:  CB CD HG2 HG3
 &rst iat=951,957,955,956, &end
#
#  chirality for residue 61 atoms:  CD NZ HE2 HE3
 &rst iat=957,963,961,962, &end
#
#  chirality for residue 61 atoms:  CG CE HD2 HD3
 &rst iat=954,960,958,959, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=947,967,950,951, &end
#
#  chirality for residue 62 atoms:  CA CG1 CG2 HB
 &rst iat=971,975,979,974, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=969,983,972,973, &end
#
#  chirality for residue 63 atoms:  CA SG HB2 HB3
 &rst iat=987,992,990,991, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=985,994,988,989, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=998,1003,1001,1002, &end
#
#  chirality for residue 64 atoms:  CB CD HG2 HG3
 &rst iat=1000,1006,1004,1005, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=996,1009,999,1000, &end
#
#  chirality for residue 65 atoms:  CA CG2 CG1 HB
 &rst iat=1013,1017,1021,1016, &end
#
#  chirality for residue 65 atoms:  CB CD1 HG12 HG13
 &rst iat=1015,1024,1022,1023, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=1011,1028,1014,1015, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=1032,1037,1035,1036, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1030,1045,1033,1034, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=1049,1054,1052,1053, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1047,1065,1050,1051, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1069,1074,1072,1073, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1067,1082,1070,1071, &end
#
#  chirality for residue 69 atoms:  CA CG HB2 HB3
 &rst iat=1086,1091,1089,1090, &end
#
#  chirality for residue 69 atoms:  CB CD HG2 HG3
 &rst iat=1088,1094,1092,1093, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1084,1097,1087,1088, &end
#
#  chirality for residue 70 atoms:  CA CG2 CG1 HB
 &rst iat=1101,1105,1109,1104, &end
#
#  chirality for residue 70 atoms:  CB CD1 HG12 HG13
 &rst iat=1103,1112,1110,1111, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1099,1116,1102,1103, &end
#
#  chirality for residue 71 atoms:  CA CG HB2 HB3
 &rst iat=1120,1125,1123,1124, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1118,1130,1121,1122, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1134,1139,1137,1138, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1132,1144,1135,1136, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1148,1153,1151,1152, &end
#
#  chirality for residue 73 atoms:  CB CD HG2 HG3
 &rst iat=1150,1156,1154,1155, &end
#
#  chirality for residue 73 atoms:  CD NZ HE2 HE3
 &rst iat=1156,1162,1160,1161, &end
#
#  chirality for residue 73 atoms:  CG CE HD2 HD3
 &rst iat=1153,1159,1157,1158, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1146,1166,1149,1150, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1170,1175,1173,1174, &end
#
#  chirality for residue 74 atoms:  CB SD HG2 HG3
 &rst iat=1172,1178,1176,1177, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1168,1183,1171,1172, &end
#
#  chirality for residue 75 atoms:  CA CG1 CG2 HB
 &rst iat=1187,1191,1195,1190, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1185,1199,1188,1189, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1203,1208,1206,1207, &end
#
#  chirality for residue 76 atoms:  CB CD HG2 HG3
 &rst iat=1205,1211,1209,1210, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1201,1214,1204,1205, &end
#
#  chirality for residue 77 atoms:  CA SG HB2 HB3
 &rst iat=1218,1223,1221,1222, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1216,1225,1219,1220, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1229,1234,1232,1233, &end
#
#  chirality for residue 78 atoms:  CB CD HG2 HG3
 &rst iat=1231,1237,1235,1236, &end
#
#  chirality for residue 78 atoms:  CD NZ HE2 HE3
 &rst iat=1237,1243,1241,1242, &end
#
#  chirality for residue 78 atoms:  CG CE HD2 HD3
 &rst iat=1234,1240,1238,1239, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1227,1247,1230,1231, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1251,1256,1254,1255, &end
#
#  chirality for residue 79 atoms:  CB CD HG2 HG3
 &rst iat=1253,1259,1257,1258, &end
#
#  chirality for residue 79 atoms:  CD NZ HE2 HE3
 &rst iat=1259,1265,1263,1264, &end
#
#  chirality for residue 79 atoms:  CG CE HD2 HD3
 &rst iat=1256,1262,1260,1261, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1249,1269,1252,1253, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1271,1279,1274,1275, &end
#
#  chirality for residue 81 atoms:  CA CG HB2 HB3
 &rst iat=1283,1288,1286,1287, &end
#
#  chirality for residue 81 atoms:  CB CD HG2 HG3
 &rst iat=1285,1291,1289,1290, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1281,1296,1284,1285, &end
#
#  chirality for residue 82 atoms:  CA CG HB2 HB3
 &rst iat=1308,1302,1306,1307, &end
#
#  chirality for residue 82 atoms:  CB CD HG2 HG3
 &rst iat=1305,1299,1303,1304, &end
#
#  chirality for residue 82 atoms:  CG N HD2 HD3
 &rst iat=1302,1298,1300,1301, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1298,1310,1309,1305, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1314,1319,1317,1318, &end
#
#  chirality for residue 83 atoms:  CB CD HG2 HG3
 &rst iat=1316,1322,1320,1321, &end
#
#  chirality for residue 83 atoms:  CD NZ HE2 HE3
 &rst iat=1322,1328,1326,1327, &end
#
#  chirality for residue 83 atoms:  CG CE HD2 HD3
 &rst iat=1319,1325,1323,1324, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1312,1332,1315,1316, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1336,1341,1339,1340, &end
#
#  chirality for residue 84 atoms:  CB CD HG2 HG3
 &rst iat=1338,1344,1342,1343, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1334,1347,1337,1338, &end
#
#  chirality for residue 85 atoms:  CA CG1 CG2 HB
 &rst iat=1351,1355,1359,1354, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1349,1363,1352,1353, &end
#
#  chirality for residue 86 atoms:  CA CG HB2 HB3
 &rst iat=1367,1372,1370,1371, &end
#
#  chirality for residue 86 atoms:  CB SD HG2 HG3
 &rst iat=1369,1375,1373,1374, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1365,1380,1368,1369, &end
#
#  chirality for residue 87 atoms:  CA OG HB2 HB3
 &rst iat=1384,1389,1387,1388, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1382,1391,1385,1386, &end
#
#  chirality for residue 88 atoms:  CA CG HB2 HB3
 &rst iat=1403,1397,1401,1402, &end
#
#  chirality for residue 88 atoms:  CB CD HG2 HG3
 &rst iat=1400,1394,1398,1399, &end
#
#  chirality for residue 88 atoms:  CG N HD2 HD3
 &rst iat=1397,1393,1395,1396, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1393,1405,1404,1400, &end
#
#  chirality for residue 89 atoms:  CA CG2 OG1 HB
 &rst iat=1409,1413,1417,1412, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1407,1419,1410,1411, &end
#
#  chirality for residue 90 atoms:  N C HA2 HA3
 &rst iat=1421,1426,1424,1425, &end
#
#  chirality for residue 91 atoms:  CA OG HB2 HB3
 &rst iat=1430,1435,1433,1434, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1428,1437,1431,1432, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1439,1447,1442,1443, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1451,1456,1454,1455, &end
#
#  chirality for residue 93 atoms:  CB CD HG2 HG3
 &rst iat=1453,1459,1457,1458, &end
#
#  chirality for residue 93 atoms:  CG NE HD2 HD3
 &rst iat=1456,1462,1460,1461, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1449,1471,1452,1453, &end
#
#  chirality for residue 94 atoms:  N C HA2 HA3
 &rst iat=1473,1478,1476,1477, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1482,1487,1485,1486, &end
#
#  chirality for residue 95 atoms:  CB CD HG2 HG3
 &rst iat=1484,1490,1488,1489, &end
#
#  chirality for residue 95 atoms:  CG NE HD2 HD3
 &rst iat=1487,1493,1491,1492, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1480,1502,1483,1484, &end
#
#  chirality for residue 96 atoms:  CA OG HB2 HB3
 &rst iat=1506,1511,1509,1510, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1504,1513,1507,1508, &end
#
#  trans-omega constraint for residue 2
 &rst iat=12,10,8,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 50., rk3=50.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=23,21,19,12, &end
#
#  trans-omega constraint for residue 4
 &rst iat=40,38,36,23, &end
#
#  trans-omega constraint for residue 5
 &rst iat=57,55,53,40, &end
#
#  trans-omega constraint for residue 6
 &rst iat=79,77,75,57, &end
#
#  trans-omega constraint for residue 7
 &rst iat=101,99,97,79, &end
#
#  trans-omega constraint for residue 8
 &rst iat=120,118,116,101, &end
#
#  trans-omega constraint for residue 9
 &rst iat=140,138,136,120, &end
#
#  trans-omega constraint for residue 10
 &rst iat=156,154,152,140, &end
#
#  trans-omega constraint for residue 11
 &rst iat=163,161,159,156, &end
#
#  trans-omega constraint for residue 12
 &rst iat=170,168,166,163, &end
#
#  trans-omega constraint for residue 13
 &rst iat=189,187,185,170, &end
#
#  trans-omega constraint for residue 14
 &rst iat=200,198,196,189, &end
#
#  trans-omega constraint for residue 15
 &rst iat=216,214,212,200, &end
#
#  trans-omega constraint for residue 16
 &rst iat=230,228,226,216, &end
#
#  trans-omega constraint for residue 17
 &rst iat=244,242,240,230, &end
#
#  trans-omega constraint for residue 18
 &rst iat=258,256,254,244, &end
#
#  trans-omega constraint for residue 19
 &rst iat=274,272,270,258, &end
#
#  trans-omega constraint for residue 20
 &rst iat=289,287,285,274, &end
#
#  trans-omega constraint for residue 21
 &rst iat=301,299,297,289, &end
#
#  trans-omega constraint for residue 22
 &rst iat=317,315,313,301, &end
#
#  trans-omega constraint for residue 23
 &rst iat=339,337,335,317, &end
#
#  trans-omega constraint for residue 24
 &rst iat=356,354,352,339, &end
#
#  trans-omega constraint for residue 25
 &rst iat=377,375,373,356, &end
#
#  trans-omega constraint for residue 26
 &rst iat=397,395,393,377, &end
#
#  trans-omega constraint for residue 27
 &rst iat=412,410,408,397, &end
#
#  trans-omega constraint for residue 28
 &rst iat=429,427,425,412, &end
#
#  trans-omega constraint for residue 29
 &rst iat=449,447,445,429, &end
#
#  trans-omega constraint for residue 30
 &rst iat=456,454,452,449, &end
#
#  trans-omega constraint for residue 31
 &rst iat=478,476,474,456, &end
#
#  trans-omega constraint for residue 32
 &rst iat=494,492,490,478, &end
#
#  trans-omega constraint for residue 33
 &rst iat=506,504,502,494, &end
#
#  trans-omega constraint for residue 34
 &rst iat=518,516,514,506, &end
#
#  trans-omega constraint for residue 35
 &rst iat=528,526,524,518, &end
#
#  trans-omega constraint for residue 36
 &rst iat=545,543,541,528, &end
#
#  trans-omega constraint for residue 37
 &rst iat=564,562,560,545, &end
#
#  trans-omega constraint for residue 38
 &rst iat=581,579,577,564, &end
#
#  trans-omega constraint for residue 39
 &rst iat=601,599,597,581, &end
#
#  trans-omega constraint for residue 40
 &rst iat=613,611,609,601, &end
#
#  trans-omega constraint for residue 41
 &rst iat=635,633,631,613, &end
#
#  trans-omega constraint for residue 42
 &rst iat=649,647,645,635, &end
#
#  trans-omega constraint for residue 43
 &rst iat=663,661,659,649, &end
#
#  trans-omega constraint for residue 44
 &rst iat=677,675,673,663, &end
#
#  trans-omega constraint for residue 45
 &rst iat=701,699,697,677, &end
#
#  trans-omega constraint for residue 46
 &rst iat=718,716,714,701, &end
#
#  trans-omega constraint for residue 47
 &rst iat=742,740,738,718, &end
#
#  trans-omega constraint for residue 48
 &rst iat=749,747,745,742, &end
#
#  trans-omega constraint for residue 49
 &rst iat=769,767,765,749, &end
#
#  trans-omega constraint for residue 50
 &rst iat=776,774,772,769, &end
#
#  trans-omega constraint for residue 51
 &rst iat=796,794,792,776, &end
#
#  trans-omega constraint for residue 52
 &rst iat=812,810,808,796, &end
#
#  trans-omega constraint for residue 53
 &rst iat=826,824,822,812, &end
#
#  trans-omega constraint for residue 54
 &rst iat=846,844,842,826, &end
#
#  trans-omega constraint for residue 55
 &rst iat=861,859,857,846, &end
#
#  trans-omega constraint for residue 56
 &rst iat=872,870,868,861, &end
#
#  trans-omega constraint for residue 57
 &rst iat=887,885,883,872, &end
#
#  trans-omega constraint for residue 58
 &rst iat=899,897,895,887, &end
#
#  trans-omega constraint for residue 59
 &rst iat=918,916,914,899, &end
#
#  trans-omega constraint for residue 60
 &rst iat=934,932,930,918, &end
#
#  trans-omega constraint for residue 61
 &rst iat=949,947,945,934, &end
#
#  trans-omega constraint for residue 62
 &rst iat=971,969,967,949, &end
#
#  trans-omega constraint for residue 63
 &rst iat=987,985,983,971, &end
#
#  trans-omega constraint for residue 64
 &rst iat=998,996,994,987, &end
#
#  trans-omega constraint for residue 65
 &rst iat=1013,1011,1009,998, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1032,1030,1028,1013, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1049,1047,1045,1032, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1069,1067,1065,1049, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1086,1084,1082,1069, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1101,1099,1097,1086, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1120,1118,1116,1101, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1134,1132,1130,1120, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1148,1146,1144,1134, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1170,1168,1166,1148, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1187,1185,1183,1170, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1203,1201,1199,1187, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1218,1216,1214,1203, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1229,1227,1225,1218, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1251,1249,1247,1229, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1273,1271,1269,1251, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1283,1281,1279,1273, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1308,1298,1296,1283, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1314,1312,1310,1308, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1336,1334,1332,1314, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1351,1349,1347,1336, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1367,1365,1363,1351, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1384,1382,1380,1367, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1403,1393,1391,1384, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1409,1407,1405,1403, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1423,1421,1419,1409, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1430,1428,1426,1423, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1441,1439,1437,1430, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1451,1449,1447,1441, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1475,1473,1471,1451, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1482,1480,1478,1475, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1506,1504,1502,1482, &end
#
#   5 LYS+   HA   56 GLU-   HA  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  58, 873, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, 
      rk2 = 32.0, rk3 = 32.0, ir6=1, ialtd=0,
 &end
#
#   5 LYS+   HA   59  VAL  QG1  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 923, 924, 925,
 &end
#
#   5 LYS+   HA   59  VAL  QG2  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2= 927, 928, 929,
 &end
#
#   5 LYS+   HA    5 LYS+   QG  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2=  63,  64,
 &end
#
#   5 LYS+  HG2   56 GLU-   QB  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 875, 876,
 &end
#
#   5 LYS+  HG2   56 GLU-   QG  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 878, 879,
 &end
#
#   5 LYS+  HG2    5 LYS+   QE  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2=  69,  70,
 &end
#
#   5 LYS+  HG3   56 GLU-   QB  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 875, 876,
 &end
#
#   5 LYS+  HG3   56 GLU-   QG  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 878, 879,
 &end
#
#   5 LYS+  HG3    5 LYS+   QE  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2=  69,  70,
 &end
#
#   5 LYS+   HN    5 LYS+  HG2  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  63, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#   5 LYS+   HN    5 LYS+  HG3  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  64, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#   5 LYS+   HN    5 LYS+   QG  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=  63,  64,
 &end
#
#   5 LYS+   HN    6 LYS+   HN  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  78, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   5 LYS+   QB   52  THR  QG2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1=  60,  61,
 igr2= 817, 818, 819,
 &end
#
#   5 LYS+   QB   53  PHE  HB2  1.80 4.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1=  60,  61,
 &end
#
#   5 LYS+   QB   53  PHE   HN  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=  60,  61,
 &end
#
#   5 LYS+   QB   59  VAL  QG2  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1=  60,  61,
 igr2= 927, 928, 929,
 &end
#
#   5 LYS+   QD   53  PHE   HN  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1=  66,  67,
 &end
#
#   5 LYS+   QD   56 GLU-   HA  1.80 4.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 873, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1=  66,  67,
 &end
#
#   5 LYS+   QD   56 GLU-   QG  1.80 4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1=  66,  67,
 igr2= 878, 879,
 &end
#
#   5 LYS+   QE   56 GLU-   HN  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 871, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1=  69,  70,
 &end
#
#   5 LYS+   QE   56 GLU-   QB  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=  69,  70,
 igr2= 875, 876,
 &end
#
#   5 LYS+   QG   56 GLU-   HA  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 873, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1=  63,  64,
 &end
#
#   5 LYS+   QG   56 GLU-   QB  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1=  63,  64,
 igr2= 875, 876,
 &end
#
#   5 LYS+   QG   56 GLU-   QG  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1=  63,  64,
 igr2= 878, 879,
 &end
#
#   5 LYS+   QG    5 LYS+   QE  1.80 3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1=  63,  64,
 igr2=  69,  70,
 &end
#
#   6 LYS+   HA   52  THR   HA  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 813, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#   6 LYS+   HA   52  THR  QG2  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 817, 818, 819,
 &end
#
#   6 LYS+   HA   53  PHE   HN  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 825, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   6 LYS+   HA    6 LYS+   QD  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2=  88,  89,
 &end
#
#   6 LYS+   HA    6 LYS+   QG  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2=  85,  86,
 &end
#
#   6 LYS+   HA    7  ILE   HN  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 100, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#   6 LYS+   HA    7  ILE  QG2  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2= 106, 107, 108,
 &end
#
#   6 LYS+   HA   80  ALA   QB  1.80 4.96
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+  HB2   80  ALA   QB  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  82,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+  HB3   80  ALA   QB  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+   HN   59  VAL  QG1  1.80 4.80
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 923, 924, 925,
 &end
#
#   6 LYS+   HN   59  VAL  QG2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 927, 928, 929,
 &end
#
#   6 LYS+   HN    6 LYS+  HB2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  82, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   6 LYS+   HN    6 LYS+  HB3  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  83, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   6 LYS+   HN    6 LYS+   QB  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2=  82,  83,
 &end
#
#   6 LYS+   HN   80  ALA   QB  1.80 4.89
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+   QB    6 LYS+   QD  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1=  82,  83,
 igr2=  88,  89,
 &end
#
#   6 LYS+   QB    7  ILE   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1=  82,  83,
 &end
#
#   6 LYS+   QB   80  ALA   QB  1.80 3.20
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr1=  82,  83,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+   QE   50  PHE   QB  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1=  91,  92,
 igr2= 779, 780,
 &end
#
#   6 LYS+   QE   50  PHE   QD  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=  91,  92,
 igr2= 783, 791,
 &end
#
#   6 LYS+   QE   80  ALA   QB  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1=  91,  92,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+   QG   50  PHE   HA  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG   50  PHE   QB  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1=  85,  86,
 igr2= 779, 780,
 &end
#
#   6 LYS+   QG   50  PHE   QD  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1=  85,  86,
 igr2= 783, 791,
 &end
#
#   6 LYS+   QG   51  VAL   HN  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG   52  THR   HA  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 813, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG   52  THR   HN  1.80 4.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG    6 LYS+   QE  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=  85,  86,
 igr2=  91,  92,
 &end
#
#   6 LYS+   QG    7  ILE   HN  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG   80  ALA   QB  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1=  85,  86,
 igr2=1276,1277,1278,
 &end
#
#   7  ILE   HA   59  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 927, 928, 929,
 &end
#
#   7  ILE   HA   79 LYS+   HA  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat= 102,1252, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   7  ILE   HA    7  ILE  QD1  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 113, 114, 115,
 &end
#
#   7  ILE   HA    7  ILE  QG2  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 106, 107, 108,
 &end
#
#   7  ILE   HA   80  ALA   HN  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 102,1272, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   7  ILE   HA   80  ALA   QB  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2=1276,1277,1278,
 &end
#
#   7  ILE   HA    8  PHE   HN  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 102, 119, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#   7  ILE   HB   78 LYS+   HN  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 104,1228, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#   7  ILE   HB    7  ILE  QD1  1.80 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 113, 114, 115,
 &end
#
#   7  ILE   HB   80  ALA   HN  1.80 4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 104,1272, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   7  ILE   HB    8  PHE  HB3  1.80 5.24
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 124, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#   7  ILE   HB    8  PHE   HN  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 119, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#   7  ILE HG12   51  VAL   HN  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 795, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   7  ILE HG12   53  PHE   QE  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 835, 839,
 &end
#
#   7  ILE HG13   51  VAL   HN  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 111, 795, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   7  ILE HG13   53  PHE   QE  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 835, 839,
 &end
#
#   7  ILE   HN   51  VAL   HN  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 100, 795, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#   7  ILE   HN    7  ILE HG12  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat= 100, 110, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   7  ILE   HN    7  ILE HG13  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat= 100, 111, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   7  ILE   HN    7  ILE  QD1  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 113, 114, 115,
 &end
#
#   7  ILE   HN    7  ILE  QG1  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 110, 111,
 &end
#
#   7  ILE   HN    7  ILE  QG2  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 106, 107, 108,
 &end
#
#   7  ILE   HN   80  ALA   QB  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2=1276,1277,1278,
 &end
#
#   7  ILE  QD1   25  PHE  HB3  1.80 4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   25  PHE   QD  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 113, 114, 115,
 igr2= 384, 392,
 &end
#
#   7  ILE  QD1   25  PHE   QE  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 113, 114, 115,
 igr2= 386, 390,
 &end
#
#   7  ILE  QD1   51  VAL   HB  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   51  VAL   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   53  PHE   HZ  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   53  PHE   QD  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 113, 114, 115,
 igr2= 833, 841,
 &end
#
#   7  ILE  QD1   53  PHE   QE  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 113, 114, 115,
 igr2= 835, 839,
 &end
#
#   7  ILE  QD1   59  VAL   HA  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   62  VAL   HB  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 974, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   62  VAL  QG1  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1= 113, 114, 115,
 igr2= 976, 977, 978,
 &end
#
#   7  ILE  QD1   62  VAL  QG2  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 113, 114, 115,
 igr2= 980, 981, 982,
 &end
#
#   7  ILE  QD1   77  CYS   HA  1.80 4.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   77  CYS  HB2  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1221, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   77  CYS  HB3  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1222, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   77  CYS   QB  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 113, 114, 115,
 igr2=1221,1222,
 &end
#
#   7  ILE  QD1    9  VAL  QG2  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
 igr1= 113, 114, 115,
 igr2= 149, 150, 151,
 &end
#
#   7  ILE  QG1   50  PHE   HA  1.80 5.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 110, 111,
 &end
#
#   7  ILE  QG1   51  VAL   HB  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr1= 110, 111,
 &end
#
#   7  ILE  QG1   51  VAL   HN  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 110, 111,
 &end
#
#   7  ILE  QG1   51  VAL  QG1  1.80 3.92
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 110, 111,
 igr2= 801, 802, 803,
 &end
#
#   7  ILE  QG1   53  PHE   QD  1.80 4.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 110, 111,
 igr2= 833, 841,
 &end
#
#   7  ILE  QG1   53  PHE   QE  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 110, 111,
 igr2= 835, 839,
 &end
#
#   7  ILE  QG1    9  VAL  QG2  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
 igr1= 110, 111,
 igr2= 149, 150, 151,
 &end
#
#   7  ILE  QG2   53  PHE   HZ  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   53  PHE   QD  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr1= 106, 107, 108,
 igr2= 833, 841,
 &end
#
#   7  ILE  QG2   53  PHE   QE  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 106, 107, 108,
 igr2= 835, 839,
 &end
#
#   7  ILE  QG2   59  VAL   HA  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   59  VAL   HB  1.80 4.94
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 921, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   62  VAL   HB  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 974, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   77  CYS   HA  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   77  CYS  HB2  1.80 4.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1221, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   77  CYS  HB3  1.80 4.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1222, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   77  CYS   QB  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 106, 107, 108,
 igr2=1221,1222,
 &end
#
#   7  ILE  QG2   79 LYS+   HA  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1252, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   79 LYS+   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1250, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2    7  ILE HG12  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2    7  ILE HG13  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 111, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2    7  ILE  QD1  1.80 2.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 106, 107, 108,
 igr2= 113, 114, 115,
 &end
#
#   7  ILE  QG2   80  ALA   HN  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2    8  PHE   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 106, 107, 108,
 &end
#
#   8  PHE   HA   50  PHE   HA  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 777, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   8  PHE   HA   50  PHE   QD  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2= 783, 791,
 &end
#
#   8  PHE   HA    8  PHE   QD  1.80 4.86
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 127, 135,
 &end
#
#   8  PHE   HA    9  VAL   HN  1.80 3.11
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 139, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#   8  PHE   HA    9  VAL  QG2  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 149, 150, 151,
 &end
#
#   8  PHE  HB2   50  PHE   QD  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 783, 791,
 &end
#
#   8  PHE  HB2   50  PHE   QE  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 785, 789,
 &end
#
#   8  PHE  HB2   78 LYS+   QG  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1235,1236,
 &end
#
#   8  PHE  HB2   80  ALA   HA  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 123,1274, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#   8  PHE  HB2   80  ALA   QB  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2=1276,1277,1278,
 &end
#
#   8  PHE  HB3   50  PHE   QE  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 785, 789,
 &end
#
#   8  PHE  HB3   78 LYS+   HN  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 124,1228, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   8  PHE  HB3   78 LYS+   QB  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2=1232,1233,
 &end
#
#   8  PHE  HB3   78 LYS+   QG  1.80 5.04
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2=1235,1236,
 &end
#
#   8  PHE   HN   80  ALA   HN  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 119,1272, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#   8  PHE   HN   80  ALA   QB  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2=1276,1277,1278,
 &end
#
#   8  PHE   HN    8  PHE  HB2  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 123, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#   8  PHE   HN    8  PHE  HB3  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 124, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   8  PHE   HN    8  PHE   QD  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 127, 135,
 &end
#
#   8  PHE   QD   10  GLY   HN  1.80 5.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
 igr1= 127, 135,
 &end
#
#   8  PHE   QD   48  PHE   QD  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 127, 135,
 igr2= 756, 764,
 &end
#
#   8  PHE   QD   50  PHE   QD  1.80 5.33
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
 igr1= 127, 135,
 igr2= 783, 791,
 &end
#
#   8  PHE   QD   50  PHE   QE  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 127, 135,
 igr2= 785, 789,
 &end
#
#   8  PHE   QD   78 LYS+   HN  1.80 4.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 127, 135,
 &end
#
#   8  PHE   QD   78 LYS+   QB  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 127, 135,
 igr2=1232,1233,
 &end
#
#   8  PHE   QD   78 LYS+   QE  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1= 127, 135,
 igr2=1241,1242,
 &end
#
#   8  PHE   QD   78 LYS+   QG  1.80 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 127, 135,
 igr2=1235,1236,
 &end
#
#   8  PHE   QE   10  GLY   QA  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1= 129, 133,
 igr2= 157, 158,
 &end
#
#   8  PHE   QE   48  PHE  HB2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 129, 133,
 &end
#
#   8  PHE   QE   48  PHE  HB3  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 753, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 129, 133,
 &end
#
#   8  PHE   QE   48  PHE   QB  1.80 4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 129, 133,
 igr2= 752, 753,
 &end
#
#   8  PHE   QE   78 LYS+   QE  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 129, 133,
 igr2=1241,1242,
 &end
#
#   9  VAL   HA   77  CYS   HA  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 141,1219, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#   9  VAL   HA    9  VAL  QG1  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 145, 146, 147,
 &end
#
#   9  VAL   HA    9  VAL  QG2  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 149, 150, 151,
 &end
#
#   9  VAL   HB   10  GLY   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 143, 155, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#   9  VAL   HB   21  VAL  QG1  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 306, 307, 308,
 &end
#
#   9  VAL   HB   21  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 310, 311, 312,
 &end
#
#   9  VAL   HB   49  GLY   HN  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 143, 768, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#   9  VAL   HB   50  PHE   HA  1.80 5.05
 &rst
  ixpk= 0, nxpk= 0, iat= 143, 777, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#   9  VAL   HN   49  GLY   HN  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 768, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#   9  VAL   HN   50  PHE   HA  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 777, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#   9  VAL   HN    9  VAL   HB  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 143, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#   9  VAL   HN    9  VAL  QG1  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 139,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 145, 146, 147,
 &end
#
#   9  VAL   HN    9  VAL  QG2  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat= 139,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2= 149, 150, 151,
 &end
#
#   9  VAL  QG1   10  GLY   HN  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 145, 146, 147,
 &end
#
#   9  VAL  QG1   25  PHE   QE  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 145, 146, 147,
 igr2= 386, 390,
 &end
#
#   9  VAL  QG1   49  GLY   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 145, 146, 147,
 &end
#
#   9  VAL  QG1   77  CYS   HA  1.80 4.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 145, 146, 147,
 &end
#
#   9  VAL  QG2   10  GLY   HN  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   25  PHE   QE  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 149, 150, 151,
 igr2= 386, 390,
 &end
#
#   9  VAL  QG2   49  GLY   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   50  PHE   HA  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   51  VAL   HA  1.80 5.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 797, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   51  VAL   HB  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   51  VAL   HN  1.80 4.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   77  CYS   HA  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   77  CYS  HB2  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1221, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   77  CYS  HB3  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1222, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 149, 150, 151,
 &end
#
#  10  GLY   HN   77  CYS   HA  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 155,1219, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  10  GLY   QA   11  GLY   HN  1.80 3.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 162, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr1= 157, 158,
 &end
#
#  10  GLY   QA   12  LEU   HN  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 157, 158,
 &end
#
#  10  GLY   QA   48  PHE   HA  1.80 4.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 157, 158,
 &end
#
#  11  GLY   HN   12  LEU   HG  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 176, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  11  GLY   HN   12  LEU   HN  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 169, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#  11  GLY   HN   48  PHE   HA  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 750, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  12  LEU   HA   12  LEU   HG  1.80 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 171, 176, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  12  LEU   HA   12  LEU  QD1  1.80 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 178, 179, 180,
 &end
#
#  12  LEU   HA   12  LEU  QD2  1.80 3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 182, 183, 184,
 &end
#
#  12  LEU   HA   13  SER   HN  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 171, 188, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  12  LEU   HA   75  VAL  QG1  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2=1192,1193,1194,
 &end
#
#  12  LEU  HB2   12  LEU  QD1  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2= 178, 179, 180,
 &end
#
#  12  LEU  HB2   45 HIS   HE1  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 173, 709, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  12  LEU  HB3   12  LEU  QD1  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 174,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2= 178, 179, 180,
 &end
#
#  12  LEU  HB3   45 HIS   HE1  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 174, 709, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  12  LEU   HG   13  SER   HN  1.80 5.46
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 188, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  12  LEU   HG   48  PHE   HA  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 750, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  12  LEU   HG   70  ILE  QD1  1.80 4.87
 &rst
  ixpk= 0, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2=1113,1114,1115,
 &end
#
#  12  LEU   HG   75  VAL  QG1  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2=1192,1193,1194,
 &end
#
#  12  LEU   HN   12  LEU  HB2  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 173, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  12  LEU   HN   12  LEU  HB3  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 174, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  12  LEU   HN   12  LEU   HG  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 176, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  12  LEU   HN   12  LEU   QB  1.80 3.42
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 173, 174,
 &end
#
#  12  LEU   HN   12  LEU  QD1  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 178, 179, 180,
 &end
#
#  12  LEU   HN   12  LEU  QD2  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 182, 183, 184,
 &end
#
#  12  LEU   HN   47  GLY   QA  1.80 4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 743, 744,
 &end
#
#  12  LEU   HN   48  PHE   HA  1.80 5.12
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 750, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#  12  LEU   HN   75  VAL  QG1  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=1192,1193,1194,
 &end
#
#  12  LEU   QB   12  LEU  QD2  1.80 3.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1= 173, 174,
 igr2= 182, 183, 184,
 &end
#
#  12  LEU   QB   13  SER   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 173, 174,
 &end
#
#  12  LEU   QB   16  THR   HB  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 173, 174,
 &end
#
#  12  LEU   QB   45 HIS   HE1  1.80 3.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 709, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr1= 173, 174,
 &end
#
#  12  LEU   QB   47  GLY   QA  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 173, 174,
 igr2= 743, 744,
 &end
#
#  12  LEU   QB   48  PHE   HN  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 173, 174,
 &end
#
#  12  LEU  QD1   16  THR  QG2  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 178, 179, 180,
 igr2= 235, 236, 237,
 &end
#
#  12  LEU  QD1   21  VAL  QG2  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 178, 179, 180,
 igr2= 310, 311, 312,
 &end
#
#  12  LEU  QD1   45 HIS   HE1  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 709, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 178, 179, 180,
 &end
#
#  12  LEU  QD1   48  PHE   HA  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 178, 179, 180,
 &end
#
#  12  LEU  QD1   48  PHE   HN  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 178, 179, 180,
 &end
#
#  12  LEU  QD1   49  GLY   HN  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1= 178, 179, 180,
 &end
#
#  12  LEU  QD2   13  SER   HN  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 182, 183, 184,
 &end
#
#  12  LEU  QD2   16  THR   HB  1.80 4.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 182, 183, 184,
 &end
#
#  12  LEU  QD2   16  THR  QG2  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 182, 183, 184,
 igr2= 235, 236, 237,
 &end
#
#  12  LEU  QD2   21  VAL  QG2  1.80 2.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1= 182, 183, 184,
 igr2= 310, 311, 312,
 &end
#
#  12  LEU  QD2   70  ILE   HB  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1104, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 182, 183, 184,
 &end
#
#  12  LEU  QD2   70  ILE  QD1  1.80 3.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 182, 183, 184,
 igr2=1113,1114,1115,
 &end
#
#  12  LEU  QD2   75  VAL   HB  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1190, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 182, 183, 184,
 &end
#
#  12  LEU  QD2   75  VAL  QG1  1.80 2.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr1= 182, 183, 184,
 igr2=1192,1193,1194,
 &end
#
#  13  SER   HA   14  VAL   HN  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 190, 199, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  13  SER   HN   13  SER  HB2  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 192, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#  13  SER   HN   13  SER  HB3  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 193, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#  13  SER   HN   13  SER   QB  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr2= 192, 193,
 &end
#
#  13  SER   HN   14  VAL   HN  3.50 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 199, r1= 3.00, r2= 3.50, r3=100.00, r4=100.50,  &end
#
#  13  SER   HN   16  THR   HB  1.80 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 233, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#  13  SER   HN   16  THR  HG1  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 239, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  13  SER   HN   16  THR  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 235, 236, 237,
 &end
#
#  13  SER   HN   70  ILE  QG2  1.80 5.28
 &rst
  ixpk= 0, nxpk= 0, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
 igr2=1106,1107,1108,
 &end
#
#  13  SER   HN   75  VAL  QG1  1.80 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2=1192,1193,1194,
 &end
#
#  13  SER   QB   14  VAL   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 192, 193,
 &end
#
#  13  SER   QB   15  ASN   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 192, 193,
 &end
#
#  13  SER   QB   73 LYS+   QB  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 192, 193,
 igr2=1151,1152,
 &end
#
#  13  SER   QB   73 LYS+   QD  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 192, 193,
 igr2=1157,1158,
 &end
#
#  13  SER   QB   73 LYS+   QG  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 192, 193,
 igr2=1154,1155,
 &end
#
#  14  VAL   HA   14  VAL  QG1  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 205, 206, 207,
 &end
#
#  14  VAL   HA   14  VAL  QG2  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 209, 210, 211,
 &end
#
#  14  VAL   HA   15  ASN   HN  2.80 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 215, r1= 2.30, r2= 2.80, r3=100.00, r4=100.50,  &end
#
#  14  VAL   HA   45 HIS   HE1  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 709, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  14  VAL   HB   15  ASN   HN  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 203, 215, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  14  VAL   HN   14  VAL   HA  2.80 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 201, r1= 2.30, r2= 2.80, r3=100.00, r4=100.50,  &end
#
#  14  VAL   HN   14  VAL  QG1  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 205, 206, 207,
 &end
#
#  14  VAL   HN   14  VAL  QG2  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 209, 210, 211,
 &end
#
#  14  VAL   HN   14  VAL  QQG  1.80 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 205, 206, 207, 209, 210, 211,
 &end
#
#  14  VAL   HN   15  ASN   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 215, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  14  VAL  QG1   15  ASN   HN  1.80 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 205, 206, 207,
 &end
#
#  14  VAL  QG1   16  THR   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 229, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 205, 206, 207,
 &end
#
#  14  VAL  QG2   15  ASN   HN  1.80 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 209, 210, 211,
 &end
#
#  14  VAL  QG2   16  THR   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 229, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 209, 210, 211,
 &end
#
#  14  VAL  QQG   15  ASN   HN  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 205, 206, 207, 209, 210, 211,
 &end
#
#  14  VAL  QQG   15  ASN   QB  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
 igr1= 205, 206, 207, 209, 210, 211,
 igr2= 219, 220,
 &end
#
#  14  VAL  QQG   16  THR   HN  1.80 4.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 229, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr1= 205, 206, 207, 209, 210, 211,
 &end
#
#  14  VAL  QQG   44 ARG+   QD  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1= 205, 206, 207, 209, 210, 211,
 igr2= 686, 687,
 &end
#
#  15  ASN   HA   15  ASN HD21  1.80 4.98
 &rst
  ixpk= 0, nxpk= 0, iat= 217, 224, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  15  ASN   HA   15  ASN HD22  1.80 4.98
 &rst
  ixpk= 0, nxpk= 0, iat= 217, 225, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  15  ASN   HA   15  ASN  QD2  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 217,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 224, 225,
 &end
#
#  15  ASN  HB2   16  THR   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 219, 229, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15  ASN  HB3   16  THR   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 229, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15  ASN   HN   15  ASN   QB  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 215,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 219, 220,
 &end
#
#  15  ASN   HN   16  THR  HG1  1.80 5.05
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#  15  ASN   HN   16  THR   HN  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 229, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  16  THR   HA   16  THR  QG2  1.80 3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 231,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 235, 236, 237,
 &end
#
#  16  THR   HA   17  THR   HN  1.80 3.02
 &rst
  ixpk= 0, nxpk= 0, iat= 231, 243, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#  16  THR   HA   17  THR  QG2  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 231,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 249, 250, 251,
 &end
#
#  16  THR   HA   71  ASN HD21  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat= 231,1128, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#  16  THR   HA   71  ASN HD22  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 231,1129, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  16  THR   HB   17  THR   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 233, 243, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  16  THR   HB   21  VAL  QG2  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 310, 311, 312,
 &end
#
#  16  THR   HB   71  ASN HD21  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 233,1128, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  16  THR   HB   71  ASN HD22  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 233,1129, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  16  THR  HG1   71  ASN HD21  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat= 239,1128, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#  16  THR   HN   16  THR   HB  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 229, 233, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#  16  THR   HN   16  THR  HG1  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 229, 239, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  16  THR   HN   16  THR  QG2  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 229,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 235, 236, 237,
 &end
#
#  16  THR   HN   71  ASN HD21  1.80 5.16
 &rst
  ixpk= 0, nxpk= 0, iat= 229,1128, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#  16  THR  QG2   17  THR   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   18  VAL   HA  1.80 5.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 259, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   20 ASP-   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   20 ASP-   QB  1.80 3.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr1= 235, 236, 237,
 igr2= 292, 293,
 &end
#
#  16  THR  QG2   21  VAL   HA  1.80 4.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 302, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   21  VAL   HB  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   21  VAL   HN  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 300, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   21  VAL  QG2  1.80 2.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 235, 236, 237,
 igr2= 310, 311, 312,
 &end
#
#  16  THR  QG2   36  LEU  QD1  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 235, 236, 237,
 igr2= 553, 554, 555,
 &end
#
#  16  THR  QG2   36  LEU  QD2  1.80 4.86
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
 igr1= 235, 236, 237,
 igr2= 557, 558, 559,
 &end
#
#  16  THR  QG2   70  ILE  QD1  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
 igr1= 235, 236, 237,
 igr2=1113,1114,1115,
 &end
#
#  16  THR  QG2   70  ILE  QG2  1.80 3.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr1= 235, 236, 237,
 igr2=1106,1107,1108,
 &end
#
#  16  THR  QG2   71  ASN  HB2  1.80 4.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   71  ASN  HB3  1.80 5.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1124, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   71  ASN HD21  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1128, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   71  ASN HD22  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 235, 236, 237,
 &end
#
#  17  THR   HA   17  THR  QG2  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2= 249, 250, 251,
 &end
#
#  17  THR   HA   18  VAL   HB  1.80 5.35
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 261, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#  17  THR   HA   18  VAL   HN  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 257, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  17  THR   HA   36  LEU  QD1  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 553, 554, 555,
 &end
#
#  17  THR   HN   17  THR  QG2  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 243,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2= 249, 250, 251,
 &end
#
#  17  THR   HN   20 ASP-  HB2  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 292, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  17  THR   HN   20 ASP-  HB3  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 293, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  17  THR   HN   20 ASP-   HN  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 288, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  17  THR   HN   20 ASP-   QB  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat= 243,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 292, 293,
 &end
#
#  17  THR   HN   71  ASN HD22  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 243,1129, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  17  THR  QG2   18  VAL   HN  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 257, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 249, 250, 251,
 &end
#
#  17  THR  QG2   19 GLU-   HN  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 249, 250, 251,
 &end
#
#  17  THR  QG2   20 ASP-   HN  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 249, 250, 251,
 &end
#
#  17  THR  QG2   21  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 249, 250, 251,
 igr2= 310, 311, 312,
 &end
#
#  18  VAL   HA   18  VAL  QG2  1.80 2.95
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2= 267, 268, 269,
 &end
#
#  18  VAL   HA   21  VAL   HB  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 304, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  18  VAL   HA   21  VAL  QG2  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 310, 311, 312,
 &end
#
#  18  VAL   HA   22 LYS+   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 316, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#  18  VAL   HA   34  ALA   QB  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2= 521, 522, 523,
 &end
#
#  18  VAL   HA   36  LEU   HG  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 551, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#  18  VAL   HA   36  LEU  QD1  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2= 553, 554, 555,
 &end
#
#  18  VAL   HA   36  LEU  QD2  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 557, 558, 559,
 &end
#
#  18  VAL   HB   19 GLU-   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 273, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  18  VAL   HB   35  MET   HA  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 529, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  18  VAL   HB   36  LEU   HG  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 551, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  18  VAL   HB   36  LEU   HN  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 544, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  18  VAL   HB   36  LEU   QB  1.80 4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 548, 549,
 &end
#
#  18  VAL   HB   36  LEU  QD1  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 553, 554, 555,
 &end
#
#  18  VAL   HB   36  LEU  QD2  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 557, 558, 559,
 &end
#
#  18  VAL   HN   18  VAL   HB  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 261, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
#  18  VAL   HN   18  VAL  QG1  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 263, 264, 265,
 &end
#
#  18  VAL   HN   18  VAL  QG2  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 267, 268, 269,
 &end
#
#  18  VAL   HN   19 GLU-   HN  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 273, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#  18  VAL   HN   20 ASP-   HN  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 288, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  18  VAL   HN   21  VAL   HB  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 304, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  18  VAL   HN   36  LEU  QD1  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 553, 554, 555,
 &end
#
#  18  VAL   HN   36  LEU  QD2  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 557, 558, 559,
 &end
#
#  18  VAL  QG1   19 GLU-   HA  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG1   19 GLU-  HG2  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 280, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG1   19 GLU-  HG3  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 281, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG1   19 GLU-   HN  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG1   19 GLU-   QG  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 263, 264, 265,
 igr2= 280, 281,
 &end
#
#  18  VAL  QG1   34  ALA   QB  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 263, 264, 265,
 igr2= 521, 522, 523,
 &end
#
#  18  VAL  QG1   36  LEU   HN  1.80 4.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG2   19 GLU-   HN  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   21  VAL   HB  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   21  VAL   HN  1.80 4.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 300, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   22 LYS+  HB2  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 320, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   22 LYS+   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   22 LYS+   QD  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 267, 268, 269,
 igr2= 326, 327,
 &end
#
#  18  VAL  QG2   34  ALA   HN  1.80 4.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 517, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   34  ALA   QB  1.80 2.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr1= 267, 268, 269,
 igr2= 521, 522, 523,
 &end
#
#  18  VAL  QG2   35  MET   HA  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 529, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   35  MET   HN  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 527, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   36  LEU   HG  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   36  LEU   HN  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   36  LEU  QD1  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 267, 268, 269,
 igr2= 553, 554, 555,
 &end
#
#  18  VAL  QG2   36  LEU  QD2  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr1= 267, 268, 269,
 igr2= 557, 558, 559,
 &end
#
#  19 GLU-   HA   19 GLU-  HG2  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 280, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  19 GLU-   HA   19 GLU-  HG3  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 281, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  19 GLU-   HA   19 GLU-   QG  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 280, 281,
 &end
#
#  19 GLU-   HA   21  VAL   HN  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 300, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  19 GLU-   HA   22 LYS+  HB2  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 320, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  19 GLU-   HA   22 LYS+  HB3  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 321, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  19 GLU-   HA   22 LYS+   HN  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 316, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  19 GLU-   HA   22 LYS+   QD  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 326, 327,
 &end
#
#  19 GLU-   HA   22 LYS+   QG  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr2= 323, 324,
 &end
#
#  19 GLU-   HA   23 HIS    HN  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 338, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  19 GLU-   HA   34  ALA   QB  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 521, 522, 523,
 &end
#
#  19 GLU-  HB2   20 ASP-   HN  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 288, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  19 GLU-  HB3   20 ASP-   HN  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 288, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  19 GLU-   HN   19 GLU-  HB2  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 277, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  19 GLU-   HN   19 GLU-  HB3  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 278, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  19 GLU-   HN   19 GLU-  HG2  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 280, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  19 GLU-   HN   19 GLU-  HG3  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 281, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  19 GLU-   HN   19 GLU-   QB  1.80 3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
 igr2= 277, 278,
 &end
#
#  19 GLU-   HN   19 GLU-   QG  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 280, 281,
 &end
#
#  19 GLU-   HN   20 ASP-   HN  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 288, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#  19 GLU-   QB   20 ASP-   HN  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 277, 278,
 &end
#
#  20 ASP-   HA   23 HIS    HN  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 290, 338, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  20 ASP-   HA   23 HIS    QB  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 342, 343,
 &end
#
#  20 ASP-  HB2   21  VAL   HN  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 292, 300, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  20 ASP-  HB2   71  ASN HD22  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 292,1129, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  20 ASP-  HB3   21  VAL   HN  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 300, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  20 ASP-  HB3   71  ASN HD22  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 293,1129, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  20 ASP-   HN   21  VAL   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 288, 300, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#  20 ASP-   HN   21  VAL  QG2  1.80 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 310, 311, 312,
 &end
#
#  20 ASP-   QB   21  VAL   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 300, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1= 292, 293,
 &end
#
#  20 ASP-   QB   21  VAL  QG2  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 292, 293,
 igr2= 310, 311, 312,
 &end
#
#  20 ASP-   QB   70  ILE  QG2  1.80 4.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 292, 293,
 igr2=1106,1107,1108,
 &end
#
#  20 ASP-   QB   71  ASN HD22  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 292, 293,
 &end
#
#  21  VAL   HA   21  VAL  QG1  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 306, 307, 308,
 &end
#
#  21  VAL   HA   21  VAL  QG2  1.80 3.04
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 310, 311, 312,
 &end
#
#  21  VAL   HA   24  TYR  HB2  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 359, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  21  VAL   HA   24  TYR  HB3  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 360, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  21  VAL   HA   24  TYR   HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 355, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  21  VAL   HA   24  TYR   QB  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 359, 360,
 &end
#
#  21  VAL   HA   25  PHE   HN  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 376, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  21  VAL   HA   70  ILE  QD1  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1113,1114,1115,
 &end
#
#  21  VAL   HA   70  ILE  QG2  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2=1106,1107,1108,
 &end
#
#  21  VAL   HB   22 LYS+   HA  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 318, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  21  VAL   HB   22 LYS+   HN  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 316, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  21  VAL   HB   34  ALA   QB  1.80 5.37
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
 igr2= 521, 522, 523,
 &end
#
#  21  VAL   HB   36  LEU  QD1  1.80 5.13
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2= 553, 554, 555,
 &end
#
#  21  VAL   HB   36  LEU  QD2  1.80 3.92
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 557, 558, 559,
 &end
#
#  21  VAL   HB   51  VAL  QG2  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2= 805, 806, 807,
 &end
#
#  21  VAL   HN   21  VAL   HB  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 300, 304, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  21  VAL   HN   21  VAL  QG2  1.80 2.96
 &rst
  ixpk= 0, nxpk= 0, iat= 300,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 310, 311, 312,
 &end
#
#  21  VAL   HN   22 LYS+   HN  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 300, 316, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  21  VAL  QG1   22 LYS+  HB2  1.80 5.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 320, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr1= 306, 307, 308,
 &end
#
#  21  VAL  QG1   22 LYS+   HN  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 306, 307, 308,
 &end
#
#  21  VAL  QG1   25  PHE   QD  1.80 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 306, 307, 308,
 igr2= 384, 392,
 &end
#
#  21  VAL  QG1   25  PHE   QE  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 306, 307, 308,
 igr2= 386, 390,
 &end
#
#  21  VAL  QG1   51  VAL  QG2  1.80 2.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 306, 307, 308,
 igr2= 805, 806, 807,
 &end
#
#  21  VAL  QG1   70  ILE  QD1  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 306, 307, 308,
 igr2=1113,1114,1115,
 &end
#
#  21  VAL  QG2   22 LYS+   HN  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 310, 311, 312,
 &end
#
#  21  VAL  QG2   25  PHE   QE  1.80 4.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1= 310, 311, 312,
 igr2= 386, 390,
 &end
#
#  21  VAL  QG2   36  LEU  QD2  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 310, 311, 312,
 igr2= 557, 558, 559,
 &end
#
#  21  VAL  QG2   70  ILE   HB  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1104, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 310, 311, 312,
 &end
#
#  21  VAL  QG2   70  ILE  QD1  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1= 310, 311, 312,
 igr2=1113,1114,1115,
 &end
#
#  21  VAL  QG2   70  ILE  QG2  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 310, 311, 312,
 igr2=1106,1107,1108,
 &end
#
#  22 LYS+   HA   22 LYS+   QD  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 326, 327,
 &end
#
#  22 LYS+   HA   22 LYS+   QG  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 323, 324,
 &end
#
#  22 LYS+   HA   25  PHE  HB2  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 380, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  22 LYS+   HA   25  PHE   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 376, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  22 LYS+   HA   25  PHE   QD  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 384, 392,
 &end
#
#  22 LYS+   HA   26 GLU-   HN  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 396, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  22 LYS+   HA   31  VAL  QG1  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 483, 484, 485,
 &end
#
#  22 LYS+   HA   31  VAL  QG2  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 487, 488, 489,
 &end
#
#  22 LYS+   HA   34  ALA   QB  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2= 521, 522, 523,
 &end
#
#  22 LYS+   HA   51  VAL  QG2  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 805, 806, 807,
 &end
#
#  22 LYS+  HB2   23 HIS    HN  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 338, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  22 LYS+  HB2   31  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 320,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 487, 488, 489,
 &end
#
#  22 LYS+  HB2   34  ALA   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 517, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  22 LYS+  HB2   34  ALA   QB  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 320,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 521, 522, 523,
 &end
#
#  22 LYS+  HB3   23 HIS    HN  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 338, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#  22 LYS+  HB3   31  VAL  QG1  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr2= 483, 484, 485,
 &end
#
#  22 LYS+  HB3   34  ALA   QB  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 521, 522, 523,
 &end
#
#  22 LYS+   HN   22 LYS+   QG  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 316,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 323, 324,
 &end
#
#  22 LYS+   QD   31  VAL  QG1  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 326, 327,
 igr2= 483, 484, 485,
 &end
#
#  22 LYS+   QD   31  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 326, 327,
 igr2= 487, 488, 489,
 &end
#
#  22 LYS+   QD   34  ALA   QB  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 326, 327,
 igr2= 521, 522, 523,
 &end
#
#  22 LYS+   QE   31  VAL  QG1  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 329, 330,
 igr2= 483, 484, 485,
 &end
#
#  22 LYS+   QG   23 HIS    HN  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr1= 323, 324,
 &end
#
#  22 LYS+   QG   26 GLU-  HG2  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 403, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 323, 324,
 &end
#
#  22 LYS+   QG   26 GLU-  HG3  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 404, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 323, 324,
 &end
#
#  22 LYS+   QG   26 GLU-   QG  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 323, 324,
 igr2= 403, 404,
 &end
#
#  22 LYS+   QG   31  VAL   HB  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 323, 324,
 &end
#
#  22 LYS+   QG   31  VAL  QG1  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 323, 324,
 igr2= 483, 484, 485,
 &end
#
#  23 HIS    HA   23 HIS   HD2  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 351, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#  23 HIS   HB2   24  TYR   HN  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 355, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  23 HIS   HB3   24  TYR   HN  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 355, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  23 HIS    HN   23 HIS   HD2  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 351, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  23 HIS    HN   24  TYR   HN  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 355, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#  23 HIS    QB   24  TYR   HN  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 342, 343,
 &end
#
#  24  TYR   HA   27  GLN HE21  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 357, 423, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  24  TYR   HA   27  GLN HE22  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 357, 424, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  24  TYR   HA   27  GLN   HN  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat= 357, 411, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  24  TYR   HA   27  GLN  QE2  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 423, 424,
 &end
#
#  24  TYR  HB2   25  PHE   HN  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 359, 376, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  24  TYR  HB2   70  ILE  QD1  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 359,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2=1113,1114,1115,
 &end
#
#  24  TYR  HB2   70  ILE  QG2  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 359,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1106,1107,1108,
 &end
#
#  24  TYR  HB3   25  PHE   HN  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 376, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  24  TYR  HB3   70  ILE  QD1  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2=1113,1114,1115,
 &end
#
#  24  TYR  HB3   70  ILE  QG2  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1106,1107,1108,
 &end
#
#  24  TYR   HN   24  TYR  HB2  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 359, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  24  TYR   HN   24  TYR  HB3  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 360, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  24  TYR   HN   25  PHE   HN  1.80 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 376, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#  24  TYR   QB   25  PHE   HN  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 376, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 359, 360,
 &end
#
#  24  TYR   QB   25  PHE   QD  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 359, 360,
 igr2= 384, 392,
 &end
#
#  24  TYR   QB   70  ILE  QD1  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 359, 360,
 igr2=1113,1114,1115,
 &end
#
#  25  PHE   HA   25  PHE   QD  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 378,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 384, 392,
 &end
#
#  25  PHE   HA   27  GLN   HN  1.80 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 378, 411, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
#  25  PHE   HA   28  PHE   QD  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 378,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 436, 444,
 &end
#
#  25  PHE   HA   28  PHE   QE  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 378,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr2= 438, 442,
 &end
#
#  25  PHE  HB2   26 GLU-   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 380, 396, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  25  PHE  HB2   31  VAL  QG2  1.80 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 487, 488, 489,
 &end
#
#  25  PHE  HB2   51  VAL  QG1  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 801, 802, 803,
 &end
#
#  25  PHE  HB2   51  VAL  QG2  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 805, 806, 807,
 &end
#
#  25  PHE  HB2   53  PHE   HZ  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 380, 837, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  25  PHE  HB2   53  PHE   QE  1.80 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 835, 839,
 &end
#
#  25  PHE  HB3   26 GLU-   HN  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 396, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  25  PHE  HB3   31  VAL  QG2  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 487, 488, 489,
 &end
#
#  25  PHE  HB3   51  VAL  QG1  1.80 3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 801, 802, 803,
 &end
#
#  25  PHE  HB3   51  VAL  QG2  1.80 4.91
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2= 805, 806, 807,
 &end
#
#  25  PHE  HB3   53  PHE   HZ  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 837, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#  25  PHE  HB3   53  PHE   QE  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr2= 835, 839,
 &end
#
#  25  PHE   HN   25  PHE  HB2  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 380, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  25  PHE   HN   25  PHE  HB3  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 381, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#  25  PHE   HN   25  PHE   QD  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 384, 392,
 &end
#
#  25  PHE   HN   26 GLU-   HN  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 396, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  25  PHE   HN   31  VAL  QG2  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 487, 488, 489,
 &end
#
#  25  PHE   QD   51  VAL  QG1  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 384, 392,
 igr2= 801, 802, 803,
 &end
#
#  25  PHE   QD   51  VAL  QG2  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1= 384, 392,
 igr2= 805, 806, 807,
 &end
#
#  25  PHE   QD   53  PHE   HZ  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 384, 392,
 &end
#
#  25  PHE   QD   53  PHE   QE  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 384, 392,
 igr2= 835, 839,
 &end
#
#  25  PHE   QD   62  VAL  QG1  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
 igr1= 384, 392,
 igr2= 976, 977, 978,
 &end
#
#  25  PHE   QD   62  VAL  QG2  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 384, 392,
 igr2= 980, 981, 982,
 &end
#
#  25  PHE   QD   70  ILE  QD1  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
 igr1= 384, 392,
 igr2=1113,1114,1115,
 &end
#
#  25  PHE   QE   51  VAL  QG2  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr1= 386, 390,
 igr2= 805, 806, 807,
 &end
#
#  25  PHE   QE   62  VAL  QG1  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
 igr1= 386, 390,
 igr2= 976, 977, 978,
 &end
#
#  25  PHE   QE   62  VAL  QG2  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1= 386, 390,
 igr2= 980, 981, 982,
 &end
#
#  25  PHE   QE   68 HIS   HE1  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 386, 390,
 &end
#
#  25  PHE   QE   70  ILE  QD1  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1= 386, 390,
 igr2=1113,1114,1115,
 &end
#
#  25  PHE   QE   75  VAL  QG2  1.80 4.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 386, 390,
 igr2=1196,1197,1198,
 &end
#
#  26 GLU-   HA   26 GLU-  HG2  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 403, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  26 GLU-   HA   26 GLU-  HG3  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 404, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  26 GLU-   HA   26 GLU-   QG  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 403, 404,
 &end
#
#  26 GLU-   HA   28  PHE   HN  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 428, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  26 GLU-   HA   29  GLY   HN  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 448, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#  26 GLU-   HA   31  VAL  QG2  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 487, 488, 489,
 &end
#
#  26 GLU-  HB2   27  GLN   HN  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 411, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#  26 GLU-  HB3   27  GLN   HN  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 401, 411, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#  26 GLU-  HG2   31  VAL   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 403, 477, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  26 GLU-  HG2   31  VAL  QG2  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 403,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 487, 488, 489,
 &end
#
#  26 GLU-  HG3   31  VAL   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 404, 477, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  26 GLU-  HG3   31  VAL  QG2  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 404,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 487, 488, 489,
 &end
#
#  26 GLU-   HN   26 GLU-  HB2  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 400, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  26 GLU-   HN   26 GLU-  HB3  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 401, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  26 GLU-   HN   26 GLU-  HG2  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 403, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  26 GLU-   HN   26 GLU-  HG3  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 404, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  26 GLU-   HN   26 GLU-   QB  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
 igr2= 400, 401,
 &end
#
#  26 GLU-   HN   26 GLU-   QG  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr2= 403, 404,
 &end
#
#  26 GLU-   HN   27  GLN   HN  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 411, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  26 GLU-   HN   31  VAL  QG2  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 487, 488, 489,
 &end
#
#  26 GLU-   QB   27  GLN   HN  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 400, 401,
 &end
#
#  26 GLU-   QG   31  VAL   HB  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 403, 404,
 &end
#
#  26 GLU-   QG   31  VAL   HN  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 403, 404,
 &end
#
#  26 GLU-   QG   31  VAL  QG1  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 403, 404,
 igr2= 483, 484, 485,
 &end
#
#  27  GLN   HA   27  GLN  HG2  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 418, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  27  GLN   HA   27  GLN  HG3  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 419, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  27  GLN   HA   27  GLN   QG  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 418, 419,
 &end
#
#  27  GLN  HG2   28  PHE   HN  1.80 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 418, 428, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  27  GLN  HG3   28  PHE   HN  1.80 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 428, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  27  GLN   HN   27  GLN  HG2  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 418, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#  27  GLN   HN   27  GLN  HG3  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 419, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#  27  GLN   HN   27  GLN   QB  1.80 3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 415, 416,
 &end
#
#  27  GLN   HN   28  PHE   HN  1.80 3.49
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 428, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  27  GLN   QB   27  GLN  QE2  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
 igr1= 415, 416,
 igr2= 423, 424,
 &end
#
#  27  GLN   QB   28  PHE   HN  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 415, 416,
 &end
#
#  27  GLN   QB   28  PHE   QD  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 415, 416,
 igr2= 436, 444,
 &end
#
#  27  GLN   QG   27  GLN  QE2  1.80 3.22
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 418, 419,
 igr2= 423, 424,
 &end
#
#  27  GLN   QG   28  PHE   HN  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 418, 419,
 &end
#
#  27  GLN   QG   28  PHE   QD  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 418, 419,
 igr2= 436, 444,
 &end
#
#  28  PHE   HA   28  PHE   QD  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2= 436, 444,
 &end
#
#  28  PHE   HA   58  ILE  QD1  1.80 5.24
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr2= 911, 912, 913,
 &end
#
#  28  PHE   HA   58  ILE  QG2  1.80 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 904, 905, 906,
 &end
#
#  28  PHE  HB2   29  GLY   HN  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 448, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  28  PHE  HB2   31  VAL  QG2  1.80 5.48
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr2= 487, 488, 489,
 &end
#
#  28  PHE  HB2   53  PHE   HZ  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 837, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  28  PHE  HB2   53  PHE   QD  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 833, 841,
 &end
#
#  28  PHE  HB2   53  PHE   QE  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 835, 839,
 &end
#
#  28  PHE  HB2   58  ILE  QD1  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 911, 912, 913,
 &end
#
#  28  PHE  HB2   58  ILE  QG2  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2= 904, 905, 906,
 &end
#
#  28  PHE  HB2   62  VAL  QG1  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 976, 977, 978,
 &end
#
#  28  PHE  HB2   62  VAL  QG2  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 980, 981, 982,
 &end
#
#  28  PHE  HB3   29  GLY   HN  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 448, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#  28  PHE  HB3   53  PHE   QE  1.80 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 835, 839,
 &end
#
#  28  PHE  HB3   58  ILE  QD1  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 911, 912, 913,
 &end
#
#  28  PHE  HB3   58  ILE  QG2  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 904, 905, 906,
 &end
#
#  28  PHE  HB3   62  VAL  QG2  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 980, 981, 982,
 &end
#
#  28  PHE  HB3   65  ILE  QD1  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr2=1025,1026,1027,
 &end
#
#  28  PHE   HN   28  PHE  HB2  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 432, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#  28  PHE   HN   28  PHE  HB3  1.80 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 433, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#  28  PHE   HN   28  PHE   QD  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 436, 444,
 &end
#
#  28  PHE   HN   28  PHE   QE  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 438, 442,
 &end
#
#  28  PHE   HN   29  GLY   HN  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 448, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  28  PHE   HN   30  LYS   HN  5.00 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 455, r1= 4.50, r2= 5.00, r3=100.00, r4=100.50,  &end
#
#  28  PHE   HZ   62  VAL  QG1  1.80 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2= 976, 977, 978,
 &end
#
#  28  PHE   HZ   65  ILE  QD1  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2=1025,1026,1027,
 &end
#
#  28  PHE   HZ   65  ILE  QG2  1.80 5.33
 &rst
  ixpk= 0, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2=1018,1019,1020,
 &end
#
#  28  PHE   HZ   68 HIS   HE1  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 440,1077, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#  28  PHE   QD   58  ILE  QD1  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 436, 444,
 igr2= 911, 912, 913,
 &end
#
#  28  PHE   QD   58  ILE  QG2  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
 igr1= 436, 444,
 igr2= 904, 905, 906,
 &end
#
#  28  PHE   QD   61 LYS+   QD  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 436, 444,
 igr2= 958, 959,
 &end
#
#  28  PHE   QD   62  VAL  QG1  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 436, 444,
 igr2= 976, 977, 978,
 &end
#
#  28  PHE   QD   62  VAL  QG2  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 436, 444,
 igr2= 980, 981, 982,
 &end
#
#  28  PHE   QD   65  ILE  QD1  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 436, 444,
 igr2=1025,1026,1027,
 &end
#
#  28  PHE   QE   62  VAL  QG1  1.80 4.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1= 438, 442,
 igr2= 976, 977, 978,
 &end
#
#  28  PHE   QE   62  VAL  QG2  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 438, 442,
 igr2= 980, 981, 982,
 &end
#
#  28  PHE   QE   65  ILE  QD1  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 438, 442,
 igr2=1025,1026,1027,
 &end
#
#  28  PHE   QE   65  ILE  QG1  1.80 4.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 438, 442,
 igr2=1022,1023,
 &end
#
#  29  GLY  HA2   30 LYS+   HN  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 450, 455, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#  29  GLY  HA2   58  ILE  QD1  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 911, 912, 913,
 &end
#
#  29  GLY  HA2   58  ILE  QG1  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 908, 909,
 &end
#
#  29  GLY  HA2   58  ILE  QG2  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 904, 905, 906,
 &end
#
#  29  GLY  HA3   30 LYS+   HN  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 451, 455, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#  29  GLY  HA3   58  ILE  QD1  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 911, 912, 913,
 &end
#
#  29  GLY  HA3   58  ILE  QG1  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 908, 909,
 &end
#
#  29  GLY  HA3   58  ILE  QG2  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 904, 905, 906,
 &end
#
#  29  GLY   HN   30  LYS   HN  2.80 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 455, r1= 2.30, r2= 2.80, r3=100.00, r4=100.50,  &end
#
#  29  GLY   HN   31  VAL  QG2  1.80 5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 487, 488, 489,
 &end
#
#  29  GLY   HN   53  PHE   QE  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 835, 839,
 &end
#
#  29  GLY   HN   58  ILE  QD1  1.80 5.45
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr2= 911, 912, 913,
 &end
#
#  29  GLY   HN   58  ILE  QG2  1.80 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 904, 905, 906,
 &end
#
#  29  GLY   QA   30 LYS+   HN  1.80 3.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr1= 450, 451,
 &end
#
#  29  GLY   QA   53  PHE   QD  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 450, 451,
 igr2= 833, 841,
 &end
#
#  29  GLY   QA   58  ILE  QG1  1.80 3.69
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 450, 451,
 igr2= 908, 909,
 &end
#
#  29  GLY   QA   58  ILE  QG2  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 450, 451,
 igr2= 904, 905, 906,
 &end
#
#  30 LYS+   HA   30 LYS+  HG2  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 457, 462, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  30 LYS+   HA   30 LYS+  HG3  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 457, 463, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  30 LYS+   HA   31  VAL   HN  1.80 2.85
 &rst
  ixpk= 0, nxpk= 0, iat= 457, 477, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
#  30 LYS+   HA   31  VAL  QG2  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 457,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 487, 488, 489,
 &end
#
#  30 LYS+  HG2   31  VAL   HN  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 462, 477, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  30 LYS+  HG3   31  VAL   HN  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 477, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  30 LYS+   HN   30 LYS+  HG2  1.80 4.91
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 462, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  30 LYS+   HN   30 LYS+  HG3  1.80 4.91
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 463, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  30 LYS+   HN   30 LYS+   QB  1.80 2.94
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2= 459, 460,
 &end
#
#  30 LYS+   HN   31  VAL   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 477, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  30 LYS+   HN   31  VAL  QG2  1.80 5.03
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr2= 487, 488, 489,
 &end
#
#  30 LYS+   HN   58  ILE  QD1  1.80 5.29
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr2= 911, 912, 913,
 &end
#
#  30 LYS+   HN   58  ILE  QG1  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr2= 908, 909,
 &end
#
#  30 LYS+   HN   58  ILE  QG2  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 904, 905, 906,
 &end
#
#  30 LYS+   QB   31  VAL   HN  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 459, 460,
 &end
#
#  30 LYS+   QB   54 GLU-  HG2  1.80 5.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 459, 460,
 &end
#
#  30 LYS+   QB   54 GLU-  HG3  1.80 5.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 853, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 459, 460,
 &end
#
#  30 LYS+   QB   54 GLU-   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 459, 460,
 &end
#
#  30 LYS+   QB   54 GLU-   QB  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 459, 460,
 igr2= 849, 850,
 &end
#
#  30 LYS+   QB   54 GLU-   QG  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 459, 460,
 igr2= 852, 853,
 &end
#
#  30 LYS+   QG   30 LYS+   QE  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 462, 463,
 igr2= 468, 469,
 &end
#
#  30 LYS+   QG   31  VAL   HN  1.80 3.69
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 462, 463,
 &end
#
#  31  VAL   HA   31  VAL  QG1  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 483, 484, 485,
 &end
#
#  31  VAL   HA   31  VAL  QG2  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 487, 488, 489,
 &end
#
#  31  VAL   HA   32 ASP-   HN  1.80 3.06
 &rst
  ixpk= 0, nxpk= 0, iat= 479, 493, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,  &end
#
#  31  VAL   HA   32 ASP-   QB  1.80 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 497, 498,
 &end
#
#  31  VAL   HA   33 ASP-   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 479, 505, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  31  VAL   HA   51  VAL  QG1  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 801, 802, 803,
 &end
#
#  31  VAL   HA   53  PHE   HA  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 479, 827, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  31  VAL   HA   53  PHE   QD  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 833, 841,
 &end
#
#  31  VAL   HA   54 GLU-   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 479, 845, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  31  VAL   HB   51  VAL  QG1  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 481,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 801, 802, 803,
 &end
#
#  31  VAL   HN   31  VAL   HB  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 477, 481, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  31  VAL   HN   31  VAL  QG1  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 477,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 483, 484, 485,
 &end
#
#  31  VAL   HN   31  VAL  QG2  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 477,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 487, 488, 489,
 &end
#
#  31  VAL  QG1   32 ASP-   HN  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   32 ASP-   QB  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
 igr1= 483, 484, 485,
 igr2= 497, 498,
 &end
#
#  31  VAL  QG1   33 ASP-   HN  1.80 3.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 505, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   33 ASP-   QB  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 483, 484, 485,
 igr2= 509, 510,
 &end
#
#  31  VAL  QG1   34  ALA   HA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 519, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   34  ALA   HN  1.80 4.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 517, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   34  ALA   QB  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 483, 484, 485,
 igr2= 521, 522, 523,
 &end
#
#  31  VAL  QG1   51  VAL   HA  1.80 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 797, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   51  VAL  QG1  1.80 2.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 483, 484, 485,
 igr2= 801, 802, 803,
 &end
#
#  31  VAL  QG1   52  THR   HB  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 815, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   52  THR   HN  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   53  PHE   HA  1.80 5.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 827, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   53  PHE   QD  1.80 4.91
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1= 483, 484, 485,
 igr2= 833, 841,
 &end
#
#  31  VAL  QG2   32 ASP-   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 487, 488, 489,
 &end
#
#  31  VAL  QG2   51  VAL  QG1  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 487, 488, 489,
 igr2= 801, 802, 803,
 &end
#
#  31  VAL  QG2   53  PHE   HZ  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 487, 488, 489,
 &end
#
#  31  VAL  QG2   53  PHE   QD  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 487, 488, 489,
 igr2= 833, 841,
 &end
#
#  31  VAL  QG2   53  PHE   QE  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1= 487, 488, 489,
 igr2= 835, 839,
 &end
#
#  32 ASP-  HB2   33 ASP-   HN  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 505, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  32 ASP-  HB2   52  THR   HB  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 815, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  32 ASP-  HB2   52  THR  QG2  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 497,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 817, 818, 819,
 &end
#
#  32 ASP-  HB3   33 ASP-   HN  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 498, 505, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  32 ASP-  HB3   52  THR   HB  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 498, 815, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  32 ASP-  HB3   52  THR  QG2  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 817, 818, 819,
 &end
#
#  32 ASP-   HN   32 ASP-  HB2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 497, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  32 ASP-   HN   32 ASP-  HB3  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 498, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  32 ASP-   HN   32 ASP-   QB  1.80 3.23
 &rst
  ixpk= 0, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2= 497, 498,
 &end
#
#  32 ASP-   HN   33 ASP-   HN  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 505, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  32 ASP-   HN   52  THR  QG2  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 817, 818, 819,
 &end
#
#  32 ASP-   HN   53  PHE   HA  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 827, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  32 ASP-   HN   54 GLU-   HN  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 845, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  32 ASP-   QB   33 ASP-   HN  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 505, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 497, 498,
 &end
#
#  32 ASP-   QB   52  THR  QG2  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 497, 498,
 igr2= 817, 818, 819,
 &end
#
#  33 ASP-   HA   34  ALA   HN  1.80 3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 507, 517, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#  33 ASP-   HA   34  ALA   QB  1.80 5.05
 &rst
  ixpk= 0, nxpk= 0, iat= 507,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr2= 521, 522, 523,
 &end
#
#  33 ASP-  HB2   34  ALA   HN  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 509, 517, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  33 ASP-  HB2   52  THR   HB  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 509, 815, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  33 ASP-  HB3   34  ALA   HN  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 517, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  33 ASP-  HB3   52  THR   HB  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 815, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  33 ASP-   HN   33 ASP-  HB2  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 509, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  33 ASP-   HN   33 ASP-  HB3  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 510, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  33 ASP-   HN   34  ALA   HA  1.80 5.35
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 519, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#  33 ASP-   HN   52  THR   HA  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 813, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  33 ASP-   HN   52  THR   HB  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 815, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  33 ASP-   HN   52  THR   HN  1.80 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 811, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#  33 ASP-   HN   53  PHE   HA  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 827, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  33 ASP-   QB   34  ALA   HN  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 517, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 509, 510,
 &end
#
#  33 ASP-   QB   52  THR   HB  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 815, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 509, 510,
 &end
#
#  33 ASP-   QB   52  THR  QG2  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 509, 510,
 igr2= 817, 818, 819,
 &end
#
#  34  ALA   HA   35  MET   HN  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 527, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
#  34  ALA   HA   51  VAL   HA  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 797, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  34  ALA   HA   51  VAL  QG1  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 801, 802, 803,
 &end
#
#  34  ALA   HA   51  VAL  QG2  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 805, 806, 807,
 &end
#
#  34  ALA   HA   52  THR   HN  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 811, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  34  ALA   HN   34  ALA   QB  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 517,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 521, 522, 523,
 &end
#
#  34  ALA   HN   35  MET   HN  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 517, 527, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  34  ALA   QB   35  MET   HA  1.80 5.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 529, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1= 521, 522, 523,
 &end
#
#  34  ALA   QB   35  MET   HN  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 527, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 521, 522, 523,
 &end
#
#  34  ALA   QB   51  VAL   HA  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 797, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 521, 522, 523,
 &end
#
#  34  ALA   QB   51  VAL  QG1  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1= 521, 522, 523,
 igr2= 801, 802, 803,
 &end
#
#  34  ALA   QB   51  VAL  QG2  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
 igr1= 521, 522, 523,
 igr2= 805, 806, 807,
 &end
#
#  34  ALA   QB   52  THR   HN  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 521, 522, 523,
 &end
#
#  35  MET   HA   36  LEU   HN  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 544, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  35  MET   HN   35  MET   QB  1.80 3.56
 &rst
  ixpk= 0, nxpk= 0, iat= 527,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2= 531, 532,
 &end
#
#  35  MET   HN   35  MET   QG  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 527,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 534, 535,
 &end
#
#  35  MET   HN   36  LEU  QD2  1.80 4.87
 &rst
  ixpk= 0, nxpk= 0, iat= 527,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2= 557, 558, 559,
 &end
#
#  35  MET   HN   51  VAL   HA  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 527, 797, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  35  MET   QB   36  LEU   HN  1.80 3.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 531, 532,
 &end
#
#  35  MET   QE   50  PHE   HN  1.80 4.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 538, 539, 540,
 &end
#
#  35  MET   QE   50  PHE   QD  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1= 538, 539, 540,
 igr2= 783, 791,
 &end
#
#  35  MET   QG   36  LEU   HN  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 534, 535,
 &end
#
#  35  MET   QG   50  PHE   QD  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 534, 535,
 igr2= 783, 791,
 &end
#
#  35  MET   QG   50  PHE   QE  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 534, 535,
 igr2= 785, 789,
 &end
#
#  36  LEU   HA   36  LEU  QD1  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 553, 554, 555,
 &end
#
#  36  LEU   HA   36  LEU  QD2  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 557, 558, 559,
 &end
#
#  36  LEU   HA   37  MET   HN  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 563, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#  36  LEU   HA   49  GLY  HA2  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 770, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  36  LEU   HA   49  GLY  HA3  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 771, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  36  LEU   HA   50  PHE   HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 775, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  36  LEU  HB2   37  MET   HN  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 563, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  36  LEU  HB3   37  MET   HN  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 563, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  36  LEU   HG   49  GLY   QA  1.80 5.22
 &rst
  ixpk= 0, nxpk= 0, iat= 551,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2= 770, 771,
 &end
#
#  36  LEU   HN   36  LEU   HG  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 544, 551, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  36  LEU   HN   36  LEU   QB  1.80 3.42
 &rst
  ixpk= 0, nxpk= 0, iat= 544,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 548, 549,
 &end
#
#  36  LEU   HN   36  LEU  QD1  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 544,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 553, 554, 555,
 &end
#
#  36  LEU   HN   36  LEU  QD2  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 544,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 557, 558, 559,
 &end
#
#  36  LEU   HN   37  MET   HN  1.80 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 544, 563, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#  36  LEU   QB   36  LEU  QD2  1.80 2.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr1= 548, 549,
 igr2= 557, 558, 559,
 &end
#
#  36  LEU   QB   37  MET   HN  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 548, 549,
 &end
#
#  36  LEU   QB   38  PHE   HZ  1.80 4.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 548, 549,
 &end
#
#  36  LEU   QB   38  PHE   QD  1.80 4.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 548, 549,
 igr2= 588, 596,
 &end
#
#  36  LEU   QB   38  PHE   QE  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr1= 548, 549,
 igr2= 590, 594,
 &end
#
#  36  LEU   QB   45 HIS   HE1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 709, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 548, 549,
 &end
#
#  36  LEU   QB   45 HIS    QB  1.80 4.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 548, 549,
 igr2= 704, 705,
 &end
#
#  36  LEU  QD1   38  PHE   HZ  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 553, 554, 555,
 &end
#
#  36  LEU  QD1   38  PHE   QE  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 553, 554, 555,
 igr2= 590, 594,
 &end
#
#  36  LEU  QD1   45 HIS   HD2  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 713, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1= 553, 554, 555,
 &end
#
#  36  LEU  QD1   45 HIS    QB  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 553, 554, 555,
 igr2= 704, 705,
 &end
#
#  36  LEU  QD2   37  MET   HN  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QD2   49  GLY  HA2  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QD2   49  GLY  HA3  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QD2   49  GLY   HN  1.80 4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QD2   49  GLY   QA  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 557, 558, 559,
 igr2= 770, 771,
 &end
#
#  36  LEU  QD2   50  PHE   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QQD   45 HIS   HD2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 713, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 553, 554, 555, 557, 558, 559,
 &end
#
#  37  MET   HA   37  MET   QE  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 565,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2= 574, 575, 576,
 &end
#
#  37  MET   HA   38  PHE   HN  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat= 565, 580, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#  37  MET  HB2   38  PHE   HN  1.80 4.95
 &rst
  ixpk= 0, nxpk= 0, iat= 567, 580, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  37  MET  HB3   38  PHE   HN  1.80 4.95
 &rst
  ixpk= 0, nxpk= 0, iat= 568, 580, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  37  MET   HN   37  MET  HB2  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 567, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  37  MET   HN   37  MET  HB3  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 568, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  37  MET   HN   37  MET  HG2  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 570, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  37  MET   HN   37  MET  HG3  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 571, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  37  MET   HN   37  MET   QB  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 567, 568,
 &end
#
#  37  MET   HN   37  MET   QG  1.80 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 570, 571,
 &end
#
#  37  MET   HN   46  ARG   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 717, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  37  MET   HN   46 ARG+   HN  1.80 5.44
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 717, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
#  37  MET   HN   49  GLY  HA2  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 770, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  37  MET   HN   49  GLY  HA3  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 771, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  37  MET   QB   37  MET   QE  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 567, 568,
 igr2= 574, 575, 576,
 &end
#
#  37  MET   QB   48  PHE   HZ  1.80 5.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 567, 568,
 &end
#
#  37  MET   QB   48  PHE   QE  1.80 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 567, 568,
 igr2= 758, 762,
 &end
#
#  37  MET   QE   38  PHE   HN  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 580, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr1= 574, 575, 576,
 &end
#
#  37  MET   QE   48  PHE   QE  1.80 4.69
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1= 574, 575, 576,
 igr2= 758, 762,
 &end
#
#  37  MET   QE   50  PHE   QD  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 574, 575, 576,
 igr2= 783, 791,
 &end
#
#  37  MET   QE   50  PHE   QE  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 574, 575, 576,
 igr2= 785, 789,
 &end
#
#  37  MET   QG   48  PHE   HZ  1.80 5.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr1= 570, 571,
 &end
#
#  37  MET   QG   48  PHE   QE  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 570, 571,
 igr2= 758, 762,
 &end
#
#  37  MET   QG   49  GLY   QA  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 570, 571,
 igr2= 770, 771,
 &end
#
#  37  MET   QG   50  PHE   QD  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 570, 571,
 igr2= 783, 791,
 &end
#
#  37  MET   QG   50  PHE   QE  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 570, 571,
 igr2= 785, 789,
 &end
#
#  38  PHE   HA   39 ASP-   HN  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 600, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  38  PHE   HA   45 HIS    HA  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 702, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  38  PHE   HA   46 ARG+   HN  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 717, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#  38  PHE  HB2   39 ASP-   HN  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 584, 600, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#  38  PHE  HB3   39 ASP-   HN  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 585, 600, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#  38  PHE   HN   38  PHE  HB2  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 584, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  38  PHE   HN   38  PHE  HB3  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 585, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  38  PHE   HN   38  PHE   QB  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 584, 585,
 &end
#
#  38  PHE   HN   38  PHE   QD  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 588, 596,
 &end
#
#  38  PHE   QB   39 ASP-   HN  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 584, 585,
 &end
#
#  38  PHE   QD   38  PHE   HZ  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 588, 596,
 &end
#
#  38  PHE   QD   39 ASP-   HN  1.80 4.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 588, 596,
 &end
#
#  38  PHE   QD   46 ARG+   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 717, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 588, 596,
 &end
#
#  39 ASP-   HN   39 ASP-  HB2  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 604, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  39 ASP-   HN   39 ASP-  HB3  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 605, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  39 ASP-   HN   39 ASP-   QB  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 600,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 604, 605,
 &end
#
#  39 ASP-   HN   40 LYS+   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 612, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  39 ASP-   HN   44 ARG+   HN  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 676, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  39 ASP-   QB   44 ARG+   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 676, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 604, 605,
 &end
#
#  40 LYS+   HA   40 LYS+   QG  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 614,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr2= 619, 620,
 &end
#
#  40 LYS+   HA   43  ASN   HN  1.80 5.26
 &rst
  ixpk= 0, nxpk= 0, iat= 614, 662, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#  40 LYS+   HN   40 LYS+   QB  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 612,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 616, 617,
 &end
#
#  40 LYS+   QB   41  THR   HN  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 634, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 616, 617,
 &end
#
#  41  THR   HA   41  THR  QG2  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 636,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 640, 641, 642,
 &end
#
#  41  THR   HA   43  ASN   HN  1.80 5.19
 &rst
  ixpk= 0, nxpk= 0, iat= 636, 662, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#  41  THR   HB   42  THR   HN  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 638, 648, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#  41  THR   HB   43  ASN   HN  1.80 5.17
 &rst
  ixpk= 0, nxpk= 0, iat= 638, 662, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
#  41  THR   HN   41  THR   HB  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 638, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  41  THR   HN   41  THR  QG2  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 634,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 640, 641, 642,
 &end
#
#  41  THR   HN   42  THR   HN  1.80 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 648, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  41  THR   HN   43  ASN   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 662, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  41  THR  QG2   42  THR   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 648, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1= 640, 641, 642,
 &end
#
#  42  THR   HA   42  THR  QG2  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat= 650,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2= 654, 655, 656,
 &end
#
#  42  THR   HN   42  THR  QG2  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 648,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2= 654, 655, 656,
 &end
#
#  42  THR   HN   43  ASN   HA  1.80 5.25
 &rst
  ixpk= 0, nxpk= 0, iat= 648, 664, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#  42  THR   HN   43  ASN   HN  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 648, 662, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  42  THR  QG2   43  ASN   HN  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 662, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 654, 655, 656,
 &end
#
#  43  ASN   HN   44 ARG+   HN  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 662, 676, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  44 ARG+   HA   45 HIS    HN  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 678, 700, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  44 ARG+  HB2   45 HIS    HN  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 680, 700, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  44 ARG+  HB3   45 HIS    HN  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 681, 700, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  44 ARG+   HN   44 ARG+  HB2  1.80 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 676, 680, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  44 ARG+   HN   44 ARG+  HB3  1.80 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 676, 681, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  44 ARG+   HN   44 ARG+  HG2  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 676, 683, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#  44 ARG+   HN   44 ARG+  HG3  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 676, 684, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#  44 ARG+   HN   44 ARG+   QB  1.80 3.42
 &rst
  ixpk= 0, nxpk= 0, iat= 676,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 680, 681,
 &end
#
#  44 ARG+   HN   44 ARG+   QG  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 676,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 683, 684,
 &end
#
#  44 ARG+   QB   44 ARG+   HE  1.80 4.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 689, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 680, 681,
 &end
#
#  44 ARG+   QB   44 ARG+   QD  1.80 2.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
 igr1= 680, 681,
 igr2= 686, 687,
 &end
#
#  44 ARG+   QB   45 HIS    HA  1.80 4.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 702, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1= 680, 681,
 &end
#
#  45 HIS    HA   46 ARG+   HA  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 702, 719, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  45 HIS    HA   46 ARG+   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 702, 717, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#  45 HIS   HB2   46 ARG+   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 704, 717, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  45 HIS   HB3   46 ARG+   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 705, 717, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  45 HIS   HE1   47  GLY   HN  1.80 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 741, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#  45 HIS   HE1   47  GLY   QA  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 709,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 743, 744,
 &end
#
#  45 HIS    HN   45 HIS    HA  2.70 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 700, 702, r1= 2.20, r2= 2.70, r3=100.00, r4=100.50,  &end
#
#  45 HIS    HN   45 HIS   HD2  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 700, 713, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  45 HIS    QB   46 ARG+   HN  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 717, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 704, 705,
 &end
#
#  46  ARG   HA   46  ARG   HN  2.70 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 717, r1= 2.20, r2= 2.70, r3=100.00, r4=100.50,  &end
#
#  46 ARG+   HA   46 ARG+   QG  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 719,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr2= 724, 725,
 &end
#
#  46 ARG+  HB2   48  PHE   QE  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 758, 762,
 &end
#
#  46 ARG+  HB3   48  PHE   QE  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 722,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 758, 762,
 &end
#
#  46 ARG+  HD2   48  PHE   QE  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 727,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 758, 762,
 &end
#
#  46 ARG+  HD3   48  PHE   QE  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 728,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 758, 762,
 &end
#
#  46 ARG+   HE   48  PHE   QE  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat= 730,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 758, 762,
 &end
#
#  46 ARG+   HN   46 ARG+  HB2  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 717, 721, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  46 ARG+   HN   46 ARG+  HB3  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 717, 722, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  46 ARG+   HN   46 ARG+   QB  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 721, 722,
 &end
#
#  46 ARG+   HN   46 ARG+   QG  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 724, 725,
 &end
#
#  46 ARG+   HN   47  GLY   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 717, 741, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  46 ARG+   HN   48  PHE   HN  1.80 4.83
 &rst
  ixpk= 0, nxpk= 0, iat= 717, 748, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  46 ARG+   QB   46 ARG+   HE  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 730, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 721, 722,
 &end
#
#  46 ARG+   QB   46 ARG+   QD  1.80 3.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 721, 722,
 igr2= 727, 728,
 &end
#
#  46 ARG+   QB   48  PHE   HN  1.80 5.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 721, 722,
 &end
#
#  46 ARG+   QB   48  PHE   HZ  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 721, 722,
 &end
#
#  46 ARG+   QB   48  PHE   QE  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 721, 722,
 igr2= 758, 762,
 &end
#
#  46 ARG+   QD   48  PHE   HZ  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 727, 728,
 &end
#
#  47  GLY   HN   48  PHE   HN  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 741, 748, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  48  PHE   HA   49  GLY   HN  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 750, 768, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  48  PHE  HB2   49  GLY   HN  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 752, 768, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  48  PHE  HB3   49  GLY   HN  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 753, 768, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  48  PHE   HN   48  PHE   QE  1.80 5.11
 &rst
  ixpk= 0, nxpk= 0, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 758, 762,
 &end
#
#  48  PHE   QB   49  GLY   HN  1.80 3.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr1= 752, 753,
 &end
#
#  48  PHE   QE   50  PHE   HZ  1.80 5.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 787, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 758, 762,
 &end
#
#  48  PHE   QE   50  PHE   QD  1.80 4.86
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 758, 762,
 igr2= 783, 791,
 &end
#
#  48  PHE   QE   50  PHE   QE  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1= 758, 762,
 igr2= 785, 789,
 &end
#
#  49  GLY  HA2   50  PHE   QD  1.80 5.10
 &rst
  ixpk= 0, nxpk= 0, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 783, 791,
 &end
#
#  49  GLY  HA3   50  PHE   QD  1.80 5.10
 &rst
  ixpk= 0, nxpk= 0, iat= 771,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 783, 791,
 &end
#
#  49  GLY   QA   50  PHE   HN  1.80 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr1= 770, 771,
 &end
#
#  49  GLY   QA   50  PHE   QD  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 770, 771,
 igr2= 783, 791,
 &end
#
#  50  PHE   HA   50  PHE   QD  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 777,  -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr2= 783, 791,
 &end
#
#  50  PHE   HA   51  VAL   HN  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 777, 795, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
#  50  PHE   HA   51  VAL  QG2  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 777,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 805, 806, 807,
 &end
#
#  50  PHE  HB2   51  VAL   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 795, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  50  PHE  HB3   51  VAL   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 780, 795, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  50  PHE   HN   50  PHE   QB  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 775,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 779, 780,
 &end
#
#  50  PHE   HN   50  PHE   QD  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 775,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 783, 791,
 &end
#
#  50  PHE   HN   50  PHE   QE  1.80 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 775,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 785, 789,
 &end
#
#  50  PHE   HZ   80  ALA   QB  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 787,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2=1276,1277,1278,
 &end
#
#  50  PHE   QB   51  VAL   HN  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 779, 780,
 &end
#
#  50  PHE   QD   51  VAL   HN  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 783, 791,
 &end
#
#  50  PHE   QD   80  ALA   QB  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 783, 791,
 igr2=1276,1277,1278,
 &end
#
#  50  PHE   QE   80  ALA   QB  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 785, 789,
 igr2=1276,1277,1278,
 &end
#
#  51  VAL   HA   51  VAL  QG1  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 797,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 801, 802, 803,
 &end
#
#  51  VAL   HA   51  VAL  QG2  1.80 3.27
 &rst
  ixpk= 0, nxpk= 0, iat= 797,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 805, 806, 807,
 &end
#
#  51  VAL   HA   52  THR   HN  1.80 2.99
 &rst
  ixpk= 0, nxpk= 0, iat= 797, 811, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#  51  VAL   HB   52  THR   HN  1.80 5.26
 &rst
  ixpk= 0, nxpk= 0, iat= 799, 811, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#  51  VAL   HN   51  VAL   HB  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 795, 799, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#  51  VAL   HN   51  VAL  QG1  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 795,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2= 801, 802, 803,
 &end
#
#  51  VAL   HN   51  VAL  QG2  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 795,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2= 805, 806, 807,
 &end
#
#  51  VAL  QG1   52  THR   HA  1.80 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 813, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 801, 802, 803,
 &end
#
#  51  VAL  QG1   52  THR   HN  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 801, 802, 803,
 &end
#
#  51  VAL  QG1   53  PHE  HB2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 801, 802, 803,
 &end
#
#  51  VAL  QG1   53  PHE   HZ  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 801, 802, 803,
 &end
#
#  51  VAL  QG1   53  PHE   QE  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 801, 802, 803,
 igr2= 835, 839,
 &end
#
#  51  VAL  QG2   52  THR   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1= 805, 806, 807,
 &end
#
#  52  THR   HA   52  THR  QG2  1.80 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 813,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 817, 818, 819,
 &end
#
#  52  THR   HA   53  PHE   HN  1.80 3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 813, 825, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#  52  THR   HA   53  PHE   QD  1.80 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 813,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2= 833, 841,
 &end
#
#  52  THR   HA   59  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 813,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 927, 928, 929,
 &end
#
#  52  THR   HB   53  PHE   HN  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 815, 825, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  52  THR   HN   52  THR   HB  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 811, 815, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  52  THR   HN   52  THR  QG2  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 811,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 817, 818, 819,
 &end
#
#  52  THR  QG2   53  PHE  HB2  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr1= 817, 818, 819,
 &end
#
#  52  THR  QG2   53  PHE   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 817, 818, 819,
 &end
#
#  52  THR  QG2   53  PHE   QD  1.80 5.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
 igr1= 817, 818, 819,
 igr2= 833, 841,
 &end
#
#  53  PHE   HA   53  PHE   QD  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 827,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 833, 841,
 &end
#
#  53  PHE   HA   54 GLU-   HN  1.80 3.27
 &rst
  ixpk= 0, nxpk= 0, iat= 827, 845, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  53  PHE   HA   59  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 827,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE  HB2   54 GLU-   HN  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 829, 845, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  53  PHE  HB2   55  SER   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 829, 860, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  53  PHE  HB2   58  ILE   HB  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 829, 902, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  53  PHE  HB2   58  ILE  QG2  1.80 5.02
 &rst
  ixpk= 0, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE  HB2   59  VAL  QG2  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE  HB3   54 GLU-   HN  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 830, 845, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  53  PHE  HB3   55  SER   HN  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 830, 860, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#  53  PHE  HB3   58  ILE  QG2  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 830,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE  HB3   59  VAL   HN  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat= 830, 917, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
#  53  PHE  HB3   59  VAL  QG2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 830,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE   HN   53  PHE  HB2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 825, 829, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  53  PHE   HN   53  PHE  HB3  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 825, 830, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  53  PHE   HN   53  PHE   QD  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat= 825,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 833, 841,
 &end
#
#  53  PHE   HN   54 GLU-   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 825, 845, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  53  PHE   HN   59  VAL  QG2  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 825,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE   HZ   58  ILE  QG2  1.80 4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 837,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE   HZ   59  VAL   HA  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 837, 919, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  53  PHE   HZ   62  VAL  QG1  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 837,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 976, 977, 978,
 &end
#
#  53  PHE   HZ   62  VAL  QG2  1.80 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 837,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 980, 981, 982,
 &end
#
#  53  PHE   QD   54 GLU-   HN  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 833, 841,
 &end
#
#  53  PHE   QD   55  SER   HN  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 833, 841,
 &end
#
#  53  PHE   QD   58  ILE   HB  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 833, 841,
 &end
#
#  53  PHE   QD   58  ILE  QD1  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 833, 841,
 igr2= 911, 912, 913,
 &end
#
#  53  PHE   QD   58  ILE  QG2  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 833, 841,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE   QD   59  VAL   HA  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 833, 841,
 &end
#
#  53  PHE   QD   59  VAL  QG2  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr1= 833, 841,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE   QD   62  VAL  QG2  1.80 5.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1= 833, 841,
 igr2= 980, 981, 982,
 &end
#
#  53  PHE   QE   58  ILE  QG2  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 835, 839,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE   QE   59  VAL   HA  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 835, 839,
 &end
#
#  53  PHE   QE   59  VAL  QG2  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 835, 839,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE   QE   62  VAL  QG1  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 835, 839,
 igr2= 976, 977, 978,
 &end
#
#  53  PHE   QE   62  VAL  QG2  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 835, 839,
 igr2= 980, 981, 982,
 &end
#
#  54 GLU-   HA   54 GLU-   QG  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 847,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 852, 853,
 &end
#
#  54 GLU-   HN   54 GLU-  HG2  1.80 5.41
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 852, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#  54 GLU-   HN   54 GLU-  HG3  1.80 5.41
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 853, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#  54 GLU-   HN   54 GLU-   QB  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 845,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2= 849, 850,
 &end
#
#  54 GLU-   HN   54 GLU-   QG  1.80 4.62
 &rst
  ixpk= 0, nxpk= 0, iat= 845,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 852, 853,
 &end
#
#  54 GLU-   QB   55  SER   HN  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 849, 850,
 &end
#
#  54 GLU-   QG   55  SER   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 852, 853,
 &end
#
#  55  SER  HB2   58  ILE  QG1  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 864,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 908, 909,
 &end
#
#  55  SER  HB3   58  ILE  QG1  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 865,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 908, 909,
 &end
#
#  55  SER   HN   55  SER  HB2  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 860, 864, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  55  SER   HN   55  SER  HB3  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 860, 865, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  55  SER   HN   55  SER   QB  1.80 3.16
 &rst
  ixpk= 0, nxpk= 0, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 864, 865,
 &end
#
#  55  SER   HN   56  GLU   HN  2.70 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 860, 871, r1= 2.20, r2= 2.70, r3=100.00, r4=100.50,  &end
#
#  55  SER   HN   58  ILE   HB  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 860, 902, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  55  SER   HN   58  ILE  QD1  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 911, 912, 913,
 &end
#
#  55  SER   QB   57 ASP-   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 864, 865,
 &end
#
#  55  SER   QB   58  ILE   HB  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 864, 865,
 &end
#
#  55  SER   QB   58  ILE   HN  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 898, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 864, 865,
 &end
#
#  55  SER   QB   58  ILE  QD1  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 864, 865,
 igr2= 911, 912, 913,
 &end
#
#  55  SER   QB   58  ILE  QG1  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 864, 865,
 igr2= 908, 909,
 &end
#
#  55  SER   QB   58  ILE  QG2  1.80 4.84
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
 igr1= 864, 865,
 igr2= 904, 905, 906,
 &end
#
#  56 GLU-   HA   56 GLU-   QG  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 873,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 878, 879,
 &end
#
#  56 GLU-   HA   58  ILE   HN  1.80 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 873, 898, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#  56 GLU-   HA   59  VAL   HB  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 873, 921, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  56 GLU-   HA   59  VAL   HN  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 873, 917, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  56 GLU-   HA   59  VAL  QG2  1.80 3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 873,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 927, 928, 929,
 &end
#
#  56 GLU-   HN   56 GLU-   QB  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 871,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 875, 876,
 &end
#
#  56 GLU-   HN   56 GLU-   QG  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 871,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 878, 879,
 &end
#
#  56 GLU-   HN   57 ASP-   HN  1.80 3.61
 &rst
  ixpk= 0, nxpk= 0, iat= 871, 886, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  56 GLU-   QB   57 ASP-   HA  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 888, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 875, 876,
 &end
#
#  56 GLU-   QB   57 ASP-   HN  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 875, 876,
 &end
#
#  56 GLU-   QB   59  VAL  QG2  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 875, 876,
 igr2= 927, 928, 929,
 &end
#
#  56 GLU-   QG   57 ASP-   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 878, 879,
 &end
#
#  57 ASP-   HA   58  ILE  QD1  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 888,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 911, 912, 913,
 &end
#
#  57 ASP-   HA   60 GLU-   HN  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 888, 933, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  57 ASP-   HA   60 GLU-   QB  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 888,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 937, 938,
 &end
#
#  57 ASP-   HA   60 GLU-   QG  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 888,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 940, 941,
 &end
#
#  57 ASP-  HB2   58  ILE   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 890, 898, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  57 ASP-  HB2   58  ILE  QD1  1.80 4.24
 &rst
  ixpk= 0, nxpk= 0, iat= 890,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 911, 912, 913,
 &end
#
#  57 ASP-  HB3   58  ILE   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 891, 898, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  57 ASP-  HB3   58  ILE  QD1  1.80 4.24
 &rst
  ixpk= 0, nxpk= 0, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 911, 912, 913,
 &end
#
#  57 ASP-   HN   57 ASP-  HB2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 886, 890, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  57 ASP-   HN   57 ASP-  HB3  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 886, 891, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  57 ASP-   HN   57 ASP-   QB  1.80 3.19
 &rst
  ixpk= 0, nxpk= 0, iat= 886,  -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
 igr2= 890, 891,
 &end
#
#  57 ASP-   HN   58  ILE   HN  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 886, 898, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#  57 ASP-   HN   58  ILE  QD1  1.80 5.40
 &rst
  ixpk= 0, nxpk= 0, iat= 886,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 911, 912, 913,
 &end
#
#  57 ASP-   QB   58  ILE  QD1  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1= 890, 891,
 igr2= 911, 912, 913,
 &end
#
#  58  ILE   HA   58  ILE  QD1  1.80 2.90
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
 igr2= 911, 912, 913,
 &end
#
#  58  ILE   HA   58  ILE  QG1  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 908, 909,
 &end
#
#  58  ILE   HA   58  ILE  QG2  1.80 3.08
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 904, 905, 906,
 &end
#
#  58  ILE   HA   61 LYS+  HB2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 900, 952, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  58  ILE   HA   61 LYS+  HB3  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 900, 953, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  58  ILE   HA   61 LYS+   HN  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 900, 948, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  58  ILE   HA   61 LYS+   QB  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 952, 953,
 &end
#
#  58  ILE   HA   61 LYS+   QD  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 958, 959,
 &end
#
#  58  ILE   HB   58  ILE  QD1  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat= 902,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 911, 912, 913,
 &end
#
#  58  ILE   HB   59  VAL   HN  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 902, 917, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  58  ILE   HB   59  VAL  QG2  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 902,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 927, 928, 929,
 &end
#
#  58  ILE   HN   58  ILE   HB  1.80 3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 898, 902, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#  58  ILE   HN   58  ILE  QD1  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 911, 912, 913,
 &end
#
#  58  ILE   HN   58  ILE  QG1  1.80 3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 908, 909,
 &end
#
#  58  ILE   HN   58  ILE  QG2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 904, 905, 906,
 &end
#
#  58  ILE   HN   59  VAL   HN  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 898, 917, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  58  ILE   HN   59  VAL  QG2  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 927, 928, 929,
 &end
#
#  58  ILE  QD1   61 LYS+   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 948, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 911, 912, 913,
 &end
#
#  58  ILE  QD1   61 LYS+   QB  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 911, 912, 913,
 igr2= 952, 953,
 &end
#
#  58  ILE  QD1   61 LYS+   QD  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 911, 912, 913,
 igr2= 958, 959,
 &end
#
#  58  ILE  QD1   62  VAL   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 970, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 911, 912, 913,
 &end
#
#  58  ILE  QG1   59  VAL   HN  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr1= 908, 909,
 &end
#
#  58  ILE  QG1   62  VAL  QG2  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
 igr1= 908, 909,
 igr2= 980, 981, 982,
 &end
#
#  58  ILE  QG2   59  VAL   HN  1.80 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 904, 905, 906,
 &end
#
#  58  ILE  QG2   59  VAL  QG2  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr1= 904, 905, 906,
 igr2= 927, 928, 929,
 &end
#
#  58  ILE  QG2   61 LYS+   HN  1.80 5.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 948, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 904, 905, 906,
 &end
#
#  58  ILE  QG2   61 LYS+   QB  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 904, 905, 906,
 igr2= 952, 953,
 &end
#
#  58  ILE  QG2   62  VAL   HB  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 974, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 904, 905, 906,
 &end
#
#  58  ILE  QG2   62  VAL   HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 970, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 904, 905, 906,
 &end
#
#  58  ILE  QG2   62  VAL  QG1  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 904, 905, 906,
 igr2= 976, 977, 978,
 &end
#
#  58  ILE  QG2   62  VAL  QG2  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
 igr1= 904, 905, 906,
 igr2= 980, 981, 982,
 &end
#
#  59  VAL   HA   53  PHE  HD1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 833, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  59  VAL   HA   53  PHE  HD2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 841, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  59  VAL   HA   53  PHE  HE1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 835, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  59  VAL   HA   53  PHE  HE2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 839, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  59  VAL   HA   59  VAL  QG1  1.80 3.06
 &rst
  ixpk= 0, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
 igr2= 923, 924, 925,
 &end
#
#  59  VAL   HA   59  VAL  QG2  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 927, 928, 929,
 &end
#
#  59  VAL   HA   62  VAL   HB  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 974, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#  59  VAL   HA   62  VAL   HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 970, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  59  VAL   HA   62  VAL  QG1  1.80 4.84
 &rst
  ixpk= 0, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr2= 976, 977, 978,
 &end
#
#  59  VAL   HA   62  VAL  QG2  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 980, 981, 982,
 &end
#
#  59  VAL   HA   63  CYS   HN  1.80 4.98
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 986, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  59  VAL   HB   60 GLU-   HN  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 921, 933, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#  59  VAL   HB   61 LYS+   HN  1.80 5.39
 &rst
  ixpk= 0, nxpk= 0, iat= 921, 948, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  59  VAL   HN   59  VAL   HB  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 917, 921, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#  59  VAL   HN   59  VAL  QG1  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 923, 924, 925,
 &end
#
#  59  VAL   HN   59  VAL  QG2  1.80 2.96
 &rst
  ixpk= 0, nxpk= 0, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 927, 928, 929,
 &end
#
#  59  VAL   HN   60 GLU-   HN  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat= 917, 933, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#  59  VAL  QG1   60 GLU-   HA  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 935, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   60 GLU-   HN  1.80 3.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   63  CYS   HN  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 986, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+   HA  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1252, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+  HG2  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+  HG3  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1258, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1250, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+   QE  1.80 3.35
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 923, 924, 925,
 igr2=1263,1264,
 &end
#
#  59  VAL  QG2   60 GLU-   HN  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 927, 928, 929,
 &end
#
#  60 GLU-   HA   60 GLU-   QG  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 940, 941,
 &end
#
#  60 GLU-   HA   63  CYS  HB2  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 990, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  60 GLU-   HA   63  CYS  HB3  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 991, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  60 GLU-   HA   63  CYS   HN  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 986, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  60 GLU-   HA   63  CYS   QB  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 990, 991,
 &end
#
#  60 GLU-   HA   64 GLU-   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 997, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  60 GLU-   HA   79 LYS+   QE  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=1263,1264,
 &end
#
#  60 GLU-   HN   60 GLU-   QB  1.80 3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr2= 937, 938,
 &end
#
#  60 GLU-   HN   60 GLU-   QG  1.80 3.49
 &rst
  ixpk= 0, nxpk= 0, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 940, 941,
 &end
#
#  60 GLU-   HN   61 LYS+   HN  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 933, 948, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  60 GLU-   QB   61 LYS+   HN  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 948, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 937, 938,
 &end
#
#  60 GLU-   QG   61 LYS+   HN  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 948, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 940, 941,
 &end
#
#  61 LYS+   HA   61 LYS+  HG2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 955, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  61 LYS+   HA   61 LYS+  HG3  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 956, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  61 LYS+   HA   61 LYS+   QD  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 958, 959,
 &end
#
#  61 LYS+   HA   61 LYS+   QG  1.80 3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2= 955, 956,
 &end
#
#  61 LYS+   HA   64 GLU-   HN  1.80 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 997, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  61 LYS+   HA   64 GLU-   QB  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2=1001,1002,
 &end
#
#  61 LYS+  HB2   62  VAL   HN  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 952, 970, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#  61 LYS+  HB3   62  VAL   HN  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 953, 970, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#  61 LYS+   HN   61 LYS+  HB2  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 952, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  61 LYS+   HN   61 LYS+  HB3  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 953, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  61 LYS+   HN   61 LYS+  HG2  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 955, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  61 LYS+   HN   61 LYS+  HG3  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 956, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  61 LYS+   HN   61 LYS+   QG  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 948,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 955, 956,
 &end
#
#  61 LYS+   HN   62  VAL   HN  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 970, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  61 LYS+   QB   62  VAL   HN  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 970, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 952, 953,
 &end
#
#  61 LYS+   QD   62  VAL  QG2  1.80 5.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
 igr1= 958, 959,
 igr2= 980, 981, 982,
 &end
#
#  62  VAL   HA   28  PHE  HD1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 972, 436, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  62  VAL   HA   28  PHE  HD2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 972, 444, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  62  VAL   HA   28  PHE  HE1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 972, 438, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  62  VAL   HA   28  PHE  HE2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 972, 442, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  62  VAL   HA   62  VAL  QG1  1.80 3.13
 &rst
  ixpk= 0, nxpk= 0, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 976, 977, 978,
 &end
#
#  62  VAL   HA   62  VAL  QG2  1.80 3.22
 &rst
  ixpk= 0, nxpk= 0, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 980, 981, 982,
 &end
#
#  62  VAL   HA   65  ILE   HB  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 972,1016, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  62  VAL   HA   65  ILE   HN  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 972,1012, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  62  VAL   HA   65  ILE  QD1  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2=1025,1026,1027,
 &end
#
#  62  VAL   HA   65  ILE  QG2  1.80 5.02
 &rst
  ixpk= 0, nxpk= 0, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2=1018,1019,1020,
 &end
#
#  62  VAL   HA   68 HIS   HE1  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 972,1077, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  62  VAL   HA   68 HIS   HE2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 972,1079, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  62  VAL   HB   63  CYS   HN  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 974, 986, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  62  VAL   HB   68 HIS   HE1  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 974,1077, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  62  VAL   HN   62  VAL   HB  1.80 3.56
 &rst
  ixpk= 0, nxpk= 0, iat= 970, 974, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  62  VAL   HN   62  VAL  QG1  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 970,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 976, 977, 978,
 &end
#
#  62  VAL   HN   62  VAL  QG2  1.80 2.88
 &rst
  ixpk= 0, nxpk= 0, iat= 970,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr2= 980, 981, 982,
 &end
#
#  62  VAL  QG1   63  CYS   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 986, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   65  ILE   HB  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   68 HIS   HD2  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1081, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   68 HIS   HE1  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   68 HIS   HE2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1079, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   77  CYS  HB2  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1221, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   77  CYS  HB3  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1222, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG2   63  CYS   HN  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 986, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 980, 981, 982,
 &end
#
#  62  VAL  QG2   68 HIS   HE1  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 980, 981, 982,
 &end
#
#  63  CYS   HA   65  ILE   HB  1.80 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 988,1016, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#  63  CYS   HA   66 HIS    HN  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat= 988,1031, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#  63  CYS   HA   77  CYS  HB2  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 988,1221, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  63  CYS   HA   77  CYS  HB3  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 988,1222, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  63  CYS  HB2   64 GLU-   HN  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 990, 997, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  63  CYS  HB3   64 GLU-   HN  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 991, 997, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  63  CYS   HN   63  CYS  HB2  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 986, 990, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  63  CYS   HN   63  CYS  HB3  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 986, 991, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  63  CYS   HN   63  CYS   QB  1.80 3.16
 &rst
  ixpk= 0, nxpk= 0, iat= 986,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 990, 991,
 &end
#
#  63  CYS   HN   64 GLU-   HN  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 986, 997, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  63  CYS   HN   65  ILE   HN  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 986,1012, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  63  CYS   QB   64 GLU-   HN  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 990, 991,
 &end
#
#  64 GLU-   HA   64 GLU-  HG2  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 999,1004, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  64 GLU-   HA   64 GLU-  HG3  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 999,1005, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  64 GLU-   HA   64 GLU-   QG  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 999,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr2=1004,1005,
 &end
#
#  64 GLU-   HN   64 GLU-  HG2  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 997,1004, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#  64 GLU-   HN   64 GLU-  HG3  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 997,1005, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#  64 GLU-   HN   64 GLU-   QB  1.80 2.94
 &rst
  ixpk= 0, nxpk= 0, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2=1001,1002,
 &end
#
#  64 GLU-   HN   64 GLU-   QG  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1004,1005,
 &end
#
#  64 GLU-   HN   65  ILE   HN  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 997,1012, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#  64 GLU-   QB   65  ILE   HN  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1012, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1=1001,1002,
 &end
#
#  65  ILE   HA   65  ILE  QD1  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=1014,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2=1025,1026,1027,
 &end
#
#  65  ILE   HA   65  ILE  QG1  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat=1014,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1022,1023,
 &end
#
#  65  ILE   HA   65  ILE  QG2  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat=1014,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2=1018,1019,1020,
 &end
#
#  65  ILE   HB   65  ILE  QD1  1.80 2.96
 &rst
  ixpk= 0, nxpk= 0, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2=1025,1026,1027,
 &end
#
#  65  ILE   HB   66 HIS    HA  1.80 5.45
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1033, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#  65  ILE   HB   66 HIS    HN  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1031, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#  65  ILE   HB   67  PHE   HN  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1048, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  65  ILE   HB   68 HIS   HD2  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1081, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  65  ILE   HB   68 HIS   HE1  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1077, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  65  ILE   HB   68 HIS   HE2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1079, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  65  ILE   HN   65  ILE   HB  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat=1012,1016, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  65  ILE   HN   65  ILE HG12  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1012,1022, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  65  ILE   HN   65  ILE HG13  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1012,1023, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  65  ILE   HN   65  ILE  QD1  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1012,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1025,1026,1027,
 &end
#
#  65  ILE   HN   65  ILE  QG1  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat=1012,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2=1022,1023,
 &end
#
#  65  ILE   HN   65  ILE  QG2  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1012,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2=1018,1019,1020,
 &end
#
#  65  ILE   HN   66 HIS    HN  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=1012,1031, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#  65  ILE  QD1   68 HIS   HE1  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr1=1025,1026,1027,
 &end
#
#  65  ILE  QG1   68 HIS   HE1  1.80 5.17
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1=1022,1023,
 &end
#
#  65  ILE  QG2   66 HIS    HN  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=1018,1019,1020,
 &end
#
#  65  ILE  QG2   67  PHE   HN  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1048, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=1018,1019,1020,
 &end
#
#  65  ILE  QG2   68 HIS   HD2  1.80 4.86
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1081, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=1018,1019,1020,
 &end
#
#  65  ILE  QG2   68 HIS   HE1  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1=1018,1019,1020,
 &end
#
#  66 HIS    HA   77  CYS   HN  1.80 4.69
 &rst
  ixpk= 0, nxpk= 0, iat=1033,1217, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  66 HIS   HB2   67  PHE   HN  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1035,1048, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  66 HIS   HB3   67  PHE   HN  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1036,1048, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  66 HIS   HD2   76 GLU-  HG2  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=1044,1209, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  66 HIS   HD2   76 GLU-  HG3  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=1044,1210, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  66 HIS   HD2   76 GLU-   QB  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr2=1206,1207,
 &end
#
#  66 HIS   HD2   76 GLU-   QG  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr2=1209,1210,
 &end
#
#  66 HIS   HD2   76  GLU   QG  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1209,1210,
 &end
#
#  66 HIS   HD2   77  CYS   HN  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat=1044,1217, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#  66 HIS    HN   68 HIS   HE1  1.80 5.09
 &rst
  ixpk= 0, nxpk= 0, iat=1031,1077, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
#  66 HIS    HN   68 HIS   HE2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1031,1079, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  66 HIS    QB   67  PHE   HN  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1048, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1035,1036,
 &end
#
#  67  PHE   HA   67  PHE   QD  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat=1050,  -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
 igr2=1056,1064,
 &end
#
#  67  PHE   HA   68 HIS   HD2  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat=1050,1081, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  67  PHE   HA   68 HIS    HN  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat=1050,1068, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  67  PHE  HB2   74  MET   QE  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1180,1181,1182,
 &end
#
#  67  PHE  HB3   74  MET   QE  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1053,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1180,1181,1182,
 &end
#
#  67  PHE   HN   67  PHE  HB2  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1048,1052, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  67  PHE   HN   67  PHE  HB3  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1048,1053, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  67  PHE   HN   67  PHE   QB  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=1048,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2=1052,1053,
 &end
#
#  67  PHE   HN   67  PHE   QD  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat=1048,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr2=1056,1064,
 &end
#
#  67  PHE   QB   68 HIS    HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1068, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1=1052,1053,
 &end
#
#  67  PHE   QB   74  MET   QE  1.80 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1=1052,1053,
 igr2=1180,1181,1182,
 &end
#
#  67  PHE   QB   74  MET   QG  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1=1052,1053,
 igr2=1176,1177,
 &end
#
#  67  PHE   QD   68 HIS    HN  1.80 4.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1068, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1056,1064,
 &end
#
#  67  PHE   QD   74  MET   QB  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1056,1064,
 igr2=1173,1174,
 &end
#
#  67  PHE   QD   74  MET   QE  1.80 4.56
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1=1056,1064,
 igr2=1180,1181,1182,
 &end
#
#  67  PHE   QD   74  MET   QG  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1=1056,1064,
 igr2=1176,1177,
 &end
#
#  67  PHE   QE   76  GLU   QB  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1058,1062,
 igr2=1206,1207,
 &end
#
#  68 HIS    HA   69 GLU-   HN  1.80 3.06
 &rst
  ixpk= 0, nxpk= 0, iat=1070,1085, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,  &end
#
#  68 HIS   HB2   69 GLU-   HN  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=1072,1085, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  68 HIS   HB2   75  VAL  QG2  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat=1072,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1196,1197,1198,
 &end
#
#  68 HIS   HB3   69 GLU-   HN  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=1073,1085, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  68 HIS   HB3   75  VAL  QG2  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat=1073,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1196,1197,1198,
 &end
#
#  68 HIS   HD2   75  VAL  QG2  1.80 4.62
 &rst
  ixpk= 0, nxpk= 0, iat=1081,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2=1196,1197,1198,
 &end
#
#  68 HIS   HD2   77  CYS   HN  1.80 4.11
 &rst
  ixpk= 0, nxpk= 0, iat=1081,1217, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  68 HIS   HD2   77  CYS   QB  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat=1081,  -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
 igr2=1221,1222,
 &end
#
#  68 HIS    HN   68 HIS   HD2  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=1068,1081, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  68 HIS    HN   69  GLU   HN  2.70 100.00
 &rst
  ixpk= 0, nxpk= 0, iat=1068,1085, r1= 2.20, r2= 2.70, r3=100.00, r4=100.50,  &end
#
#  68 HIS    HN   74  MET   QE  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=1068,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2=1180,1181,1182,
 &end
#
#  68 HIS    HN   75  VAL   HN  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=1068,1186, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  68 HIS    HN   75  VAL  QG2  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=1068,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2=1196,1197,1198,
 &end
#
#  68 HIS    QB   69 GLU-   HN  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1085, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1=1072,1073,
 &end
#
#  68 HIS    QB   75  VAL  QG2  1.80 3.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1=1072,1073,
 igr2=1196,1197,1198,
 &end
#
#  69 GLU-  HG2   72  ASN   HA  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1135, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  69 GLU-  HG3   72  ASN   HA  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=1093,1135, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  69 GLU-   HN   69 GLU-   QG  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat=1085,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2=1092,1093,
 &end
#
#  69 GLU-   HN   74  MET   QE  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=1085,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2=1180,1181,1182,
 &end
#
#  69 GLU-   QG   70  ILE   HN  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1100, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr1=1092,1093,
 &end
#
#  69 GLU-   QG   72  ASN   HA  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1=1092,1093,
 &end
#
#  69 GLU-   QG   72  ASN   HN  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1=1092,1093,
 &end
#
#  70  ILE   HA   70  ILE HG12  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1110, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  70  ILE   HA   70  ILE HG13  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1111, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  70  ILE   HA   70  ILE  QD1  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=1102,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2=1113,1114,1115,
 &end
#
#  70  ILE   HA   70  ILE  QG1  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat=1102,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2=1110,1111,
 &end
#
#  70  ILE   HA   70  ILE  QG2  1.80 3.16
 &rst
  ixpk= 0, nxpk= 0, iat=1102,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2=1106,1107,1108,
 &end
#
#  70  ILE   HA   71  ASN   HA  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1121, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  70  ILE   HA   71  ASN   HN  1.80 3.08
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1119, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#  70  ILE   HB   70  ILE  QD1  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=1104,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2=1113,1114,1115,
 &end
#
#  70  ILE   HB   75  VAL  QG2  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=1104,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2=1196,1197,1198,
 &end
#
#  70  ILE   HN   70  ILE   HB  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1104, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  70  ILE   HN   70  ILE HG12  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1110, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  70  ILE   HN   70  ILE HG13  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1111, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  70  ILE   HN   70  ILE  QG1  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=1110,1111,
 &end
#
#  70  ILE   HN   70  ILE  QG2  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1106,1107,1108,
 &end
#
#  70  ILE   HN   73 LYS+   HN  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1147, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#  70  ILE   HN   73 LYS+   QB  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1151,1152,
 &end
#
#  70  ILE   HN   74  MET   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1169, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  70  ILE   HN   75  VAL  QG1  1.80 4.06
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1192,1193,1194,
 &end
#
#  70  ILE   HN   75  VAL  QG2  1.80 5.17
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2=1196,1197,1198,
 &end
#
#  70  ILE  QD1   75  VAL  QG2  1.80 3.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=1113,1114,1115,
 igr2=1196,1197,1198,
 &end
#
#  70  ILE  QG1   75  VAL  QG2  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1=1110,1111,
 igr2=1196,1197,1198,
 &end
#
#  70  ILE  QG2   70  ILE  QD1  1.80 2.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=1106,1107,1108,
 igr2=1113,1114,1115,
 &end
#
#  70  ILE  QG2   70  ILE  QG1  1.80 3.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,
 igr1=1106,1107,1108,
 igr2=1110,1111,
 &end
#
#  70  ILE  QG2   71  ASN   HA  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1121, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   71  ASN  HB2  1.80 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   71  ASN HD21  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1128, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   71  ASN HD22  1.80 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   71  ASN   HN  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   72  ASN   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1106,1107,1108,
 &end
#
#  71  ASN   HA   71  ASN HD21  1.80 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1128, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  71  ASN   HA   72  ASN   HN  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1133, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#  71  ASN   HN   72  ASN   HN  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1133, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  71  ASN   HN   73 LYS+   HN  1.80 4.99
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1147, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#  72  ASN   HN   72  ASN   QB  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2=1137,1138,
 &end
#
#  72  ASN   HN   73 LYS+   HN  1.80 3.56
 &rst
  ixpk= 0, nxpk= 0, iat=1133,1147, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  72  ASN   HN   73 LYS+   QB  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1151,1152,
 &end
#
#  73 LYS+   HA   74  MET   HN  1.80 3.01
 &rst
  ixpk= 0, nxpk= 0, iat=1149,1169, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,  &end
#
#  73 LYS+  HD2   74  MET   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=1157,1169, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  73 LYS+  HD3   74  MET   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=1158,1169, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  73 LYS+   HN   73 LYS+  HB2  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=1147,1151, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  73 LYS+   HN   73 LYS+  HB3  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=1147,1152, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  73 LYS+   HN   73 LYS+   QB  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=1147,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2=1151,1152,
 &end
#
#  73 LYS+   QB   73 LYS+   QE  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1=1151,1152,
 igr2=1160,1161,
 &end
#
#  73 LYS+   QB   74  MET   HN  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1=1151,1152,
 &end
#
#  73 LYS+   QD   74  MET   HN  1.80 3.92
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1157,1158,
 &end
#
#  73 LYS+   QG   73 LYS+  HE2  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1160, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1=1154,1155,
 &end
#
#  73 LYS+   QG   73 LYS+  HE3  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1=1154,1155,
 &end
#
#  73 LYS+   QG   74  MET   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1=1154,1155,
 &end
#
#  74  MET   HA   75  VAL   HN  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat=1171,1186, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  74  MET   HA   75  VAL  QG2  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=1171,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2=1196,1197,1198,
 &end
#
#  74  MET   HN   74  MET  HB2  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1169,1173, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  74  MET   HN   74  MET  HB3  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1169,1174, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  74  MET   HN   74  MET   QB  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat=1169,  -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr2=1173,1174,
 &end
#
#  74  MET   HN   74  MET   QG  1.80 3.92
 &rst
  ixpk= 0, nxpk= 0, iat=1169,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2=1176,1177,
 &end
#
#  74  MET   HN   75  VAL   HA  1.80 5.28
 &rst
  ixpk= 0, nxpk= 0, iat=1169,1188, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
#  74  MET   QB   75  VAL   HN  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1=1173,1174,
 &end
#
#  74  MET   QE   75  VAL   HN  1.80 5.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1=1180,1181,1182,
 &end
#
#  74  MET   QG   74  MET   QE  1.80 3.17
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1=1176,1177,
 igr2=1180,1181,1182,
 &end
#
#  75  VAL   HA   75  VAL  QG1  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=1188,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1192,1193,1194,
 &end
#
#  75  VAL   HA   76 GLU-   HN  1.80 3.49
 &rst
  ixpk= 0, nxpk= 0, iat=1188,1202, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  75  VAL   HB   76 GLU-   HN  1.80 3.58
 &rst
  ixpk= 0, nxpk= 0, iat=1190,1202, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#  75  VAL   HN   75  VAL   HB  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=1186,1190, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  75  VAL   HN   75  VAL  QG1  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2=1192,1193,1194,
 &end
#
#  75  VAL   HN   75  VAL  QG2  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=1196,1197,1198,
 &end
#
#  75  VAL  QG1   76 GLU-   HN  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1192,1193,1194,
 &end
#
#  75  VAL  QG2   76 GLU-   HA  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1204, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=1196,1197,1198,
 &end
#
#  75  VAL  QG2   76 GLU-   HN  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr1=1196,1197,1198,
 &end
#
#  76 GLU-   HA   77  CYS   HN  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat=1204,1217, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#  76 GLU-  HG2   77  CYS   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=1209,1217, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  76 GLU-  HG3   77  CYS   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=1210,1217, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  76 GLU-   HN   76 GLU-  HB2  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1206, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  76 GLU-   HN   76 GLU-  HB3  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1207, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  76 GLU-   HN   76 GLU-   QB  1.80 3.30
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2=1206,1207,
 &end
#
#  77  CYS   HA   78 LYS+   HN  1.80 2.96
 &rst
  ixpk= 0, nxpk= 0, iat=1219,1228, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
#  77  CYS   HA   78 LYS+   QG  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=1219,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1235,1236,
 &end
#
#  77  CYS  HB2   78 LYS+   HN  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat=1221,1228, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  77  CYS  HB3   78 LYS+   HN  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat=1222,1228, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  77  CYS   HN   77  CYS  HB2  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=1217,1221, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  77  CYS   HN   77  CYS  HB3  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=1217,1222, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  77  CYS   HN   77  CYS   QB  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=1217,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2=1221,1222,
 &end
#
#  77  CYS   HN   78 LYS+   HN  1.80 4.95
 &rst
  ixpk= 0, nxpk= 0, iat=1217,1228, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  77  CYS   QB   78 LYS+   HN  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1=1221,1222,
 &end
#
#  78 LYS+   HA   79 LYS+   HN  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat=1230,1250, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#  78 LYS+  HG2   78 LYS+   QE  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2=1241,1242,
 &end
#
#  78 LYS+  HG3   78 LYS+   QE  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1236,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2=1241,1242,
 &end
#
#  78 LYS+   HN   78 LYS+  HG2  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=1228,1235, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  78 LYS+   HN   78 LYS+  HG3  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=1228,1236, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  78 LYS+   HN   78 LYS+   QB  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1228,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2=1232,1233,
 &end
#
#  78 LYS+   HN   79 LYS+   HN  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=1228,1250, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#  78 LYS+   QB   78 LYS+   QE  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1=1232,1233,
 igr2=1241,1242,
 &end
#
#  78 LYS+   QB   79 LYS+   HN  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1250, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1=1232,1233,
 &end
#
#  78 LYS+   QG   78 LYS+   QE  1.80 3.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1=1235,1236,
 igr2=1241,1242,
 &end
#
#  79 LYS+   HA   79 LYS+  HG2  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1257, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  79 LYS+   HA   79 LYS+  HG3  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1258, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  79 LYS+   HA   80  ALA   HN  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1272, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  79 LYS+   HA   80  ALA   QB  1.80 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=1252,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2=1276,1277,1278,
 &end
#
#  79 LYS+  HB2   80  ALA   HN  1.80 4.77
 &rst
  ixpk= 0, nxpk= 0, iat=1254,1272, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#  79 LYS+  HB3   80  ALA   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat=1255,1272, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  79 LYS+  HG2   79 LYS+   QE  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2=1263,1264,
 &end
#
#  79 LYS+  HG3   79 LYS+   QE  1.80 2.94
 &rst
  ixpk= 0, nxpk= 0, iat=1258,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2=1263,1264,
 &end
#
#  79 LYS+  HG3   80  ALA   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1258,1272, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  79 LYS+   HN   79 LYS+  HB2  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat=1250,1254, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
#  79 LYS+   HN   79 LYS+  HB3  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat=1250,1255, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  79 LYS+   HN   79 LYS+  HG2  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=1250,1257, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#  79 LYS+   HN   79 LYS+  HG3  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=1250,1258, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  80  ALA   HA   81  GLN   HN  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=1274,1282, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#  80  ALA   HN   80  ALA   QB  1.80 3.07
 &rst
  ixpk= 0, nxpk= 0, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2=1276,1277,1278,
 &end
#
#  80  ALA   QB   81  GLN   HN  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1282, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1=1276,1277,1278,
 &end
#
#  81  GLN   HA   82  PRO  HD2  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1300, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#  81  GLN   HA   82  PRO  HD3  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1301, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#  81  GLN   HN   81  GLN   QG  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1282,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2=1289,1290,
 &end
#
#  81  GLN   QB   82  PRO   QD  1.80 4.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=1286,1287,
 igr2=1300,1301,
 &end
#
#  81  GLN   QG   82  PRO  HD2  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1300, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1=1289,1290,
 &end
#
#  81  GLN   QG   82  PRO  HD3  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1301, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1=1289,1290,
 &end
#
#  81  GLN   QG   82  PRO   QD  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=1289,1290,
 igr2=1300,1301,
 &end
#
#  82  PRO  HB2   83 LYS+   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=1306,1313, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  82  PRO  HB3   83 LYS+   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=1307,1313, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  82  PRO  HD2   85  VAL  QG1  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=1300,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1356,1357,1358,
 &end
#
#  82  PRO  HD2   85  VAL  QG2  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=1300,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1360,1361,1362,
 &end
#
#  82  PRO  HD3   85  VAL  QG1  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=1301,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1356,1357,1358,
 &end
#
#  82  PRO  HD3   85  VAL  QG2  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=1301,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1360,1361,1362,
 &end
#
#  82  PRO   QB   83 LYS+   HN  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1313, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1=1306,1307,
 &end
#
#  82  PRO   QB   85  VAL  QQG  1.80 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
 igr1=1306,1307,
 igr2=1356,1357,1358,1360,1361,1362,
 &end
#
#  82  PRO   QD   85  VAL  QQG  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1=1300,1301,
 igr2=1356,1357,1358,1360,1361,1362,
 &end
#
#  82  PRO   QG   85  VAL   HN  1.80 5.05
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1303,1304,
 &end
#
#  82  PRO   QG   85  VAL  QQG  1.80 3.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1=1303,1304,
 igr2=1356,1357,1358,1360,1361,1362,
 &end
#
#  83 LYS+   HA   83 LYS+   QG  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=1315,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2=1320,1321,
 &end
#
#  83 LYS+   HA   84 GLU-   HN  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat=1315,1335, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#  83 LYS+   HN   83 LYS+   QB  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat=1313,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1317,1318,
 &end
#
#  83 LYS+   HN   83 LYS+   QG  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat=1313,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2=1320,1321,
 &end
#
#  83 LYS+   HN   84 GLU-   HN  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=1313,1335, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  83 LYS+   QB   84 GLU-   HN  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1=1317,1318,
 &end
#
#  83 LYS+   QG   83 LYS+   QE  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1=1320,1321,
 igr2=1326,1327,
 &end
#
#  83 LYS+   QG   84 GLU-   HN  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1=1320,1321,
 &end
#
#  84 GLU-   HA   84 GLU-   QG  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat=1337,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2=1342,1343,
 &end
#
#  84 GLU-   HA   85  VAL   HN  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat=1337,1350, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  84 GLU-   HA   86  MET   HN  1.80 5.04
 &rst
  ixpk= 0, nxpk= 0, iat=1337,1366, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#  84 GLU-   HN   84 GLU-  HB2  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=1335,1339, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  84 GLU-   HN   84 GLU-  HB3  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=1335,1340, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  84 GLU-   HN   84 GLU-   QB  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2=1339,1340,
 &end
#
#  84 GLU-   HN   84 GLU-   QG  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1342,1343,
 &end
#
#  84 GLU-   HN   85  VAL   HN  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=1335,1350, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  85  VAL   HA   85  VAL  QG1  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2=1356,1357,1358,
 &end
#
#  85  VAL   HA   85  VAL  QG2  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2=1360,1361,1362,
 &end
#
#  85  VAL   HA   86  MET   HN  1.80 3.56
 &rst
  ixpk= 0, nxpk= 0, iat=1352,1366, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  85  VAL   HN   85  VAL   HB  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat=1350,1354, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#  85  VAL   HN   85  VAL  QG1  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2=1356,1357,1358,
 &end
#
#  85  VAL   HN   85  VAL  QG2  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2=1360,1361,1362,
 &end
#
#  85  VAL   HN   85  VAL  QQG  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=1356,1357,1358,1360,1361,1362,
 &end
#
#  85  VAL   HN   86  MET   HN  1.80 3.42
 &rst
  ixpk= 0, nxpk= 0, iat=1350,1366, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#  85  VAL   HN   86  MET   QB  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1370,1371,
 &end
#
#  85  VAL  QG1   86  MET   HN  1.80 4.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1366, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1=1356,1357,1358,
 &end
#
#  85  VAL  QG2   86  MET   HN  1.80 4.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1366, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1=1360,1361,1362,
 &end
#
#  85  VAL  QQG   86  MET   HN  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1366, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1=1356,1357,1358,1360,1361,1362,
 &end
#
#  85  VAL  QQG   86  MET   QB  1.80 5.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
 igr1=1356,1357,1358,1360,1361,1362,
 igr2=1370,1371,
 &end
#
#  85  VAL  QQG   86  MET   QG  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1=1356,1357,1358,1360,1361,1362,
 igr2=1373,1374,
 &end
#
#  86  MET   HA   86  MET   QE  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat=1368,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2=1377,1378,1379,
 &end
#
#  86  MET   HA   87  SER   HN  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat=1368,1383, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#  86  MET   HN   86  MET  HB2  1.80 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=1366,1370, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  86  MET   HN   86  MET  HB3  1.80 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=1366,1371, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  86  MET   HN   86  MET   QB  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=1366,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2=1370,1371,
 &end
#
#  86  MET   HN   86  MET   QG  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=1366,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2=1373,1374,
 &end
#
#  86  MET   HN   87  SER   HA  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat=1366,1385, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
#  86  MET   HN   87  SER   HN  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1366,1383, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  87  SER   HA   88  PRO   QD  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=1385,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2=1395,1396,
 &end
#
#  87  SER   HN   87  SER   QB  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1387,1388,
 &end
#
#  97   G   H8   14  VAL  QG1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 205, 206, 207,
 &end
#
#  97   G   H8   14  VAL  QG2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 209, 210, 211,
 &end
#
#  97   G   H8   97   G  H1'  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1528,1525, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  98   U  H1'    8  PHE   QD  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1559,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 127, 135,
 &end
#
#  98   U  H1'   98   U  H2'  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=1559,1574, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  98   U   H6   10  GLY   QA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1562,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 157, 158,
 &end
#
#  98   U   H6   11  GLY   QA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1562,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 164, 165,
 &end
#
#  98   U   H6   98   U  H1'  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1562,1559, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  99   A  H1'   99   A  H2'  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=1589,1607, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  99   A   H2  100   G   Q2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1634,1635,
 &end
#
#  99   A   H2   50  PHE   QD  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 783, 791,
 &end
#
#  99   A   H2   50  PHE   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 785, 789,
 &end
#
#  99   A   H2   80  ALA   HA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1274, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  99   A   H2   80  ALA   QB  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1276,1277,1278,
 &end
#
#  99   A   H2   81  GLN   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1282, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  99   A   H8   99   A  H1'  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1592,1589, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100   G  H1'  100   G  H2'  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1622,1641, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 100   G  H1'   35  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1622,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 538, 539, 540,
 &end
#
# 100   G  H1'   37  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1622,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 574, 575, 576,
 &end
#
# 100   G   H8  100   G  H1'  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,1622, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 100   G   H8   35  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 538, 539, 540,
 &end
#
# 100   G   H8   35  MET   QG  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 534, 535,
 &end
#
# 100   G   H8   37  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 574, 575, 576,
 &end
#
# 100   G   H8   50  PHE   QD  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 783, 791,
 &end
#
# 100   G   H8   50  PHE   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 785, 789,
 &end
#
# 100   G   Q2   81  GLN   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1282, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1634,1635,
 &end
#
# 100   G   Q2   83  LYS   HA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1315, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1634,1635,
 &end
#
# 100   G   Q2   83  LYS   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1313, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1634,1635,
 &end
#
# 100   G   Q2   84  GLU   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1634,1635,
 &end
#
# 100   G   Q2   86  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1634,1635,
 igr2=1377,1378,1379,
 &end
#
# 100   G   Q2   86  MET   QG  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1634,1635,
 igr2=1373,1374,
 &end
#
# 100   G   Q2    8  PHE   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1634,1635,
 igr2= 129, 133,
 &end
#
# 101   U   H6   35  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1659,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 538, 539, 540,
 &end
#
# 101   U   H6   37  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1659,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 574, 575, 576,
 &end
# 1675 atoms read from pdb file leap.pdb.
# 7 ILE CHI1:  (7 ILE N)-(7 ILE CA)-(7 ILE CB)-(7 ILE CG1)  40.0  80.0
 &rst     iat =    99,   101,   103,   109,
	  r1 =  39.0, r2 =  40.0, r3 =  80.0, r4 =  81.0,
	  rk2 = 60.0, rk3 = 60.0,				&end
# 8 PHE CHI1:  (8 PHE N)-(8 PHE CA)-(8 PHE CB)-(8 PHE CG) 160.0 200.0
 &rst     iat =   118,   120,   122,   125,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 9 VAL CHI1:  (9 VAL N)-(9 VAL CA)-(9 VAL CB)-(9 VAL CG1) 160.0 200.0
 &rst     iat =   138,   140,   142,   144,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 12 LEU CHI1:  (12 LEU N)-(12 LEU CA)-(12 LEU CB)-(12 LEU CG) -80.0 -40.0
 &rst     iat =   168,   170,   172,   175,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 12 LEU CHI2:  (12 LEU CA)-(12 LEU CB)-(12 LEU CG)-(12 LEU CD1) 160.0 200.0
 &rst     iat =   170,   172,   175,   177,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 21 VAL CHI1:  (21 VAL N)-(21 VAL CA)-(21 VAL CB)-(21 VAL CG1) 160.0 200.0
 &rst     iat =   299,   301,   303,   305,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 25 PHE CHI1:  (25 PHE N)-(25 PHE CA)-(25 PHE CB)-(25 PHE CG) -80.0 -40.0
 &rst     iat =   375,   377,   379,   382,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 31 VAL CHI1:  (31 VAL N)-(31 VAL CA)-(31 VAL CB)-(31 VAL CG1) 160.0 200.0
 &rst     iat =   476,   478,   480,   482,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 36 LEU CHI1:  (36 LEU N)-(36 LEU CA)-(36 LEU CB)-(36 LEU CG) -80.0 -40.0
 &rst     iat =   543,   545,   547,   550,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 36 LEU CHI2:  (36 LEU CA)-(36 LEU CB)-(36 LEU CG)-(36 LEU CD1) 160.0 200.0
 &rst     iat =   545,   547,   550,   552,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 38 PHE CHI1:  (38 PHE N)-(38 PHE CA)-(38 PHE CB)-(38 PHE CG) -80.0 -40.0
 &rst     iat =   579,   581,   583,   586,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 48 PHE CHI1:  (48 PHE N)-(48 PHE CA)-(48 PHE CB)-(48 PHE CG)  40.0  80.0
 &rst     iat =   747,   749,   751,   754,
	  r1 =  39.0, r2 =  40.0, r3 =  80.0, r4 =  81.0,
	&end
# 51 VAL CHI1:  (51 VAL N)-(51 VAL CA)-(51 VAL CB)-(51 VAL CG1) 160.0 200.0
 &rst     iat =   794,   796,   798,   800,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 58 ILE CHI1:  (58 ILE N)-(58 ILE CA)-(58 ILE CB)-(58 ILE CG1) -80.0 -40.0
 &rst     iat =   897,   899,   901,   907,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 59 VAL CHI1:  (59 VAL N)-(59 VAL CA)-(59 VAL CB)-(59 VAL CG1) 160.0 200.0
 &rst     iat =   916,   918,   920,   922,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 62 VAL CHI1:  (62 VAL N)-(62 VAL CA)-(62 VAL CB)-(62 VAL CG1) 160.0 200.0
 &rst     iat =   969,   971,   973,   975,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 70 ILE CHI1:  (70 ILE N)-(70 ILE CA)-(70 ILE CB)-(70 ILE CG1) -80.0 -40.0
 &rst     iat =  1099,  1101,  1103,  1109,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 70 ILE CHI21:  (70 ILE CA)-(70 ILE CB)-(70 ILE CG1)-(70 ILE CD1) 160.0 200.0
 &rst     iat =  1101,  1103,  1109,  1112,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 75 VAL CHI1:  (75 VAL N)-(75 VAL CA)-(75 VAL CB)-(75 VAL CG1) -80.0 -40.0
 &rst     iat =  1185,  1187,  1189,  1191,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 97 RG NU0:  (97 G5 C4')-(97 G5 O4')-(97 G5 C1')-(97 G5 C2') -37.3  -7.3
 &rst     iat =  1521,  1523,  1524,  1543,
	  r1 = -38.3, r2 = -37.3, r3 =  -7.3, r4 =  -6.3,
	&end
# 97 RG NU1:  (97 G5 O4')-(97 G5 C1')-(97 G5 C2')-(97 G5 C3')  19.8  49.8
 &rst     iat =  1523,  1524,  1543,  1541,
	  r1 =  18.8, r2 =  19.8, r3 =  49.8, r4 =  50.8,
	&end
# 97 RG NU2:  (97 G5 C1')-(97 G5 C2')-(97 G5 C3')-(97 G5 C4') -49.0 -19.0
 &rst     iat =  1524,  1543,  1541,  1521,
	  r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0,
	&end
# 97 RG NU3:  (97 G5 C2')-(97 G5 C3')-(97 G5 C4')-(97 G5 O4')   5.2  35.2
 &rst     iat =  1543,  1541,  1521,  1523,
	  r1 =   4.2, r2 =   5.2, r3 =  35.2, r4 =  36.2,
	&end
# 97 RG NU4:  (97 G5 C3')-(97 G5 C4')-(97 G5 O4')-(97 G5 C1') -13.7  16.3
 &rst     iat =  1541,  1521,  1523,  1524,
	  r1 = -14.7, r2 = -13.7, r3 =  16.3, r4 =  17.3,
	&end
# 98 RU CHI:  (98 U O4')-(98 U C1')-(98 U N1)-(98 U C2) 120.0 300.0
 &rst     iat =  1557,  1558,  1560,  1569,
	  r1 = 119.0, r2 = 120.0, r3 = 300.0, r4 = 301.0,
	&end
# 98 RU NU0:  (98 U C4')-(98 U O4')-(98 U C1')-(98 U C2') -37.3  -7.3
 &rst     iat =  1555,  1557,  1558,  1573,
	  r1 = -38.3, r2 = -37.3, r3 =  -7.3, r4 =  -6.3,
	&end
# 98 RU NU1:  (98 U O4')-(98 U C1')-(98 U C2')-(98 U C3')  19.8  49.8
 &rst     iat =  1557,  1558,  1573,  1571,
	  r1 =  18.8, r2 =  19.8, r3 =  49.8, r4 =  50.8,
	&end
# 98 RU NU2:  (98 U C1')-(98 U C2')-(98 U C3')-(98 U C4') -49.0 -19.0
 &rst     iat =  1558,  1573,  1571,  1555,
	  r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0,
	&end
# 98 RU NU3:  (98 U C2')-(98 U C3')-(98 U C4')-(98 U O4')   5.2  35.2
 &rst     iat =  1573,  1571,  1555,  1557,
	  r1 =   4.2, r2 =   5.2, r3 =  35.2, r4 =  36.2,
	&end
# 98 RU NU4:  (98 U C3')-(98 U C4')-(98 U O4')-(98 U C1') -13.7  16.3
 &rst     iat =  1571,  1555,  1557,  1558,
	  r1 = -14.7, r2 = -13.7, r3 =  16.3, r4 =  17.3,
	&end
# 99 RA CHI:  (99 A O4')-(99 A C1')-(99 A N9)-(99 A C4) 120.0 300.0
 &rst     iat =  1587,  1588,  1590,  1603,
	  r1 = 119.0, r2 = 120.0, r3 = 300.0, r4 = 301.0,
	&end
# 100 RG CHI:  (100 G O4')-(100 G C1')-(100 G N9)-(100 G C4) -30.0  90.0
 &rst     iat =  1620,  1621,  1623,  1637,
	  r1 = -31.0, r2 = -30.0, r3 =  90.0, r4 =  91.0,
	&end
# 100 RG NU0:  (100 G C4')-(100 G O4')-(100 G C1')-(100 G C2') -37.3  -7.3
 &rst     iat =  1618,  1620,  1621,  1640,
	  r1 = -38.3, r2 = -37.3, r3 =  -7.3, r4 =  -6.3,
	&end
# 100 RG NU1:  (100 G O4')-(100 G C1')-(100 G C2')-(100 G C3')  19.8  49.8
 &rst     iat =  1620,  1621,  1640,  1638,
	  r1 =  18.8, r2 =  19.8, r3 =  49.8, r4 =  50.8,
	&end
# 100 RG NU2:  (100 G C1')-(100 G C2')-(100 G C3')-(100 G C4') -49.0 -19.0
 &rst     iat =  1621,  1640,  1638,  1618,
	  r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0,
	&end
# 100 RG NU3:  (100 G C2')-(100 G C3')-(100 G C4')-(100 G O4')   5.2  35.2
 &rst     iat =  1640,  1638,  1618,  1620,
	  r1 =   4.2, r2 =   5.2, r3 =  35.2, r4 =  36.2,
	&end
# 100 RG NU4:  (100 G C3')-(100 G C4')-(100 G O4')-(100 G C1') -13.7  16.3
 &rst     iat =  1638,  1618,  1620,  1621,
	  r1 = -14.7, r2 = -13.7, r3 =  16.3, r4 =  17.3,
	&end
# 101 RU NU0:  (101 U3 C4')-(101 U3 O4')-(101 U3 C1')-(101 U3 C2') -37.3  -7.3
 &rst     iat =  1652,  1654,  1655,  1670,
	  r1 = -38.3, r2 = -37.3, r3 =  -7.3, r4 =  -6.3,
	&end
# 101 RU NU1:  (101 U3 O4')-(101 U3 C1')-(101 U3 C2')-(101 U3 C3')  19.8  49.8
 &rst     iat =  1654,  1655,  1670,  1668,
	  r1 =  18.8, r2 =  19.8, r3 =  49.8, r4 =  50.8,
	&end
# 101 RU NU2:  (101 U3 C1')-(101 U3 C2')-(101 U3 C3')-(101 U3 C4') -49.0 -19.0
 &rst     iat =  1655,  1670,  1668,  1652,
	  r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0,
	&end
# 101 RU NU3:  (101 U3 C2')-(101 U3 C3')-(101 U3 C4')-(101 U3 O4')   5.2  35.2
 &rst     iat =  1670,  1668,  1652,  1654,
	  r1 =   4.2, r2 =   5.2, r3 =  35.2, r4 =  36.2,
	&end
# 101 RU NU4:  (101 U3 C3')-(101 U3 C4')-(101 U3 O4')-(101 U3 C1') -13.7  16.3
 &rst     iat =  1668,  1652,  1654,  1655,
	  r1 = -14.7, r2 = -13.7, r3 =  16.3, r4 =  17.3,
	&end
# Restraints file 2: RST_uXsuBKA.disang
#
#  chirality for residue 1 atoms:  N C HA2 HA3
 &rst iat=1,8,6,7, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 250., rk3 = 250.,  &end
#
#  chirality for residue 2 atoms:  CA OG HB2 HB3
 &rst iat=12,17,15,16, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=10,19,13,14, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=23,28,26,27, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=21,36,24,25, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=40,45,43,44, &end
#
#  chirality for residue 4 atoms:  CB SD HG2 HG3
 &rst iat=42,48,46,47, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=38,53,41,42, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=57,62,60,61, &end
#
#  chirality for residue 5 atoms:  CB CD HG2 HG3
 &rst iat=59,65,63,64, &end
#
#  chirality for residue 5 atoms:  CD NZ HE2 HE3
 &rst iat=65,71,69,70, &end
#
#  chirality for residue 5 atoms:  CG CE HD2 HD3
 &rst iat=62,68,66,67, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=55,75,58,59, &end
#
#  chirality for residue 6 atoms:  CA CG HB2 HB3
 &rst iat=79,84,82,83, &end
#
#  chirality for residue 6 atoms:  CB CD HG2 HG3
 &rst iat=81,87,85,86, &end
#
#  chirality for residue 6 atoms:  CD NZ HE2 HE3
 &rst iat=87,93,91,92, &end
#
#  chirality for residue 6 atoms:  CG CE HD2 HD3
 &rst iat=84,90,88,89, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=77,97,80,81, &end
#
#  chirality for residue 7 atoms:  CA CG2 CG1 HB
 &rst iat=101,105,109,104, &end
#
#  chirality for residue 7 atoms:  CB CD1 HG12 HG13
 &rst iat=103,112,110,111, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=99,116,102,103, &end
#
#  chirality for residue 8 atoms:  CA CG HB2 HB3
 &rst iat=120,125,123,124, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=118,136,121,122, &end
#
#  chirality for residue 9 atoms:  CA CG1 CG2 HB
 &rst iat=140,144,148,143, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=138,152,141,142, &end
#
#  chirality for residue 10 atoms:  N C HA2 HA3
 &rst iat=154,159,157,158, &end
#
#  chirality for residue 11 atoms:  N C HA2 HA3
 &rst iat=161,166,164,165, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=170,175,173,174, &end
#
#  chirality for residue 12 atoms:  CB CD1 CD2 HG
 &rst iat=172,177,181,176, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=168,185,171,172, &end
#
#  chirality for residue 13 atoms:  CA OG HB2 HB3
 &rst iat=189,194,192,193, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=187,196,190,191, &end
#
#  chirality for residue 14 atoms:  CA CG1 CG2 HB
 &rst iat=200,204,208,203, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=198,212,201,202, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=216,221,219,220, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=214,226,217,218, &end
#
#  chirality for residue 16 atoms:  CA CG2 OG1 HB
 &rst iat=230,234,238,233, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=228,240,231,232, &end
#
#  chirality for residue 17 atoms:  CA CG2 OG1 HB
 &rst iat=244,248,252,247, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=242,254,245,246, &end
#
#  chirality for residue 18 atoms:  CA CG1 CG2 HB
 &rst iat=258,262,266,261, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=256,270,259,260, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=274,279,277,278, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=276,282,280,281, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=272,285,275,276, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=289,294,292,293, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=287,297,290,291, &end
#
#  chirality for residue 21 atoms:  CA CG1 CG2 HB
 &rst iat=301,305,309,304, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=299,313,302,303, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=317,322,320,321, &end
#
#  chirality for residue 22 atoms:  CB CD HG2 HG3
 &rst iat=319,325,323,324, &end
#
#  chirality for residue 22 atoms:  CD NZ HE2 HE3
 &rst iat=325,331,329,330, &end
#
#  chirality for residue 22 atoms:  CG CE HD2 HD3
 &rst iat=322,328,326,327, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=315,335,318,319, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=339,344,342,343, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=337,352,340,341, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=356,361,359,360, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=354,373,357,358, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=377,382,380,381, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=375,393,378,379, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=397,402,400,401, &end
#
#  chirality for residue 26 atoms:  CB CD HG2 HG3
 &rst iat=399,405,403,404, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=395,408,398,399, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=412,417,415,416, &end
#
#  chirality for residue 27 atoms:  CB CD HG2 HG3
 &rst iat=414,420,418,419, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=410,425,413,414, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=429,434,432,433, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=427,445,430,431, &end
#
#  chirality for residue 29 atoms:  N C HA2 HA3
 &rst iat=447,452,450,451, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=456,461,459,460, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=458,464,462,463, &end
#
#  chirality for residue 30 atoms:  CD NZ HE2 HE3
 &rst iat=464,470,468,469, &end
#
#  chirality for residue 30 atoms:  CG CE HD2 HD3
 &rst iat=461,467,465,466, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=454,474,457,458, &end
#
#  chirality for residue 31 atoms:  CA CG1 CG2 HB
 &rst iat=478,482,486,481, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=476,490,479,480, &end
#
#  chirality for residue 32 atoms:  CA CG HB2 HB3
 &rst iat=494,499,497,498, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=492,502,495,496, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=506,511,509,510, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=504,514,507,508, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=516,524,519,520, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=528,533,531,532, &end
#
#  chirality for residue 35 atoms:  CB SD HG2 HG3
 &rst iat=530,536,534,535, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=526,541,529,530, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=545,550,548,549, &end
#
#  chirality for residue 36 atoms:  CB CD1 CD2 HG
 &rst iat=547,552,556,551, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=543,560,546,547, &end
#
#  chirality for residue 37 atoms:  CA CG HB2 HB3
 &rst iat=564,569,567,568, &end
#
#  chirality for residue 37 atoms:  CB SD HG2 HG3
 &rst iat=566,572,570,571, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=562,577,565,566, &end
#
#  chirality for residue 38 atoms:  CA CG HB2 HB3
 &rst iat=581,586,584,585, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=579,597,582,583, &end
#
#  chirality for residue 39 atoms:  CA CG HB2 HB3
 &rst iat=601,606,604,605, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=599,609,602,603, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=613,618,616,617, &end
#
#  chirality for residue 40 atoms:  CB CD HG2 HG3
 &rst iat=615,621,619,620, &end
#
#  chirality for residue 40 atoms:  CD NZ HE2 HE3
 &rst iat=621,627,625,626, &end
#
#  chirality for residue 40 atoms:  CG CE HD2 HD3
 &rst iat=618,624,622,623, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=611,631,614,615, &end
#
#  chirality for residue 41 atoms:  CA CG2 OG1 HB
 &rst iat=635,639,643,638, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=633,645,636,637, &end
#
#  chirality for residue 42 atoms:  CA CG2 OG1 HB
 &rst iat=649,653,657,652, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=647,659,650,651, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=663,668,666,667, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=661,673,664,665, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=677,682,680,681, &end
#
#  chirality for residue 44 atoms:  CB CD HG2 HG3
 &rst iat=679,685,683,684, &end
#
#  chirality for residue 44 atoms:  CG NE HD2 HD3
 &rst iat=682,688,686,687, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=675,697,678,679, &end
#
#  chirality for residue 45 atoms:  CA CG HB2 HB3
 &rst iat=701,706,704,705, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=699,714,702,703, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=718,723,721,722, &end
#
#  chirality for residue 46 atoms:  CB CD HG2 HG3
 &rst iat=720,726,724,725, &end
#
#  chirality for residue 46 atoms:  CG NE HD2 HD3
 &rst iat=723,729,727,728, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=716,738,719,720, &end
#
#  chirality for residue 47 atoms:  N C HA2 HA3
 &rst iat=740,745,743,744, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=749,754,752,753, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=747,765,750,751, &end
#
#  chirality for residue 49 atoms:  N C HA2 HA3
 &rst iat=767,772,770,771, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=776,781,779,780, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=774,792,777,778, &end
#
#  chirality for residue 51 atoms:  CA CG1 CG2 HB
 &rst iat=796,800,804,799, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=794,808,797,798, &end
#
#  chirality for residue 52 atoms:  CA CG2 OG1 HB
 &rst iat=812,816,820,815, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=810,822,813,814, &end
#
#  chirality for residue 53 atoms:  CA CG HB2 HB3
 &rst iat=826,831,829,830, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=824,842,827,828, &end
#
#  chirality for residue 54 atoms:  CA CG HB2 HB3
 &rst iat=846,851,849,850, &end
#
#  chirality for residue 54 atoms:  CB CD HG2 HG3
 &rst iat=848,854,852,853, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=844,857,847,848, &end
#
#  chirality for residue 55 atoms:  CA OG HB2 HB3
 &rst iat=861,866,864,865, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=859,868,862,863, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=872,877,875,876, &end
#
#  chirality for residue 56 atoms:  CB CD HG2 HG3
 &rst iat=874,880,878,879, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=870,883,873,874, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=887,892,890,891, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=885,895,888,889, &end
#
#  chirality for residue 58 atoms:  CA CG2 CG1 HB
 &rst iat=899,903,907,902, &end
#
#  chirality for residue 58 atoms:  CB CD1 HG12 HG13
 &rst iat=901,910,908,909, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=897,914,900,901, &end
#
#  chirality for residue 59 atoms:  CA CG1 CG2 HB
 &rst iat=918,922,926,921, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=916,930,919,920, &end
#
#  chirality for residue 60 atoms:  CA CG HB2 HB3
 &rst iat=934,939,937,938, &end
#
#  chirality for residue 60 atoms:  CB CD HG2 HG3
 &rst iat=936,942,940,941, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=932,945,935,936, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=949,954,952,953, &end
#
#  chirality for residue 61 atoms:  CB CD HG2 HG3
 &rst iat=951,957,955,956, &end
#
#  chirality for residue 61 atoms:  CD NZ HE2 HE3
 &rst iat=957,963,961,962, &end
#
#  chirality for residue 61 atoms:  CG CE HD2 HD3
 &rst iat=954,960,958,959, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=947,967,950,951, &end
#
#  chirality for residue 62 atoms:  CA CG1 CG2 HB
 &rst iat=971,975,979,974, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=969,983,972,973, &end
#
#  chirality for residue 63 atoms:  CA SG HB2 HB3
 &rst iat=987,992,990,991, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=985,994,988,989, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=998,1003,1001,1002, &end
#
#  chirality for residue 64 atoms:  CB CD HG2 HG3
 &rst iat=1000,1006,1004,1005, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=996,1009,999,1000, &end
#
#  chirality for residue 65 atoms:  CA CG2 CG1 HB
 &rst iat=1013,1017,1021,1016, &end
#
#  chirality for residue 65 atoms:  CB CD1 HG12 HG13
 &rst iat=1015,1024,1022,1023, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=1011,1028,1014,1015, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=1032,1037,1035,1036, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1030,1045,1033,1034, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=1049,1054,1052,1053, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1047,1065,1050,1051, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1069,1074,1072,1073, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1067,1082,1070,1071, &end
#
#  chirality for residue 69 atoms:  CA CG HB2 HB3
 &rst iat=1086,1091,1089,1090, &end
#
#  chirality for residue 69 atoms:  CB CD HG2 HG3
 &rst iat=1088,1094,1092,1093, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1084,1097,1087,1088, &end
#
#  chirality for residue 70 atoms:  CA CG2 CG1 HB
 &rst iat=1101,1105,1109,1104, &end
#
#  chirality for residue 70 atoms:  CB CD1 HG12 HG13
 &rst iat=1103,1112,1110,1111, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1099,1116,1102,1103, &end
#
#  chirality for residue 71 atoms:  CA CG HB2 HB3
 &rst iat=1120,1125,1123,1124, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1118,1130,1121,1122, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1134,1139,1137,1138, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1132,1144,1135,1136, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1148,1153,1151,1152, &end
#
#  chirality for residue 73 atoms:  CB CD HG2 HG3
 &rst iat=1150,1156,1154,1155, &end
#
#  chirality for residue 73 atoms:  CD NZ HE2 HE3
 &rst iat=1156,1162,1160,1161, &end
#
#  chirality for residue 73 atoms:  CG CE HD2 HD3
 &rst iat=1153,1159,1157,1158, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1146,1166,1149,1150, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1170,1175,1173,1174, &end
#
#  chirality for residue 74 atoms:  CB SD HG2 HG3
 &rst iat=1172,1178,1176,1177, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1168,1183,1171,1172, &end
#
#  chirality for residue 75 atoms:  CA CG1 CG2 HB
 &rst iat=1187,1191,1195,1190, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1185,1199,1188,1189, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1203,1208,1206,1207, &end
#
#  chirality for residue 76 atoms:  CB CD HG2 HG3
 &rst iat=1205,1211,1209,1210, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1201,1214,1204,1205, &end
#
#  chirality for residue 77 atoms:  CA SG HB2 HB3
 &rst iat=1218,1223,1221,1222, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1216,1225,1219,1220, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1229,1234,1232,1233, &end
#
#  chirality for residue 78 atoms:  CB CD HG2 HG3
 &rst iat=1231,1237,1235,1236, &end
#
#  chirality for residue 78 atoms:  CD NZ HE2 HE3
 &rst iat=1237,1243,1241,1242, &end
#
#  chirality for residue 78 atoms:  CG CE HD2 HD3
 &rst iat=1234,1240,1238,1239, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1227,1247,1230,1231, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1251,1256,1254,1255, &end
#
#  chirality for residue 79 atoms:  CB CD HG2 HG3
 &rst iat=1253,1259,1257,1258, &end
#
#  chirality for residue 79 atoms:  CD NZ HE2 HE3
 &rst iat=1259,1265,1263,1264, &end
#
#  chirality for residue 79 atoms:  CG CE HD2 HD3
 &rst iat=1256,1262,1260,1261, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1249,1269,1252,1253, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1271,1279,1274,1275, &end
#
#  chirality for residue 81 atoms:  CA CG HB2 HB3
 &rst iat=1283,1288,1286,1287, &end
#
#  chirality for residue 81 atoms:  CB CD HG2 HG3
 &rst iat=1285,1291,1289,1290, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1281,1296,1284,1285, &end
#
#  chirality for residue 82 atoms:  CA CG HB2 HB3
 &rst iat=1308,1302,1306,1307, &end
#
#  chirality for residue 82 atoms:  CB CD HG2 HG3
 &rst iat=1305,1299,1303,1304, &end
#
#  chirality for residue 82 atoms:  CG N HD2 HD3
 &rst iat=1302,1298,1300,1301, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1298,1310,1309,1305, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1314,1319,1317,1318, &end
#
#  chirality for residue 83 atoms:  CB CD HG2 HG3
 &rst iat=1316,1322,1320,1321, &end
#
#  chirality for residue 83 atoms:  CD NZ HE2 HE3
 &rst iat=1322,1328,1326,1327, &end
#
#  chirality for residue 83 atoms:  CG CE HD2 HD3
 &rst iat=1319,1325,1323,1324, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1312,1332,1315,1316, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1336,1341,1339,1340, &end
#
#  chirality for residue 84 atoms:  CB CD HG2 HG3
 &rst iat=1338,1344,1342,1343, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1334,1347,1337,1338, &end
#
#  chirality for residue 85 atoms:  CA CG1 CG2 HB
 &rst iat=1351,1355,1359,1354, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1349,1363,1352,1353, &end
#
#  chirality for residue 86 atoms:  CA CG HB2 HB3
 &rst iat=1367,1372,1370,1371, &end
#
#  chirality for residue 86 atoms:  CB SD HG2 HG3
 &rst iat=1369,1375,1373,1374, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1365,1380,1368,1369, &end
#
#  chirality for residue 87 atoms:  CA OG HB2 HB3
 &rst iat=1384,1389,1387,1388, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1382,1391,1385,1386, &end
#
#  chirality for residue 88 atoms:  CA CG HB2 HB3
 &rst iat=1403,1397,1401,1402, &end
#
#  chirality for residue 88 atoms:  CB CD HG2 HG3
 &rst iat=1400,1394,1398,1399, &end
#
#  chirality for residue 88 atoms:  CG N HD2 HD3
 &rst iat=1397,1393,1395,1396, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1393,1405,1404,1400, &end
#
#  chirality for residue 89 atoms:  CA CG2 OG1 HB
 &rst iat=1409,1413,1417,1412, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1407,1419,1410,1411, &end
#
#  chirality for residue 90 atoms:  N C HA2 HA3
 &rst iat=1421,1426,1424,1425, &end
#
#  chirality for residue 91 atoms:  CA OG HB2 HB3
 &rst iat=1430,1435,1433,1434, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1428,1437,1431,1432, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1439,1447,1442,1443, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1451,1456,1454,1455, &end
#
#  chirality for residue 93 atoms:  CB CD HG2 HG3
 &rst iat=1453,1459,1457,1458, &end
#
#  chirality for residue 93 atoms:  CG NE HD2 HD3
 &rst iat=1456,1462,1460,1461, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1449,1471,1452,1453, &end
#
#  chirality for residue 94 atoms:  N C HA2 HA3
 &rst iat=1473,1478,1476,1477, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1482,1487,1485,1486, &end
#
#  chirality for residue 95 atoms:  CB CD HG2 HG3
 &rst iat=1484,1490,1488,1489, &end
#
#  chirality for residue 95 atoms:  CG NE HD2 HD3
 &rst iat=1487,1493,1491,1492, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1480,1502,1483,1484, &end
#
#  chirality for residue 96 atoms:  CA OG HB2 HB3
 &rst iat=1506,1511,1509,1510, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1504,1513,1507,1508, &end
#
#  trans-omega constraint for residue 2
 &rst iat=12,10,8,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 50., rk3=50.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=23,21,19,12, &end
#
#  trans-omega constraint for residue 4
 &rst iat=40,38,36,23, &end
#
#  trans-omega constraint for residue 5
 &rst iat=57,55,53,40, &end
#
#  trans-omega constraint for residue 6
 &rst iat=79,77,75,57, &end
#
#  trans-omega constraint for residue 7
 &rst iat=101,99,97,79, &end
#
#  trans-omega constraint for residue 8
 &rst iat=120,118,116,101, &end
#
#  trans-omega constraint for residue 9
 &rst iat=140,138,136,120, &end
#
#  trans-omega constraint for residue 10
 &rst iat=156,154,152,140, &end
#
#  trans-omega constraint for residue 11
 &rst iat=163,161,159,156, &end
#
#  trans-omega constraint for residue 12
 &rst iat=170,168,166,163, &end
#
#  trans-omega constraint for residue 13
 &rst iat=189,187,185,170, &end
#
#  trans-omega constraint for residue 14
 &rst iat=200,198,196,189, &end
#
#  trans-omega constraint for residue 15
 &rst iat=216,214,212,200, &end
#
#  trans-omega constraint for residue 16
 &rst iat=230,228,226,216, &end
#
#  trans-omega constraint for residue 17
 &rst iat=244,242,240,230, &end
#
#  trans-omega constraint for residue 18
 &rst iat=258,256,254,244, &end
#
#  trans-omega constraint for residue 19
 &rst iat=274,272,270,258, &end
#
#  trans-omega constraint for residue 20
 &rst iat=289,287,285,274, &end
#
#  trans-omega constraint for residue 21
 &rst iat=301,299,297,289, &end
#
#  trans-omega constraint for residue 22
 &rst iat=317,315,313,301, &end
#
#  trans-omega constraint for residue 23
 &rst iat=339,337,335,317, &end
#
#  trans-omega constraint for residue 24
 &rst iat=356,354,352,339, &end
#
#  trans-omega constraint for residue 25
 &rst iat=377,375,373,356, &end
#
#  trans-omega constraint for residue 26
 &rst iat=397,395,393,377, &end
#
#  trans-omega constraint for residue 27
 &rst iat=412,410,408,397, &end
#
#  trans-omega constraint for residue 28
 &rst iat=429,427,425,412, &end
#
#  trans-omega constraint for residue 29
 &rst iat=449,447,445,429, &end
#
#  trans-omega constraint for residue 30
 &rst iat=456,454,452,449, &end
#
#  trans-omega constraint for residue 31
 &rst iat=478,476,474,456, &end
#
#  trans-omega constraint for residue 32
 &rst iat=494,492,490,478, &end
#
#  trans-omega constraint for residue 33
 &rst iat=506,504,502,494, &end
#
#  trans-omega constraint for residue 34
 &rst iat=518,516,514,506, &end
#
#  trans-omega constraint for residue 35
 &rst iat=528,526,524,518, &end
#
#  trans-omega constraint for residue 36
 &rst iat=545,543,541,528, &end
#
#  trans-omega constraint for residue 37
 &rst iat=564,562,560,545, &end
#
#  trans-omega constraint for residue 38
 &rst iat=581,579,577,564, &end
#
#  trans-omega constraint for residue 39
 &rst iat=601,599,597,581, &end
#
#  trans-omega constraint for residue 40
 &rst iat=613,611,609,601, &end
#
#  trans-omega constraint for residue 41
 &rst iat=635,633,631,613, &end
#
#  trans-omega constraint for residue 42
 &rst iat=649,647,645,635, &end
#
#  trans-omega constraint for residue 43
 &rst iat=663,661,659,649, &end
#
#  trans-omega constraint for residue 44
 &rst iat=677,675,673,663, &end
#
#  trans-omega constraint for residue 45
 &rst iat=701,699,697,677, &end
#
#  trans-omega constraint for residue 46
 &rst iat=718,716,714,701, &end
#
#  trans-omega constraint for residue 47
 &rst iat=742,740,738,718, &end
#
#  trans-omega constraint for residue 48
 &rst iat=749,747,745,742, &end
#
#  trans-omega constraint for residue 49
 &rst iat=769,767,765,749, &end
#
#  trans-omega constraint for residue 50
 &rst iat=776,774,772,769, &end
#
#  trans-omega constraint for residue 51
 &rst iat=796,794,792,776, &end
#
#  trans-omega constraint for residue 52
 &rst iat=812,810,808,796, &end
#
#  trans-omega constraint for residue 53
 &rst iat=826,824,822,812, &end
#
#  trans-omega constraint for residue 54
 &rst iat=846,844,842,826, &end
#
#  trans-omega constraint for residue 55
 &rst iat=861,859,857,846, &end
#
#  trans-omega constraint for residue 56
 &rst iat=872,870,868,861, &end
#
#  trans-omega constraint for residue 57
 &rst iat=887,885,883,872, &end
#
#  trans-omega constraint for residue 58
 &rst iat=899,897,895,887, &end
#
#  trans-omega constraint for residue 59
 &rst iat=918,916,914,899, &end
#
#  trans-omega constraint for residue 60
 &rst iat=934,932,930,918, &end
#
#  trans-omega constraint for residue 61
 &rst iat=949,947,945,934, &end
#
#  trans-omega constraint for residue 62
 &rst iat=971,969,967,949, &end
#
#  trans-omega constraint for residue 63
 &rst iat=987,985,983,971, &end
#
#  trans-omega constraint for residue 64
 &rst iat=998,996,994,987, &end
#
#  trans-omega constraint for residue 65
 &rst iat=1013,1011,1009,998, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1032,1030,1028,1013, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1049,1047,1045,1032, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1069,1067,1065,1049, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1086,1084,1082,1069, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1101,1099,1097,1086, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1120,1118,1116,1101, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1134,1132,1130,1120, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1148,1146,1144,1134, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1170,1168,1166,1148, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1187,1185,1183,1170, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1203,1201,1199,1187, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1218,1216,1214,1203, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1229,1227,1225,1218, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1251,1249,1247,1229, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1273,1271,1269,1251, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1283,1281,1279,1273, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1308,1298,1296,1283, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1314,1312,1310,1308, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1336,1334,1332,1314, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1351,1349,1347,1336, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1367,1365,1363,1351, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1384,1382,1380,1367, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1403,1393,1391,1384, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1409,1407,1405,1403, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1423,1421,1419,1409, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1430,1428,1426,1423, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1441,1439,1437,1430, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1451,1449,1447,1441, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1475,1473,1471,1451, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1482,1480,1478,1475, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1506,1504,1502,1482, &end
#
#   5 LYS+   HA   56 GLU-   HA  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  58, 873, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, 
      rk2 = 32.0, rk3 = 32.0, ir6=1, ialtd=0,
 &end
#
#   5 LYS+   HA   59  VAL  QG1  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 923, 924, 925,
 &end
#
#   5 LYS+   HA   59  VAL  QG2  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2= 927, 928, 929,
 &end
#
#   5 LYS+   HA    5 LYS+   QG  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2=  63,  64,
 &end
#
#   5 LYS+  HG2   56 GLU-   QB  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 875, 876,
 &end
#
#   5 LYS+  HG2   56 GLU-   QG  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 878, 879,
 &end
#
#   5 LYS+  HG2    5 LYS+   QE  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2=  69,  70,
 &end
#
#   5 LYS+  HG3   56 GLU-   QB  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 875, 876,
 &end
#
#   5 LYS+  HG3   56 GLU-   QG  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 878, 879,
 &end
#
#   5 LYS+  HG3    5 LYS+   QE  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2=  69,  70,
 &end
#
#   5 LYS+   HN    5 LYS+  HG2  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  63, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#   5 LYS+   HN    5 LYS+  HG3  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  64, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#   5 LYS+   HN    5 LYS+   QG  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=  63,  64,
 &end
#
#   5 LYS+   HN    6 LYS+   HN  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  78, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   5 LYS+   QB   52  THR  QG2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1=  60,  61,
 igr2= 817, 818, 819,
 &end
#
#   5 LYS+   QB   53  PHE  HB2  1.80 4.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1=  60,  61,
 &end
#
#   5 LYS+   QB   53  PHE   HN  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=  60,  61,
 &end
#
#   5 LYS+   QB   59  VAL  QG2  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1=  60,  61,
 igr2= 927, 928, 929,
 &end
#
#   5 LYS+   QD   53  PHE   HN  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1=  66,  67,
 &end
#
#   5 LYS+   QD   56 GLU-   HA  1.80 4.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 873, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1=  66,  67,
 &end
#
#   5 LYS+   QD   56 GLU-   QG  1.80 4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1=  66,  67,
 igr2= 878, 879,
 &end
#
#   5 LYS+   QE   56 GLU-   HN  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 871, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1=  69,  70,
 &end
#
#   5 LYS+   QE   56 GLU-   QB  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=  69,  70,
 igr2= 875, 876,
 &end
#
#   5 LYS+   QG   56 GLU-   HA  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 873, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1=  63,  64,
 &end
#
#   5 LYS+   QG   56 GLU-   QB  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1=  63,  64,
 igr2= 875, 876,
 &end
#
#   5 LYS+   QG   56 GLU-   QG  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1=  63,  64,
 igr2= 878, 879,
 &end
#
#   5 LYS+   QG    5 LYS+   QE  1.80 3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1=  63,  64,
 igr2=  69,  70,
 &end
#
#   6 LYS+   HA   52  THR   HA  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 813, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#   6 LYS+   HA   52  THR  QG2  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 817, 818, 819,
 &end
#
#   6 LYS+   HA   53  PHE   HN  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 825, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   6 LYS+   HA    6 LYS+   QD  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2=  88,  89,
 &end
#
#   6 LYS+   HA    6 LYS+   QG  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2=  85,  86,
 &end
#
#   6 LYS+   HA    7  ILE   HN  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 100, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#   6 LYS+   HA    7  ILE  QG2  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2= 106, 107, 108,
 &end
#
#   6 LYS+   HA   80  ALA   QB  1.80 4.96
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+  HB2   80  ALA   QB  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  82,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+  HB3   80  ALA   QB  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+   HN   59  VAL  QG1  1.80 4.80
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2= 923, 924, 925,
 &end
#
#   6 LYS+   HN   59  VAL  QG2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 927, 928, 929,
 &end
#
#   6 LYS+   HN    6 LYS+  HB2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  82, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   6 LYS+   HN    6 LYS+  HB3  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  83, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   6 LYS+   HN    6 LYS+   QB  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2=  82,  83,
 &end
#
#   6 LYS+   HN   80  ALA   QB  1.80 4.89
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+   QB    6 LYS+   QD  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1=  82,  83,
 igr2=  88,  89,
 &end
#
#   6 LYS+   QB    7  ILE   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1=  82,  83,
 &end
#
#   6 LYS+   QB   80  ALA   QB  1.80 3.20
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr1=  82,  83,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+   QE   50  PHE   QB  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1=  91,  92,
 igr2= 779, 780,
 &end
#
#   6 LYS+   QE   50  PHE   QD  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=  91,  92,
 igr2= 783, 791,
 &end
#
#   6 LYS+   QE   80  ALA   QB  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1=  91,  92,
 igr2=1276,1277,1278,
 &end
#
#   6 LYS+   QG   50  PHE   HA  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG   50  PHE   QB  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1=  85,  86,
 igr2= 779, 780,
 &end
#
#   6 LYS+   QG   50  PHE   QD  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1=  85,  86,
 igr2= 783, 791,
 &end
#
#   6 LYS+   QG   51  VAL   HN  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG   52  THR   HA  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 813, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG   52  THR   HN  1.80 4.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG    6 LYS+   QE  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=  85,  86,
 igr2=  91,  92,
 &end
#
#   6 LYS+   QG    7  ILE   HN  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  85,  86,
 &end
#
#   6 LYS+   QG   80  ALA   QB  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1=  85,  86,
 igr2=1276,1277,1278,
 &end
#
#   7  ILE   HA   59  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 927, 928, 929,
 &end
#
#   7  ILE   HA   79 LYS+   HA  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat= 102,1252, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   7  ILE   HA    7  ILE  QD1  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 113, 114, 115,
 &end
#
#   7  ILE   HA    7  ILE  QG2  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 106, 107, 108,
 &end
#
#   7  ILE   HA   80  ALA   HN  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 102,1272, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   7  ILE   HA   80  ALA   QB  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2=1276,1277,1278,
 &end
#
#   7  ILE   HA    8  PHE   HN  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 102, 119, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#   7  ILE   HB   78 LYS+   HN  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 104,1228, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#   7  ILE   HB    7  ILE  QD1  1.80 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 113, 114, 115,
 &end
#
#   7  ILE   HB   80  ALA   HN  1.80 4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 104,1272, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   7  ILE   HB    8  PHE  HB3  1.80 5.24
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 124, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#   7  ILE   HB    8  PHE   HN  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 119, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#   7  ILE HG12   51  VAL   HN  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 795, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   7  ILE HG12   53  PHE   QE  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 110,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 835, 839,
 &end
#
#   7  ILE HG13   51  VAL   HN  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 111, 795, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   7  ILE HG13   53  PHE   QE  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 835, 839,
 &end
#
#   7  ILE   HN   51  VAL   HN  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 100, 795, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#   7  ILE   HN    7  ILE HG12  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat= 100, 110, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   7  ILE   HN    7  ILE HG13  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat= 100, 111, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   7  ILE   HN    7  ILE  QD1  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 113, 114, 115,
 &end
#
#   7  ILE   HN    7  ILE  QG1  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 110, 111,
 &end
#
#   7  ILE   HN    7  ILE  QG2  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 106, 107, 108,
 &end
#
#   7  ILE   HN   80  ALA   QB  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2=1276,1277,1278,
 &end
#
#   7  ILE  QD1   25  PHE  HB3  1.80 4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   25  PHE   QD  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 113, 114, 115,
 igr2= 384, 392,
 &end
#
#   7  ILE  QD1   25  PHE   QE  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 113, 114, 115,
 igr2= 386, 390,
 &end
#
#   7  ILE  QD1   51  VAL   HB  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   51  VAL   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   53  PHE   HZ  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   53  PHE   QD  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 113, 114, 115,
 igr2= 833, 841,
 &end
#
#   7  ILE  QD1   53  PHE   QE  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 113, 114, 115,
 igr2= 835, 839,
 &end
#
#   7  ILE  QD1   59  VAL   HA  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   62  VAL   HB  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 974, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   62  VAL  QG1  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1= 113, 114, 115,
 igr2= 976, 977, 978,
 &end
#
#   7  ILE  QD1   62  VAL  QG2  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 113, 114, 115,
 igr2= 980, 981, 982,
 &end
#
#   7  ILE  QD1   77  CYS   HA  1.80 4.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   77  CYS  HB2  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1221, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   77  CYS  HB3  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1222, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 113, 114, 115,
 &end
#
#   7  ILE  QD1   77  CYS   QB  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 113, 114, 115,
 igr2=1221,1222,
 &end
#
#   7  ILE  QD1    9  VAL  QG2  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
 igr1= 113, 114, 115,
 igr2= 149, 150, 151,
 &end
#
#   7  ILE  QG1   50  PHE   HA  1.80 5.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 110, 111,
 &end
#
#   7  ILE  QG1   51  VAL   HB  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr1= 110, 111,
 &end
#
#   7  ILE  QG1   51  VAL   HN  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 110, 111,
 &end
#
#   7  ILE  QG1   51  VAL  QG1  1.80 3.92
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 110, 111,
 igr2= 801, 802, 803,
 &end
#
#   7  ILE  QG1   53  PHE   QD  1.80 4.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 110, 111,
 igr2= 833, 841,
 &end
#
#   7  ILE  QG1   53  PHE   QE  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 110, 111,
 igr2= 835, 839,
 &end
#
#   7  ILE  QG1    9  VAL  QG2  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
 igr1= 110, 111,
 igr2= 149, 150, 151,
 &end
#
#   7  ILE  QG2   53  PHE   HZ  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   53  PHE   QD  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr1= 106, 107, 108,
 igr2= 833, 841,
 &end
#
#   7  ILE  QG2   53  PHE   QE  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 106, 107, 108,
 igr2= 835, 839,
 &end
#
#   7  ILE  QG2   59  VAL   HA  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   59  VAL   HB  1.80 4.94
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 921, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   62  VAL   HB  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 974, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   77  CYS   HA  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   77  CYS  HB2  1.80 4.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1221, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   77  CYS  HB3  1.80 4.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1222, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   77  CYS   QB  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 106, 107, 108,
 igr2=1221,1222,
 &end
#
#   7  ILE  QG2   79 LYS+   HA  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1252, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2   79 LYS+   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1250, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2    7  ILE HG12  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 110, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2    7  ILE HG13  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 111, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2    7  ILE  QD1  1.80 2.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 106, 107, 108,
 igr2= 113, 114, 115,
 &end
#
#   7  ILE  QG2   80  ALA   HN  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1272, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 106, 107, 108,
 &end
#
#   7  ILE  QG2    8  PHE   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 106, 107, 108,
 &end
#
#   8  PHE   HA   50  PHE   HA  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 777, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   8  PHE   HA   50  PHE   QD  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2= 783, 791,
 &end
#
#   8  PHE   HA    8  PHE   QD  1.80 4.86
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 127, 135,
 &end
#
#   8  PHE   HA    9  VAL   HN  1.80 3.11
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 139, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#   8  PHE   HA    9  VAL  QG2  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 149, 150, 151,
 &end
#
#   8  PHE  HB2   50  PHE   QD  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 783, 791,
 &end
#
#   8  PHE  HB2   50  PHE   QE  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 785, 789,
 &end
#
#   8  PHE  HB2   78 LYS+   QG  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1235,1236,
 &end
#
#   8  PHE  HB2   80  ALA   HA  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 123,1274, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#   8  PHE  HB2   80  ALA   QB  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2=1276,1277,1278,
 &end
#
#   8  PHE  HB3   50  PHE   QE  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 785, 789,
 &end
#
#   8  PHE  HB3   78 LYS+   HN  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 124,1228, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   8  PHE  HB3   78 LYS+   QB  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2=1232,1233,
 &end
#
#   8  PHE  HB3   78 LYS+   QG  1.80 5.04
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2=1235,1236,
 &end
#
#   8  PHE   HN   80  ALA   HN  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 119,1272, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#   8  PHE   HN   80  ALA   QB  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2=1276,1277,1278,
 &end
#
#   8  PHE   HN    8  PHE  HB2  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 123, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#   8  PHE   HN    8  PHE  HB3  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 119, 124, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   8  PHE   HN    8  PHE   QD  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 127, 135,
 &end
#
#   8  PHE   QD   10  GLY   HN  1.80 5.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
 igr1= 127, 135,
 &end
#
#   8  PHE   QD   48  PHE   QD  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 127, 135,
 igr2= 756, 764,
 &end
#
#   8  PHE   QD   50  PHE   QD  1.80 5.33
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
 igr1= 127, 135,
 igr2= 783, 791,
 &end
#
#   8  PHE   QD   50  PHE   QE  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 127, 135,
 igr2= 785, 789,
 &end
#
#   8  PHE   QD   78 LYS+   HN  1.80 4.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 127, 135,
 &end
#
#   8  PHE   QD   78 LYS+   QB  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 127, 135,
 igr2=1232,1233,
 &end
#
#   8  PHE   QD   78 LYS+   QE  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1= 127, 135,
 igr2=1241,1242,
 &end
#
#   8  PHE   QD   78 LYS+   QG  1.80 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 127, 135,
 igr2=1235,1236,
 &end
#
#   8  PHE   QE   10  GLY   QA  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1= 129, 133,
 igr2= 157, 158,
 &end
#
#   8  PHE   QE   48  PHE  HB2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 129, 133,
 &end
#
#   8  PHE   QE   48  PHE  HB3  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 753, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 129, 133,
 &end
#
#   8  PHE   QE   48  PHE   QB  1.80 4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 129, 133,
 igr2= 752, 753,
 &end
#
#   8  PHE   QE   78 LYS+   QE  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 129, 133,
 igr2=1241,1242,
 &end
#
#   9  VAL   HA   77  CYS   HA  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 141,1219, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#   9  VAL   HA    9  VAL  QG1  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 145, 146, 147,
 &end
#
#   9  VAL   HA    9  VAL  QG2  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 149, 150, 151,
 &end
#
#   9  VAL   HB   10  GLY   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 143, 155, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#   9  VAL   HB   21  VAL  QG1  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 306, 307, 308,
 &end
#
#   9  VAL   HB   21  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 143,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 310, 311, 312,
 &end
#
#   9  VAL   HB   49  GLY   HN  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 143, 768, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#   9  VAL   HB   50  PHE   HA  1.80 5.05
 &rst
  ixpk= 0, nxpk= 0, iat= 143, 777, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#   9  VAL   HN   49  GLY   HN  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 768, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#   9  VAL   HN   50  PHE   HA  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 777, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#   9  VAL   HN    9  VAL   HB  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 143, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#   9  VAL   HN    9  VAL  QG1  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 139,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 145, 146, 147,
 &end
#
#   9  VAL   HN    9  VAL  QG2  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat= 139,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2= 149, 150, 151,
 &end
#
#   9  VAL  QG1   10  GLY   HN  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 145, 146, 147,
 &end
#
#   9  VAL  QG1   25  PHE   QE  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 145, 146, 147,
 igr2= 386, 390,
 &end
#
#   9  VAL  QG1   49  GLY   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 145, 146, 147,
 &end
#
#   9  VAL  QG1   77  CYS   HA  1.80 4.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 145, 146, 147,
 &end
#
#   9  VAL  QG2   10  GLY   HN  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   25  PHE   QE  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 149, 150, 151,
 igr2= 386, 390,
 &end
#
#   9  VAL  QG2   49  GLY   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   50  PHE   HA  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   51  VAL   HA  1.80 5.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 797, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   51  VAL   HB  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   51  VAL   HN  1.80 4.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   77  CYS   HA  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1219, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   77  CYS  HB2  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1221, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 149, 150, 151,
 &end
#
#   9  VAL  QG2   77  CYS  HB3  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1222, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 149, 150, 151,
 &end
#
#  10  GLY   HN   77  CYS   HA  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 155,1219, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  10  GLY   QA   11  GLY   HN  1.80 3.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 162, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr1= 157, 158,
 &end
#
#  10  GLY   QA   12  LEU   HN  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 157, 158,
 &end
#
#  10  GLY   QA   48  PHE   HA  1.80 4.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 157, 158,
 &end
#
#  11  GLY   HN   12  LEU   HG  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 176, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  11  GLY   HN   12  LEU   HN  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 169, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#  11  GLY   HN   48  PHE   HA  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 162, 750, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  12  LEU   HA   12  LEU   HG  1.80 4.16
 &rst
  ixpk= 0, nxpk= 0, iat= 171, 176, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  12  LEU   HA   12  LEU  QD1  1.80 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 178, 179, 180,
 &end
#
#  12  LEU   HA   12  LEU  QD2  1.80 3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 182, 183, 184,
 &end
#
#  12  LEU   HA   13  SER   HN  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 171, 188, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  12  LEU   HA   75  VAL  QG1  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2=1192,1193,1194,
 &end
#
#  12  LEU  HB2   12  LEU  QD1  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2= 178, 179, 180,
 &end
#
#  12  LEU  HB2   45 HIS   HE1  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 173, 709, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  12  LEU  HB3   12  LEU  QD1  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 174,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2= 178, 179, 180,
 &end
#
#  12  LEU  HB3   45 HIS   HE1  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 174, 709, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  12  LEU   HG   13  SER   HN  1.80 5.46
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 188, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  12  LEU   HG   48  PHE   HA  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 750, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  12  LEU   HG   70  ILE  QD1  1.80 4.87
 &rst
  ixpk= 0, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2=1113,1114,1115,
 &end
#
#  12  LEU   HG   75  VAL  QG1  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2=1192,1193,1194,
 &end
#
#  12  LEU   HN   12  LEU  HB2  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 173, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  12  LEU   HN   12  LEU  HB3  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 174, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  12  LEU   HN   12  LEU   HG  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 176, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  12  LEU   HN   12  LEU   QB  1.80 3.42
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 173, 174,
 &end
#
#  12  LEU   HN   12  LEU  QD1  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 178, 179, 180,
 &end
#
#  12  LEU   HN   12  LEU  QD2  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 182, 183, 184,
 &end
#
#  12  LEU   HN   47  GLY   QA  1.80 4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 743, 744,
 &end
#
#  12  LEU   HN   48  PHE   HA  1.80 5.12
 &rst
  ixpk= 0, nxpk= 0, iat= 169, 750, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#  12  LEU   HN   75  VAL  QG1  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=1192,1193,1194,
 &end
#
#  12  LEU   QB   12  LEU  QD2  1.80 3.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1= 173, 174,
 igr2= 182, 183, 184,
 &end
#
#  12  LEU   QB   13  SER   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 173, 174,
 &end
#
#  12  LEU   QB   16  THR   HB  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 173, 174,
 &end
#
#  12  LEU   QB   45 HIS   HE1  1.80 3.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 709, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr1= 173, 174,
 &end
#
#  12  LEU   QB   47  GLY   QA  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 173, 174,
 igr2= 743, 744,
 &end
#
#  12  LEU   QB   48  PHE   HN  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 173, 174,
 &end
#
#  12  LEU  QD1   16  THR  QG2  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 178, 179, 180,
 igr2= 235, 236, 237,
 &end
#
#  12  LEU  QD1   21  VAL  QG2  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 178, 179, 180,
 igr2= 310, 311, 312,
 &end
#
#  12  LEU  QD1   45 HIS   HE1  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 709, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 178, 179, 180,
 &end
#
#  12  LEU  QD1   48  PHE   HA  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 178, 179, 180,
 &end
#
#  12  LEU  QD1   48  PHE   HN  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 178, 179, 180,
 &end
#
#  12  LEU  QD1   49  GLY   HN  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1= 178, 179, 180,
 &end
#
#  12  LEU  QD2   13  SER   HN  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 188, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 182, 183, 184,
 &end
#
#  12  LEU  QD2   16  THR   HB  1.80 4.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 182, 183, 184,
 &end
#
#  12  LEU  QD2   16  THR  QG2  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 182, 183, 184,
 igr2= 235, 236, 237,
 &end
#
#  12  LEU  QD2   21  VAL  QG2  1.80 2.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1= 182, 183, 184,
 igr2= 310, 311, 312,
 &end
#
#  12  LEU  QD2   70  ILE   HB  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1104, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 182, 183, 184,
 &end
#
#  12  LEU  QD2   70  ILE  QD1  1.80 3.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 182, 183, 184,
 igr2=1113,1114,1115,
 &end
#
#  12  LEU  QD2   75  VAL   HB  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1190, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 182, 183, 184,
 &end
#
#  12  LEU  QD2   75  VAL  QG1  1.80 2.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr1= 182, 183, 184,
 igr2=1192,1193,1194,
 &end
#
#  13  SER   HA   14  VAL   HN  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 190, 199, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  13  SER   HN   13  SER  HB2  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 192, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#  13  SER   HN   13  SER  HB3  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 193, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#  13  SER   HN   13  SER   QB  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr2= 192, 193,
 &end
#
#  13  SER   HN   14  VAL   HN  3.50 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 199, r1= 3.00, r2= 3.50, r3=100.00, r4=100.50,  &end
#
#  13  SER   HN   16  THR   HB  1.80 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 233, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#  13  SER   HN   16  THR  HG1  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 188, 239, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  13  SER   HN   16  THR  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 235, 236, 237,
 &end
#
#  13  SER   HN   70  ILE  QG2  1.80 5.28
 &rst
  ixpk= 0, nxpk= 0, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
 igr2=1106,1107,1108,
 &end
#
#  13  SER   HN   75  VAL  QG1  1.80 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 188,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2=1192,1193,1194,
 &end
#
#  13  SER   QB   14  VAL   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 192, 193,
 &end
#
#  13  SER   QB   15  ASN   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 192, 193,
 &end
#
#  13  SER   QB   73 LYS+   QB  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 192, 193,
 igr2=1151,1152,
 &end
#
#  13  SER   QB   73 LYS+   QD  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 192, 193,
 igr2=1157,1158,
 &end
#
#  13  SER   QB   73 LYS+   QG  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 192, 193,
 igr2=1154,1155,
 &end
#
#  14  VAL   HA   14  VAL  QG1  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 205, 206, 207,
 &end
#
#  14  VAL   HA   14  VAL  QG2  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 209, 210, 211,
 &end
#
#  14  VAL   HA   15  ASN   HN  2.80 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 215, r1= 2.30, r2= 2.80, r3=100.00, r4=100.50,  &end
#
#  14  VAL   HA   45 HIS   HE1  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 709, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  14  VAL   HB   15  ASN   HN  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 203, 215, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  14  VAL   HN   14  VAL   HA  2.80 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 201, r1= 2.30, r2= 2.80, r3=100.00, r4=100.50,  &end
#
#  14  VAL   HN   14  VAL  QG1  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 205, 206, 207,
 &end
#
#  14  VAL   HN   14  VAL  QG2  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 209, 210, 211,
 &end
#
#  14  VAL   HN   14  VAL  QQG  1.80 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 205, 206, 207, 209, 210, 211,
 &end
#
#  14  VAL   HN   15  ASN   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 199, 215, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  14  VAL  QG1   15  ASN   HN  1.80 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 205, 206, 207,
 &end
#
#  14  VAL  QG1   16  THR   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 229, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 205, 206, 207,
 &end
#
#  14  VAL  QG2   15  ASN   HN  1.80 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 209, 210, 211,
 &end
#
#  14  VAL  QG2   16  THR   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 229, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 209, 210, 211,
 &end
#
#  14  VAL  QQG   15  ASN   HN  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 215, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 205, 206, 207, 209, 210, 211,
 &end
#
#  14  VAL  QQG   15  ASN   QB  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
 igr1= 205, 206, 207, 209, 210, 211,
 igr2= 219, 220,
 &end
#
#  14  VAL  QQG   16  THR   HN  1.80 4.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 229, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr1= 205, 206, 207, 209, 210, 211,
 &end
#
#  14  VAL  QQG   44 ARG+   QD  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1= 205, 206, 207, 209, 210, 211,
 igr2= 686, 687,
 &end
#
#  15  ASN   HA   15  ASN HD21  1.80 4.98
 &rst
  ixpk= 0, nxpk= 0, iat= 217, 224, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  15  ASN   HA   15  ASN HD22  1.80 4.98
 &rst
  ixpk= 0, nxpk= 0, iat= 217, 225, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  15  ASN   HA   15  ASN  QD2  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 217,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 224, 225,
 &end
#
#  15  ASN  HB2   16  THR   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 219, 229, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15  ASN  HB3   16  THR   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 229, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15  ASN   HN   15  ASN   QB  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 215,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 219, 220,
 &end
#
#  15  ASN   HN   16  THR  HG1  1.80 5.05
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#  15  ASN   HN   16  THR   HN  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 229, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  16  THR   HA   16  THR  QG2  1.80 3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 231,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 235, 236, 237,
 &end
#
#  16  THR   HA   17  THR   HN  1.80 3.02
 &rst
  ixpk= 0, nxpk= 0, iat= 231, 243, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#  16  THR   HA   17  THR  QG2  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 231,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 249, 250, 251,
 &end
#
#  16  THR   HA   71  ASN HD21  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat= 231,1128, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#  16  THR   HA   71  ASN HD22  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 231,1129, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  16  THR   HB   17  THR   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 233, 243, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  16  THR   HB   21  VAL  QG2  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 310, 311, 312,
 &end
#
#  16  THR   HB   71  ASN HD21  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 233,1128, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  16  THR   HB   71  ASN HD22  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 233,1129, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  16  THR  HG1   71  ASN HD21  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat= 239,1128, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#  16  THR   HN   16  THR   HB  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 229, 233, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#  16  THR   HN   16  THR  HG1  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 229, 239, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  16  THR   HN   16  THR  QG2  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 229,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 235, 236, 237,
 &end
#
#  16  THR   HN   71  ASN HD21  1.80 5.16
 &rst
  ixpk= 0, nxpk= 0, iat= 229,1128, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#  16  THR  QG2   17  THR   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   18  VAL   HA  1.80 5.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 259, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   20 ASP-   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   20 ASP-   QB  1.80 3.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr1= 235, 236, 237,
 igr2= 292, 293,
 &end
#
#  16  THR  QG2   21  VAL   HA  1.80 4.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 302, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   21  VAL   HB  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   21  VAL   HN  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 300, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   21  VAL  QG2  1.80 2.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 235, 236, 237,
 igr2= 310, 311, 312,
 &end
#
#  16  THR  QG2   36  LEU  QD1  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 235, 236, 237,
 igr2= 553, 554, 555,
 &end
#
#  16  THR  QG2   36  LEU  QD2  1.80 4.86
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
 igr1= 235, 236, 237,
 igr2= 557, 558, 559,
 &end
#
#  16  THR  QG2   70  ILE  QD1  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
 igr1= 235, 236, 237,
 igr2=1113,1114,1115,
 &end
#
#  16  THR  QG2   70  ILE  QG2  1.80 3.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr1= 235, 236, 237,
 igr2=1106,1107,1108,
 &end
#
#  16  THR  QG2   71  ASN  HB2  1.80 4.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   71  ASN  HB3  1.80 5.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1124, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   71  ASN HD21  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1128, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 235, 236, 237,
 &end
#
#  16  THR  QG2   71  ASN HD22  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 235, 236, 237,
 &end
#
#  17  THR   HA   17  THR  QG2  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2= 249, 250, 251,
 &end
#
#  17  THR   HA   18  VAL   HB  1.80 5.35
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 261, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#  17  THR   HA   18  VAL   HN  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 257, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  17  THR   HA   36  LEU  QD1  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 553, 554, 555,
 &end
#
#  17  THR   HN   17  THR  QG2  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 243,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2= 249, 250, 251,
 &end
#
#  17  THR   HN   20 ASP-  HB2  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 292, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  17  THR   HN   20 ASP-  HB3  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 293, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  17  THR   HN   20 ASP-   HN  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 288, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  17  THR   HN   20 ASP-   QB  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat= 243,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 292, 293,
 &end
#
#  17  THR   HN   71  ASN HD22  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 243,1129, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  17  THR  QG2   18  VAL   HN  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 257, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 249, 250, 251,
 &end
#
#  17  THR  QG2   19 GLU-   HN  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 249, 250, 251,
 &end
#
#  17  THR  QG2   20 ASP-   HN  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 249, 250, 251,
 &end
#
#  17  THR  QG2   21  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 249, 250, 251,
 igr2= 310, 311, 312,
 &end
#
#  18  VAL   HA   18  VAL  QG2  1.80 2.95
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2= 267, 268, 269,
 &end
#
#  18  VAL   HA   21  VAL   HB  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 304, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  18  VAL   HA   21  VAL  QG2  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 310, 311, 312,
 &end
#
#  18  VAL   HA   22 LYS+   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 316, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#  18  VAL   HA   34  ALA   QB  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2= 521, 522, 523,
 &end
#
#  18  VAL   HA   36  LEU   HG  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 551, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#  18  VAL   HA   36  LEU  QD1  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2= 553, 554, 555,
 &end
#
#  18  VAL   HA   36  LEU  QD2  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 557, 558, 559,
 &end
#
#  18  VAL   HB   19 GLU-   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 273, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  18  VAL   HB   35  MET   HA  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 529, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  18  VAL   HB   36  LEU   HG  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 551, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  18  VAL   HB   36  LEU   HN  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 261, 544, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  18  VAL   HB   36  LEU   QB  1.80 4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 548, 549,
 &end
#
#  18  VAL   HB   36  LEU  QD1  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 553, 554, 555,
 &end
#
#  18  VAL   HB   36  LEU  QD2  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 557, 558, 559,
 &end
#
#  18  VAL   HN   18  VAL   HB  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 261, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
#  18  VAL   HN   18  VAL  QG1  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 263, 264, 265,
 &end
#
#  18  VAL   HN   18  VAL  QG2  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 267, 268, 269,
 &end
#
#  18  VAL   HN   19 GLU-   HN  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 273, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#  18  VAL   HN   20 ASP-   HN  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 288, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  18  VAL   HN   21  VAL   HB  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 257, 304, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  18  VAL   HN   36  LEU  QD1  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 553, 554, 555,
 &end
#
#  18  VAL   HN   36  LEU  QD2  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 557, 558, 559,
 &end
#
#  18  VAL  QG1   19 GLU-   HA  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG1   19 GLU-  HG2  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 280, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG1   19 GLU-  HG3  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 281, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG1   19 GLU-   HN  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG1   19 GLU-   QG  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 263, 264, 265,
 igr2= 280, 281,
 &end
#
#  18  VAL  QG1   34  ALA   QB  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 263, 264, 265,
 igr2= 521, 522, 523,
 &end
#
#  18  VAL  QG1   36  LEU   HN  1.80 4.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 263, 264, 265,
 &end
#
#  18  VAL  QG2   19 GLU-   HN  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   21  VAL   HB  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   21  VAL   HN  1.80 4.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 300, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   22 LYS+  HB2  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 320, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   22 LYS+   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   22 LYS+   QD  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 267, 268, 269,
 igr2= 326, 327,
 &end
#
#  18  VAL  QG2   34  ALA   HN  1.80 4.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 517, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   34  ALA   QB  1.80 2.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr1= 267, 268, 269,
 igr2= 521, 522, 523,
 &end
#
#  18  VAL  QG2   35  MET   HA  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 529, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   35  MET   HN  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 527, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   36  LEU   HG  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   36  LEU   HN  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 267, 268, 269,
 &end
#
#  18  VAL  QG2   36  LEU  QD1  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 267, 268, 269,
 igr2= 553, 554, 555,
 &end
#
#  18  VAL  QG2   36  LEU  QD2  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr1= 267, 268, 269,
 igr2= 557, 558, 559,
 &end
#
#  19 GLU-   HA   19 GLU-  HG2  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 280, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  19 GLU-   HA   19 GLU-  HG3  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 281, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  19 GLU-   HA   19 GLU-   QG  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 280, 281,
 &end
#
#  19 GLU-   HA   21  VAL   HN  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 300, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  19 GLU-   HA   22 LYS+  HB2  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 320, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  19 GLU-   HA   22 LYS+  HB3  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 321, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  19 GLU-   HA   22 LYS+   HN  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 316, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  19 GLU-   HA   22 LYS+   QD  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 326, 327,
 &end
#
#  19 GLU-   HA   22 LYS+   QG  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr2= 323, 324,
 &end
#
#  19 GLU-   HA   23 HIS    HN  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 338, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  19 GLU-   HA   34  ALA   QB  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 521, 522, 523,
 &end
#
#  19 GLU-  HB2   20 ASP-   HN  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 277, 288, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  19 GLU-  HB3   20 ASP-   HN  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 288, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  19 GLU-   HN   19 GLU-  HB2  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 277, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  19 GLU-   HN   19 GLU-  HB3  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 278, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  19 GLU-   HN   19 GLU-  HG2  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 280, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  19 GLU-   HN   19 GLU-  HG3  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 281, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  19 GLU-   HN   19 GLU-   QB  1.80 3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
 igr2= 277, 278,
 &end
#
#  19 GLU-   HN   19 GLU-   QG  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 280, 281,
 &end
#
#  19 GLU-   HN   20 ASP-   HN  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 288, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#  19 GLU-   QB   20 ASP-   HN  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 277, 278,
 &end
#
#  20 ASP-   HA   23 HIS    HN  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 290, 338, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  20 ASP-   HA   23 HIS    QB  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 342, 343,
 &end
#
#  20 ASP-  HB2   21  VAL   HN  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 292, 300, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  20 ASP-  HB2   71  ASN HD22  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 292,1129, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  20 ASP-  HB3   21  VAL   HN  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 293, 300, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  20 ASP-  HB3   71  ASN HD22  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 293,1129, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  20 ASP-   HN   21  VAL   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 288, 300, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#  20 ASP-   HN   21  VAL  QG2  1.80 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 310, 311, 312,
 &end
#
#  20 ASP-   QB   21  VAL   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 300, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1= 292, 293,
 &end
#
#  20 ASP-   QB   21  VAL  QG2  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 292, 293,
 igr2= 310, 311, 312,
 &end
#
#  20 ASP-   QB   70  ILE  QG2  1.80 4.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 292, 293,
 igr2=1106,1107,1108,
 &end
#
#  20 ASP-   QB   71  ASN HD22  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 292, 293,
 &end
#
#  21  VAL   HA   21  VAL  QG1  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 306, 307, 308,
 &end
#
#  21  VAL   HA   21  VAL  QG2  1.80 3.04
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 310, 311, 312,
 &end
#
#  21  VAL   HA   24  TYR  HB2  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 359, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  21  VAL   HA   24  TYR  HB3  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 360, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  21  VAL   HA   24  TYR   HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 355, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  21  VAL   HA   24  TYR   QB  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 359, 360,
 &end
#
#  21  VAL   HA   25  PHE   HN  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 376, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  21  VAL   HA   70  ILE  QD1  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1113,1114,1115,
 &end
#
#  21  VAL   HA   70  ILE  QG2  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 302,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2=1106,1107,1108,
 &end
#
#  21  VAL   HB   22 LYS+   HA  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 318, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  21  VAL   HB   22 LYS+   HN  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 316, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  21  VAL   HB   34  ALA   QB  1.80 5.37
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
 igr2= 521, 522, 523,
 &end
#
#  21  VAL   HB   36  LEU  QD1  1.80 5.13
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2= 553, 554, 555,
 &end
#
#  21  VAL   HB   36  LEU  QD2  1.80 3.92
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 557, 558, 559,
 &end
#
#  21  VAL   HB   51  VAL  QG2  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2= 805, 806, 807,
 &end
#
#  21  VAL   HN   21  VAL   HB  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 300, 304, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  21  VAL   HN   21  VAL  QG2  1.80 2.96
 &rst
  ixpk= 0, nxpk= 0, iat= 300,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 310, 311, 312,
 &end
#
#  21  VAL   HN   22 LYS+   HN  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 300, 316, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  21  VAL  QG1   22 LYS+  HB2  1.80 5.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 320, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr1= 306, 307, 308,
 &end
#
#  21  VAL  QG1   22 LYS+   HN  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 306, 307, 308,
 &end
#
#  21  VAL  QG1   25  PHE   QD  1.80 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 306, 307, 308,
 igr2= 384, 392,
 &end
#
#  21  VAL  QG1   25  PHE   QE  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 306, 307, 308,
 igr2= 386, 390,
 &end
#
#  21  VAL  QG1   51  VAL  QG2  1.80 2.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 306, 307, 308,
 igr2= 805, 806, 807,
 &end
#
#  21  VAL  QG1   70  ILE  QD1  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 306, 307, 308,
 igr2=1113,1114,1115,
 &end
#
#  21  VAL  QG2   22 LYS+   HN  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 310, 311, 312,
 &end
#
#  21  VAL  QG2   25  PHE   QE  1.80 4.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1= 310, 311, 312,
 igr2= 386, 390,
 &end
#
#  21  VAL  QG2   36  LEU  QD2  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 310, 311, 312,
 igr2= 557, 558, 559,
 &end
#
#  21  VAL  QG2   70  ILE   HB  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1104, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 310, 311, 312,
 &end
#
#  21  VAL  QG2   70  ILE  QD1  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1= 310, 311, 312,
 igr2=1113,1114,1115,
 &end
#
#  21  VAL  QG2   70  ILE  QG2  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 310, 311, 312,
 igr2=1106,1107,1108,
 &end
#
#  22 LYS+   HA   22 LYS+   QD  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 326, 327,
 &end
#
#  22 LYS+   HA   22 LYS+   QG  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 323, 324,
 &end
#
#  22 LYS+   HA   25  PHE  HB2  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 380, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  22 LYS+   HA   25  PHE   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 376, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  22 LYS+   HA   25  PHE   QD  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 384, 392,
 &end
#
#  22 LYS+   HA   26 GLU-   HN  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 396, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  22 LYS+   HA   31  VAL  QG1  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 483, 484, 485,
 &end
#
#  22 LYS+   HA   31  VAL  QG2  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 487, 488, 489,
 &end
#
#  22 LYS+   HA   34  ALA   QB  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2= 521, 522, 523,
 &end
#
#  22 LYS+   HA   51  VAL  QG2  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 805, 806, 807,
 &end
#
#  22 LYS+  HB2   23 HIS    HN  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 338, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  22 LYS+  HB2   31  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 320,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 487, 488, 489,
 &end
#
#  22 LYS+  HB2   34  ALA   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 517, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  22 LYS+  HB2   34  ALA   QB  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 320,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 521, 522, 523,
 &end
#
#  22 LYS+  HB3   23 HIS    HN  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 338, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#  22 LYS+  HB3   31  VAL  QG1  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr2= 483, 484, 485,
 &end
#
#  22 LYS+  HB3   34  ALA   QB  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 521, 522, 523,
 &end
#
#  22 LYS+   HN   22 LYS+   QG  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 316,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 323, 324,
 &end
#
#  22 LYS+   QD   31  VAL  QG1  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 326, 327,
 igr2= 483, 484, 485,
 &end
#
#  22 LYS+   QD   31  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 326, 327,
 igr2= 487, 488, 489,
 &end
#
#  22 LYS+   QD   34  ALA   QB  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 326, 327,
 igr2= 521, 522, 523,
 &end
#
#  22 LYS+   QE   31  VAL  QG1  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 329, 330,
 igr2= 483, 484, 485,
 &end
#
#  22 LYS+   QG   23 HIS    HN  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr1= 323, 324,
 &end
#
#  22 LYS+   QG   26 GLU-  HG2  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 403, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 323, 324,
 &end
#
#  22 LYS+   QG   26 GLU-  HG3  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 404, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 323, 324,
 &end
#
#  22 LYS+   QG   26 GLU-   QG  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 323, 324,
 igr2= 403, 404,
 &end
#
#  22 LYS+   QG   31  VAL   HB  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 323, 324,
 &end
#
#  22 LYS+   QG   31  VAL  QG1  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 323, 324,
 igr2= 483, 484, 485,
 &end
#
#  23 HIS    HA   23 HIS   HD2  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 351, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#  23 HIS   HB2   24  TYR   HN  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 355, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  23 HIS   HB3   24  TYR   HN  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 355, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  23 HIS    HN   23 HIS   HD2  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 351, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  23 HIS    HN   24  TYR   HN  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 355, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#  23 HIS    QB   24  TYR   HN  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 342, 343,
 &end
#
#  24  TYR   HA   27  GLN HE21  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 357, 423, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  24  TYR   HA   27  GLN HE22  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 357, 424, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  24  TYR   HA   27  GLN   HN  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat= 357, 411, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  24  TYR   HA   27  GLN  QE2  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 423, 424,
 &end
#
#  24  TYR  HB2   25  PHE   HN  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 359, 376, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  24  TYR  HB2   70  ILE  QD1  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 359,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2=1113,1114,1115,
 &end
#
#  24  TYR  HB2   70  ILE  QG2  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 359,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1106,1107,1108,
 &end
#
#  24  TYR  HB3   25  PHE   HN  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat= 360, 376, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  24  TYR  HB3   70  ILE  QD1  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2=1113,1114,1115,
 &end
#
#  24  TYR  HB3   70  ILE  QG2  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 360,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1106,1107,1108,
 &end
#
#  24  TYR   HN   24  TYR  HB2  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 359, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  24  TYR   HN   24  TYR  HB3  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 360, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  24  TYR   HN   25  PHE   HN  1.80 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 355, 376, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#  24  TYR   QB   25  PHE   HN  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 376, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 359, 360,
 &end
#
#  24  TYR   QB   25  PHE   QD  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 359, 360,
 igr2= 384, 392,
 &end
#
#  24  TYR   QB   70  ILE  QD1  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 359, 360,
 igr2=1113,1114,1115,
 &end
#
#  25  PHE   HA   25  PHE   QD  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 378,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 384, 392,
 &end
#
#  25  PHE   HA   27  GLN   HN  1.80 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 378, 411, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
#  25  PHE   HA   28  PHE   QD  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 378,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 436, 444,
 &end
#
#  25  PHE   HA   28  PHE   QE  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 378,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr2= 438, 442,
 &end
#
#  25  PHE  HB2   26 GLU-   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 380, 396, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  25  PHE  HB2   31  VAL  QG2  1.80 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 487, 488, 489,
 &end
#
#  25  PHE  HB2   51  VAL  QG1  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 801, 802, 803,
 &end
#
#  25  PHE  HB2   51  VAL  QG2  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 805, 806, 807,
 &end
#
#  25  PHE  HB2   53  PHE   HZ  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 380, 837, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  25  PHE  HB2   53  PHE   QE  1.80 4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 835, 839,
 &end
#
#  25  PHE  HB3   26 GLU-   HN  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 396, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  25  PHE  HB3   31  VAL  QG2  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 487, 488, 489,
 &end
#
#  25  PHE  HB3   51  VAL  QG1  1.80 3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 801, 802, 803,
 &end
#
#  25  PHE  HB3   51  VAL  QG2  1.80 4.91
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2= 805, 806, 807,
 &end
#
#  25  PHE  HB3   53  PHE   HZ  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 837, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#  25  PHE  HB3   53  PHE   QE  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr2= 835, 839,
 &end
#
#  25  PHE   HN   25  PHE  HB2  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 380, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  25  PHE   HN   25  PHE  HB3  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 381, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#  25  PHE   HN   25  PHE   QD  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 384, 392,
 &end
#
#  25  PHE   HN   26 GLU-   HN  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 396, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  25  PHE   HN   31  VAL  QG2  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 376,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 487, 488, 489,
 &end
#
#  25  PHE   QD   51  VAL  QG1  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 384, 392,
 igr2= 801, 802, 803,
 &end
#
#  25  PHE   QD   51  VAL  QG2  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1= 384, 392,
 igr2= 805, 806, 807,
 &end
#
#  25  PHE   QD   53  PHE   HZ  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 384, 392,
 &end
#
#  25  PHE   QD   53  PHE   QE  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 384, 392,
 igr2= 835, 839,
 &end
#
#  25  PHE   QD   62  VAL  QG1  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
 igr1= 384, 392,
 igr2= 976, 977, 978,
 &end
#
#  25  PHE   QD   62  VAL  QG2  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 384, 392,
 igr2= 980, 981, 982,
 &end
#
#  25  PHE   QD   70  ILE  QD1  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
 igr1= 384, 392,
 igr2=1113,1114,1115,
 &end
#
#  25  PHE   QE   51  VAL  QG2  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr1= 386, 390,
 igr2= 805, 806, 807,
 &end
#
#  25  PHE   QE   62  VAL  QG1  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
 igr1= 386, 390,
 igr2= 976, 977, 978,
 &end
#
#  25  PHE   QE   62  VAL  QG2  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1= 386, 390,
 igr2= 980, 981, 982,
 &end
#
#  25  PHE   QE   68 HIS   HE1  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 386, 390,
 &end
#
#  25  PHE   QE   70  ILE  QD1  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1= 386, 390,
 igr2=1113,1114,1115,
 &end
#
#  25  PHE   QE   75  VAL  QG2  1.80 4.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 386, 390,
 igr2=1196,1197,1198,
 &end
#
#  26 GLU-   HA   26 GLU-  HG2  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 403, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  26 GLU-   HA   26 GLU-  HG3  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 404, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  26 GLU-   HA   26 GLU-   QG  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 403, 404,
 &end
#
#  26 GLU-   HA   28  PHE   HN  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 428, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  26 GLU-   HA   29  GLY   HN  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 448, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#  26 GLU-   HA   31  VAL  QG2  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 487, 488, 489,
 &end
#
#  26 GLU-  HB2   27  GLN   HN  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 411, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#  26 GLU-  HB3   27  GLN   HN  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 401, 411, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#  26 GLU-  HG2   31  VAL   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 403, 477, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  26 GLU-  HG2   31  VAL  QG2  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 403,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 487, 488, 489,
 &end
#
#  26 GLU-  HG3   31  VAL   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 404, 477, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  26 GLU-  HG3   31  VAL  QG2  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 404,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 487, 488, 489,
 &end
#
#  26 GLU-   HN   26 GLU-  HB2  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 400, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  26 GLU-   HN   26 GLU-  HB3  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 401, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  26 GLU-   HN   26 GLU-  HG2  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 403, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  26 GLU-   HN   26 GLU-  HG3  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 404, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  26 GLU-   HN   26 GLU-   QB  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
 igr2= 400, 401,
 &end
#
#  26 GLU-   HN   26 GLU-   QG  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr2= 403, 404,
 &end
#
#  26 GLU-   HN   27  GLN   HN  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 411, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  26 GLU-   HN   31  VAL  QG2  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 396,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 487, 488, 489,
 &end
#
#  26 GLU-   QB   27  GLN   HN  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 400, 401,
 &end
#
#  26 GLU-   QG   31  VAL   HB  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 403, 404,
 &end
#
#  26 GLU-   QG   31  VAL   HN  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 403, 404,
 &end
#
#  26 GLU-   QG   31  VAL  QG1  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 403, 404,
 igr2= 483, 484, 485,
 &end
#
#  27  GLN   HA   27  GLN  HG2  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 418, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  27  GLN   HA   27  GLN  HG3  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 413, 419, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  27  GLN   HA   27  GLN   QG  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 418, 419,
 &end
#
#  27  GLN  HG2   28  PHE   HN  1.80 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 418, 428, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  27  GLN  HG3   28  PHE   HN  1.80 4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 428, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  27  GLN   HN   27  GLN  HG2  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 418, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#  27  GLN   HN   27  GLN  HG3  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 419, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#  27  GLN   HN   27  GLN   QB  1.80 3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 415, 416,
 &end
#
#  27  GLN   HN   28  PHE   HN  1.80 3.49
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 428, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  27  GLN   QB   27  GLN  QE2  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
 igr1= 415, 416,
 igr2= 423, 424,
 &end
#
#  27  GLN   QB   28  PHE   HN  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 415, 416,
 &end
#
#  27  GLN   QB   28  PHE   QD  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 415, 416,
 igr2= 436, 444,
 &end
#
#  27  GLN   QG   27  GLN  QE2  1.80 3.22
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 418, 419,
 igr2= 423, 424,
 &end
#
#  27  GLN   QG   28  PHE   HN  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 418, 419,
 &end
#
#  27  GLN   QG   28  PHE   QD  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 418, 419,
 igr2= 436, 444,
 &end
#
#  28  PHE   HA   28  PHE   QD  1.80 3.95
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2= 436, 444,
 &end
#
#  28  PHE   HA   58  ILE  QD1  1.80 5.24
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr2= 911, 912, 913,
 &end
#
#  28  PHE   HA   58  ILE  QG2  1.80 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 904, 905, 906,
 &end
#
#  28  PHE  HB2   29  GLY   HN  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 448, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  28  PHE  HB2   31  VAL  QG2  1.80 5.48
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr2= 487, 488, 489,
 &end
#
#  28  PHE  HB2   53  PHE   HZ  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 432, 837, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  28  PHE  HB2   53  PHE   QD  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 833, 841,
 &end
#
#  28  PHE  HB2   53  PHE   QE  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 835, 839,
 &end
#
#  28  PHE  HB2   58  ILE  QD1  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 911, 912, 913,
 &end
#
#  28  PHE  HB2   58  ILE  QG2  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2= 904, 905, 906,
 &end
#
#  28  PHE  HB2   62  VAL  QG1  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 976, 977, 978,
 &end
#
#  28  PHE  HB2   62  VAL  QG2  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 432,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 980, 981, 982,
 &end
#
#  28  PHE  HB3   29  GLY   HN  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 448, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#  28  PHE  HB3   53  PHE   QE  1.80 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 835, 839,
 &end
#
#  28  PHE  HB3   58  ILE  QD1  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 911, 912, 913,
 &end
#
#  28  PHE  HB3   58  ILE  QG2  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 904, 905, 906,
 &end
#
#  28  PHE  HB3   62  VAL  QG2  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 980, 981, 982,
 &end
#
#  28  PHE  HB3   65  ILE  QD1  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr2=1025,1026,1027,
 &end
#
#  28  PHE   HN   28  PHE  HB2  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 432, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#  28  PHE   HN   28  PHE  HB3  1.80 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 433, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#  28  PHE   HN   28  PHE   QD  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 436, 444,
 &end
#
#  28  PHE   HN   28  PHE   QE  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 428,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 438, 442,
 &end
#
#  28  PHE   HN   29  GLY   HN  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 448, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  28  PHE   HN   30  LYS   HN  5.00 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 455, r1= 4.50, r2= 5.00, r3=100.00, r4=100.50,  &end
#
#  28  PHE   HZ   62  VAL  QG1  1.80 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2= 976, 977, 978,
 &end
#
#  28  PHE   HZ   65  ILE  QD1  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2=1025,1026,1027,
 &end
#
#  28  PHE   HZ   65  ILE  QG2  1.80 5.33
 &rst
  ixpk= 0, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2=1018,1019,1020,
 &end
#
#  28  PHE   HZ   68 HIS   HE1  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 440,1077, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#  28  PHE   QD   58  ILE  QD1  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 436, 444,
 igr2= 911, 912, 913,
 &end
#
#  28  PHE   QD   58  ILE  QG2  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
 igr1= 436, 444,
 igr2= 904, 905, 906,
 &end
#
#  28  PHE   QD   61 LYS+   QD  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 436, 444,
 igr2= 958, 959,
 &end
#
#  28  PHE   QD   62  VAL  QG1  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 436, 444,
 igr2= 976, 977, 978,
 &end
#
#  28  PHE   QD   62  VAL  QG2  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 436, 444,
 igr2= 980, 981, 982,
 &end
#
#  28  PHE   QD   65  ILE  QD1  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 436, 444,
 igr2=1025,1026,1027,
 &end
#
#  28  PHE   QE   62  VAL  QG1  1.80 4.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1= 438, 442,
 igr2= 976, 977, 978,
 &end
#
#  28  PHE   QE   62  VAL  QG2  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 438, 442,
 igr2= 980, 981, 982,
 &end
#
#  28  PHE   QE   65  ILE  QD1  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 438, 442,
 igr2=1025,1026,1027,
 &end
#
#  28  PHE   QE   65  ILE  QG1  1.80 4.78
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 438, 442,
 igr2=1022,1023,
 &end
#
#  29  GLY  HA2   30 LYS+   HN  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 450, 455, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#  29  GLY  HA2   58  ILE  QD1  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 911, 912, 913,
 &end
#
#  29  GLY  HA2   58  ILE  QG1  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 908, 909,
 &end
#
#  29  GLY  HA2   58  ILE  QG2  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 450,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 904, 905, 906,
 &end
#
#  29  GLY  HA3   30 LYS+   HN  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 451, 455, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#  29  GLY  HA3   58  ILE  QD1  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 911, 912, 913,
 &end
#
#  29  GLY  HA3   58  ILE  QG1  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 908, 909,
 &end
#
#  29  GLY  HA3   58  ILE  QG2  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 904, 905, 906,
 &end
#
#  29  GLY   HN   30  LYS   HN  2.80 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 455, r1= 2.30, r2= 2.80, r3=100.00, r4=100.50,  &end
#
#  29  GLY   HN   31  VAL  QG2  1.80 5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 487, 488, 489,
 &end
#
#  29  GLY   HN   53  PHE   QE  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 835, 839,
 &end
#
#  29  GLY   HN   58  ILE  QD1  1.80 5.45
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr2= 911, 912, 913,
 &end
#
#  29  GLY   HN   58  ILE  QG2  1.80 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 904, 905, 906,
 &end
#
#  29  GLY   QA   30 LYS+   HN  1.80 3.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr1= 450, 451,
 &end
#
#  29  GLY   QA   53  PHE   QD  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 450, 451,
 igr2= 833, 841,
 &end
#
#  29  GLY   QA   58  ILE  QG1  1.80 3.69
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 450, 451,
 igr2= 908, 909,
 &end
#
#  29  GLY   QA   58  ILE  QG2  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 450, 451,
 igr2= 904, 905, 906,
 &end
#
#  30 LYS+   HA   30 LYS+  HG2  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 457, 462, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  30 LYS+   HA   30 LYS+  HG3  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 457, 463, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  30 LYS+   HA   31  VAL   HN  1.80 2.85
 &rst
  ixpk= 0, nxpk= 0, iat= 457, 477, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
#  30 LYS+   HA   31  VAL  QG2  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 457,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 487, 488, 489,
 &end
#
#  30 LYS+  HG2   31  VAL   HN  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 462, 477, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  30 LYS+  HG3   31  VAL   HN  1.80 4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 477, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  30 LYS+   HN   30 LYS+  HG2  1.80 4.91
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 462, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  30 LYS+   HN   30 LYS+  HG3  1.80 4.91
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 463, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  30 LYS+   HN   30 LYS+   QB  1.80 2.94
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2= 459, 460,
 &end
#
#  30 LYS+   HN   31  VAL   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 477, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  30 LYS+   HN   31  VAL  QG2  1.80 5.03
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr2= 487, 488, 489,
 &end
#
#  30 LYS+   HN   58  ILE  QD1  1.80 5.29
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr2= 911, 912, 913,
 &end
#
#  30 LYS+   HN   58  ILE  QG1  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr2= 908, 909,
 &end
#
#  30 LYS+   HN   58  ILE  QG2  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 904, 905, 906,
 &end
#
#  30 LYS+   QB   31  VAL   HN  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 459, 460,
 &end
#
#  30 LYS+   QB   54 GLU-  HG2  1.80 5.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 459, 460,
 &end
#
#  30 LYS+   QB   54 GLU-  HG3  1.80 5.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 853, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 459, 460,
 &end
#
#  30 LYS+   QB   54 GLU-   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 459, 460,
 &end
#
#  30 LYS+   QB   54 GLU-   QB  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 459, 460,
 igr2= 849, 850,
 &end
#
#  30 LYS+   QB   54 GLU-   QG  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 459, 460,
 igr2= 852, 853,
 &end
#
#  30 LYS+   QG   30 LYS+   QE  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 462, 463,
 igr2= 468, 469,
 &end
#
#  30 LYS+   QG   31  VAL   HN  1.80 3.69
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 477, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 462, 463,
 &end
#
#  31  VAL   HA   31  VAL  QG1  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 483, 484, 485,
 &end
#
#  31  VAL   HA   31  VAL  QG2  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 487, 488, 489,
 &end
#
#  31  VAL   HA   32 ASP-   HN  1.80 3.06
 &rst
  ixpk= 0, nxpk= 0, iat= 479, 493, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,  &end
#
#  31  VAL   HA   32 ASP-   QB  1.80 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 497, 498,
 &end
#
#  31  VAL   HA   33 ASP-   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 479, 505, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  31  VAL   HA   51  VAL  QG1  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 801, 802, 803,
 &end
#
#  31  VAL   HA   53  PHE   HA  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 479, 827, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  31  VAL   HA   53  PHE   QD  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 479,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 833, 841,
 &end
#
#  31  VAL   HA   54 GLU-   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 479, 845, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  31  VAL   HB   51  VAL  QG1  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 481,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 801, 802, 803,
 &end
#
#  31  VAL   HN   31  VAL   HB  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 477, 481, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  31  VAL   HN   31  VAL  QG1  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 477,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 483, 484, 485,
 &end
#
#  31  VAL   HN   31  VAL  QG2  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 477,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 487, 488, 489,
 &end
#
#  31  VAL  QG1   32 ASP-   HN  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   32 ASP-   QB  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
 igr1= 483, 484, 485,
 igr2= 497, 498,
 &end
#
#  31  VAL  QG1   33 ASP-   HN  1.80 3.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 505, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   33 ASP-   QB  1.80 4.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 483, 484, 485,
 igr2= 509, 510,
 &end
#
#  31  VAL  QG1   34  ALA   HA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 519, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   34  ALA   HN  1.80 4.63
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 517, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   34  ALA   QB  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 483, 484, 485,
 igr2= 521, 522, 523,
 &end
#
#  31  VAL  QG1   51  VAL   HA  1.80 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 797, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   51  VAL  QG1  1.80 2.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 483, 484, 485,
 igr2= 801, 802, 803,
 &end
#
#  31  VAL  QG1   52  THR   HB  1.80 4.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 815, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   52  THR   HN  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   53  PHE   HA  1.80 5.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 827, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
 igr1= 483, 484, 485,
 &end
#
#  31  VAL  QG1   53  PHE   QD  1.80 4.91
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1= 483, 484, 485,
 igr2= 833, 841,
 &end
#
#  31  VAL  QG2   32 ASP-   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 487, 488, 489,
 &end
#
#  31  VAL  QG2   51  VAL  QG1  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 487, 488, 489,
 igr2= 801, 802, 803,
 &end
#
#  31  VAL  QG2   53  PHE   HZ  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 487, 488, 489,
 &end
#
#  31  VAL  QG2   53  PHE   QD  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 487, 488, 489,
 igr2= 833, 841,
 &end
#
#  31  VAL  QG2   53  PHE   QE  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1= 487, 488, 489,
 igr2= 835, 839,
 &end
#
#  32 ASP-  HB2   33 ASP-   HN  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 505, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  32 ASP-  HB2   52  THR   HB  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 815, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  32 ASP-  HB2   52  THR  QG2  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 497,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 817, 818, 819,
 &end
#
#  32 ASP-  HB3   33 ASP-   HN  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 498, 505, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  32 ASP-  HB3   52  THR   HB  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 498, 815, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  32 ASP-  HB3   52  THR  QG2  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 817, 818, 819,
 &end
#
#  32 ASP-   HN   32 ASP-  HB2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 497, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  32 ASP-   HN   32 ASP-  HB3  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 498, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  32 ASP-   HN   32 ASP-   QB  1.80 3.23
 &rst
  ixpk= 0, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2= 497, 498,
 &end
#
#  32 ASP-   HN   33 ASP-   HN  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 505, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  32 ASP-   HN   52  THR  QG2  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 817, 818, 819,
 &end
#
#  32 ASP-   HN   53  PHE   HA  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 827, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  32 ASP-   HN   54 GLU-   HN  1.80 4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 493, 845, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  32 ASP-   QB   33 ASP-   HN  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 505, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 497, 498,
 &end
#
#  32 ASP-   QB   52  THR  QG2  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 497, 498,
 igr2= 817, 818, 819,
 &end
#
#  33 ASP-   HA   34  ALA   HN  1.80 3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 507, 517, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#  33 ASP-   HA   34  ALA   QB  1.80 5.05
 &rst
  ixpk= 0, nxpk= 0, iat= 507,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr2= 521, 522, 523,
 &end
#
#  33 ASP-  HB2   34  ALA   HN  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 509, 517, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  33 ASP-  HB2   52  THR   HB  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 509, 815, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  33 ASP-  HB3   34  ALA   HN  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 517, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  33 ASP-  HB3   52  THR   HB  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 815, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  33 ASP-   HN   33 ASP-  HB2  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 509, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  33 ASP-   HN   33 ASP-  HB3  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 510, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  33 ASP-   HN   34  ALA   HA  1.80 5.35
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 519, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#  33 ASP-   HN   52  THR   HA  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 813, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  33 ASP-   HN   52  THR   HB  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 815, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  33 ASP-   HN   52  THR   HN  1.80 3.69
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 811, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#  33 ASP-   HN   53  PHE   HA  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 827, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  33 ASP-   QB   34  ALA   HN  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 517, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 509, 510,
 &end
#
#  33 ASP-   QB   52  THR   HB  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 815, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 509, 510,
 &end
#
#  33 ASP-   QB   52  THR  QG2  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 509, 510,
 igr2= 817, 818, 819,
 &end
#
#  34  ALA   HA   35  MET   HN  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 527, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
#  34  ALA   HA   51  VAL   HA  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 797, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  34  ALA   HA   51  VAL  QG1  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 801, 802, 803,
 &end
#
#  34  ALA   HA   51  VAL  QG2  1.80 3.99
 &rst
  ixpk= 0, nxpk= 0, iat= 519,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2= 805, 806, 807,
 &end
#
#  34  ALA   HA   52  THR   HN  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 811, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  34  ALA   HN   34  ALA   QB  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 517,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 521, 522, 523,
 &end
#
#  34  ALA   HN   35  MET   HN  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 517, 527, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  34  ALA   QB   35  MET   HA  1.80 5.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 529, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1= 521, 522, 523,
 &end
#
#  34  ALA   QB   35  MET   HN  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 527, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 521, 522, 523,
 &end
#
#  34  ALA   QB   51  VAL   HA  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 797, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 521, 522, 523,
 &end
#
#  34  ALA   QB   51  VAL  QG1  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1= 521, 522, 523,
 igr2= 801, 802, 803,
 &end
#
#  34  ALA   QB   51  VAL  QG2  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
 igr1= 521, 522, 523,
 igr2= 805, 806, 807,
 &end
#
#  34  ALA   QB   52  THR   HN  1.80 4.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 521, 522, 523,
 &end
#
#  35  MET   HA   36  LEU   HN  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 544, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  35  MET   HN   35  MET   QB  1.80 3.56
 &rst
  ixpk= 0, nxpk= 0, iat= 527,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2= 531, 532,
 &end
#
#  35  MET   HN   35  MET   QG  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 527,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 534, 535,
 &end
#
#  35  MET   HN   36  LEU  QD2  1.80 4.87
 &rst
  ixpk= 0, nxpk= 0, iat= 527,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2= 557, 558, 559,
 &end
#
#  35  MET   HN   51  VAL   HA  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 527, 797, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  35  MET   QB   36  LEU   HN  1.80 3.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 531, 532,
 &end
#
#  35  MET   QE   50  PHE   HN  1.80 4.48
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 538, 539, 540,
 &end
#
#  35  MET   QE   50  PHE   QD  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1= 538, 539, 540,
 igr2= 783, 791,
 &end
#
#  35  MET   QG   36  LEU   HN  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 534, 535,
 &end
#
#  35  MET   QG   50  PHE   QD  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 534, 535,
 igr2= 783, 791,
 &end
#
#  35  MET   QG   50  PHE   QE  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 534, 535,
 igr2= 785, 789,
 &end
#
#  36  LEU   HA   36  LEU  QD1  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2= 553, 554, 555,
 &end
#
#  36  LEU   HA   36  LEU  QD2  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 557, 558, 559,
 &end
#
#  36  LEU   HA   37  MET   HN  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 563, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#  36  LEU   HA   49  GLY  HA2  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 770, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  36  LEU   HA   49  GLY  HA3  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 771, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  36  LEU   HA   50  PHE   HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 546, 775, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  36  LEU  HB2   37  MET   HN  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 548, 563, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  36  LEU  HB3   37  MET   HN  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 549, 563, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  36  LEU   HG   49  GLY   QA  1.80 5.22
 &rst
  ixpk= 0, nxpk= 0, iat= 551,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2= 770, 771,
 &end
#
#  36  LEU   HN   36  LEU   HG  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 544, 551, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  36  LEU   HN   36  LEU   QB  1.80 3.42
 &rst
  ixpk= 0, nxpk= 0, iat= 544,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 548, 549,
 &end
#
#  36  LEU   HN   36  LEU  QD1  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat= 544,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 553, 554, 555,
 &end
#
#  36  LEU   HN   36  LEU  QD2  1.80 4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 544,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 557, 558, 559,
 &end
#
#  36  LEU   HN   37  MET   HN  1.80 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 544, 563, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#  36  LEU   QB   36  LEU  QD2  1.80 2.89
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr1= 548, 549,
 igr2= 557, 558, 559,
 &end
#
#  36  LEU   QB   37  MET   HN  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 548, 549,
 &end
#
#  36  LEU   QB   38  PHE   HZ  1.80 4.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 548, 549,
 &end
#
#  36  LEU   QB   38  PHE   QD  1.80 4.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 548, 549,
 igr2= 588, 596,
 &end
#
#  36  LEU   QB   38  PHE   QE  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr1= 548, 549,
 igr2= 590, 594,
 &end
#
#  36  LEU   QB   45 HIS   HE1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 709, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 548, 549,
 &end
#
#  36  LEU   QB   45 HIS    QB  1.80 4.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 548, 549,
 igr2= 704, 705,
 &end
#
#  36  LEU  QD1   38  PHE   HZ  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 553, 554, 555,
 &end
#
#  36  LEU  QD1   38  PHE   QE  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 553, 554, 555,
 igr2= 590, 594,
 &end
#
#  36  LEU  QD1   45 HIS   HD2  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 713, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1= 553, 554, 555,
 &end
#
#  36  LEU  QD1   45 HIS    QB  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 553, 554, 555,
 igr2= 704, 705,
 &end
#
#  36  LEU  QD2   37  MET   HN  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 563, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QD2   49  GLY  HA2  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QD2   49  GLY  HA3  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QD2   49  GLY   HN  1.80 4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QD2   49  GLY   QA  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 557, 558, 559,
 igr2= 770, 771,
 &end
#
#  36  LEU  QD2   50  PHE   HN  1.80 4.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 557, 558, 559,
 &end
#
#  36  LEU  QQD   45 HIS   HD2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 713, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 553, 554, 555, 557, 558, 559,
 &end
#
#  37  MET   HA   37  MET   QE  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 565,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2= 574, 575, 576,
 &end
#
#  37  MET   HA   38  PHE   HN  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat= 565, 580, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#  37  MET  HB2   38  PHE   HN  1.80 4.95
 &rst
  ixpk= 0, nxpk= 0, iat= 567, 580, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  37  MET  HB3   38  PHE   HN  1.80 4.95
 &rst
  ixpk= 0, nxpk= 0, iat= 568, 580, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  37  MET   HN   37  MET  HB2  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 567, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  37  MET   HN   37  MET  HB3  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 568, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  37  MET   HN   37  MET  HG2  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 570, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  37  MET   HN   37  MET  HG3  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 571, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  37  MET   HN   37  MET   QB  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 567, 568,
 &end
#
#  37  MET   HN   37  MET   QG  1.80 3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 563,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 570, 571,
 &end
#
#  37  MET   HN   46  ARG   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 717, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  37  MET   HN   46 ARG+   HN  1.80 5.44
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 717, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
#  37  MET   HN   49  GLY  HA2  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 770, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  37  MET   HN   49  GLY  HA3  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 771, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  37  MET   QB   37  MET   QE  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 567, 568,
 igr2= 574, 575, 576,
 &end
#
#  37  MET   QB   48  PHE   HZ  1.80 5.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 567, 568,
 &end
#
#  37  MET   QB   48  PHE   QE  1.80 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 567, 568,
 igr2= 758, 762,
 &end
#
#  37  MET   QE   38  PHE   HN  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 580, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr1= 574, 575, 576,
 &end
#
#  37  MET   QE   48  PHE   QE  1.80 4.69
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1= 574, 575, 576,
 igr2= 758, 762,
 &end
#
#  37  MET   QE   50  PHE   QD  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 574, 575, 576,
 igr2= 783, 791,
 &end
#
#  37  MET   QE   50  PHE   QE  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 574, 575, 576,
 igr2= 785, 789,
 &end
#
#  37  MET   QG   48  PHE   HZ  1.80 5.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr1= 570, 571,
 &end
#
#  37  MET   QG   48  PHE   QE  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 570, 571,
 igr2= 758, 762,
 &end
#
#  37  MET   QG   49  GLY   QA  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 570, 571,
 igr2= 770, 771,
 &end
#
#  37  MET   QG   50  PHE   QD  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 570, 571,
 igr2= 783, 791,
 &end
#
#  37  MET   QG   50  PHE   QE  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 570, 571,
 igr2= 785, 789,
 &end
#
#  38  PHE   HA   39 ASP-   HN  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 600, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  38  PHE   HA   45 HIS    HA  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 702, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  38  PHE   HA   46 ARG+   HN  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 582, 717, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#  38  PHE  HB2   39 ASP-   HN  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 584, 600, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#  38  PHE  HB3   39 ASP-   HN  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 585, 600, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#  38  PHE   HN   38  PHE  HB2  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 584, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  38  PHE   HN   38  PHE  HB3  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 585, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  38  PHE   HN   38  PHE   QB  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 584, 585,
 &end
#
#  38  PHE   HN   38  PHE   QD  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 588, 596,
 &end
#
#  38  PHE   QB   39 ASP-   HN  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 584, 585,
 &end
#
#  38  PHE   QD   38  PHE   HZ  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 588, 596,
 &end
#
#  38  PHE   QD   39 ASP-   HN  1.80 4.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 600, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 588, 596,
 &end
#
#  38  PHE   QD   46 ARG+   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 717, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 588, 596,
 &end
#
#  39 ASP-   HN   39 ASP-  HB2  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 604, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  39 ASP-   HN   39 ASP-  HB3  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 605, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  39 ASP-   HN   39 ASP-   QB  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 600,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 604, 605,
 &end
#
#  39 ASP-   HN   40 LYS+   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 612, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  39 ASP-   HN   44 ARG+   HN  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 600, 676, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  39 ASP-   QB   44 ARG+   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 676, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 604, 605,
 &end
#
#  40 LYS+   HA   40 LYS+   QG  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 614,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr2= 619, 620,
 &end
#
#  40 LYS+   HA   43  ASN   HN  1.80 5.26
 &rst
  ixpk= 0, nxpk= 0, iat= 614, 662, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#  40 LYS+   HN   40 LYS+   QB  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 612,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 616, 617,
 &end
#
#  40 LYS+   QB   41  THR   HN  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 634, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 616, 617,
 &end
#
#  41  THR   HA   41  THR  QG2  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 636,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 640, 641, 642,
 &end
#
#  41  THR   HA   43  ASN   HN  1.80 5.19
 &rst
  ixpk= 0, nxpk= 0, iat= 636, 662, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#  41  THR   HB   42  THR   HN  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 638, 648, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#  41  THR   HB   43  ASN   HN  1.80 5.17
 &rst
  ixpk= 0, nxpk= 0, iat= 638, 662, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
#  41  THR   HN   41  THR   HB  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 638, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  41  THR   HN   41  THR  QG2  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 634,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 640, 641, 642,
 &end
#
#  41  THR   HN   42  THR   HN  1.80 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 648, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  41  THR   HN   43  ASN   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 662, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  41  THR  QG2   42  THR   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 648, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1= 640, 641, 642,
 &end
#
#  42  THR   HA   42  THR  QG2  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat= 650,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2= 654, 655, 656,
 &end
#
#  42  THR   HN   42  THR  QG2  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 648,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2= 654, 655, 656,
 &end
#
#  42  THR   HN   43  ASN   HA  1.80 5.25
 &rst
  ixpk= 0, nxpk= 0, iat= 648, 664, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#  42  THR   HN   43  ASN   HN  1.80 3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 648, 662, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  42  THR  QG2   43  ASN   HN  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 662, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 654, 655, 656,
 &end
#
#  43  ASN   HN   44 ARG+   HN  1.80 3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 662, 676, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  44 ARG+   HA   45 HIS    HN  1.80 3.45
 &rst
  ixpk= 0, nxpk= 0, iat= 678, 700, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  44 ARG+  HB2   45 HIS    HN  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 680, 700, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  44 ARG+  HB3   45 HIS    HN  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 681, 700, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  44 ARG+   HN   44 ARG+  HB2  1.80 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 676, 680, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  44 ARG+   HN   44 ARG+  HB3  1.80 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 676, 681, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  44 ARG+   HN   44 ARG+  HG2  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 676, 683, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#  44 ARG+   HN   44 ARG+  HG3  1.80 4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 676, 684, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#  44 ARG+   HN   44 ARG+   QB  1.80 3.42
 &rst
  ixpk= 0, nxpk= 0, iat= 676,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 680, 681,
 &end
#
#  44 ARG+   HN   44 ARG+   QG  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 676,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 683, 684,
 &end
#
#  44 ARG+   QB   44 ARG+   HE  1.80 4.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 689, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 680, 681,
 &end
#
#  44 ARG+   QB   44 ARG+   QD  1.80 2.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
 igr1= 680, 681,
 igr2= 686, 687,
 &end
#
#  44 ARG+   QB   45 HIS    HA  1.80 4.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 702, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1= 680, 681,
 &end
#
#  45 HIS    HA   46 ARG+   HA  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 702, 719, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  45 HIS    HA   46 ARG+   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 702, 717, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#  45 HIS   HB2   46 ARG+   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 704, 717, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  45 HIS   HB3   46 ARG+   HN  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 705, 717, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  45 HIS   HE1   47  GLY   HN  1.80 4.73
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 741, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#  45 HIS   HE1   47  GLY   QA  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 709,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 743, 744,
 &end
#
#  45 HIS    HN   45 HIS    HA  2.70 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 700, 702, r1= 2.20, r2= 2.70, r3=100.00, r4=100.50,  &end
#
#  45 HIS    HN   45 HIS   HD2  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 700, 713, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  45 HIS    QB   46 ARG+   HN  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 717, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 704, 705,
 &end
#
#  46  ARG   HA   46  ARG   HN  2.70 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 717, r1= 2.20, r2= 2.70, r3=100.00, r4=100.50,  &end
#
#  46 ARG+   HA   46 ARG+   QG  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 719,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr2= 724, 725,
 &end
#
#  46 ARG+  HB2   48  PHE   QE  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 758, 762,
 &end
#
#  46 ARG+  HB3   48  PHE   QE  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 722,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 758, 762,
 &end
#
#  46 ARG+  HD2   48  PHE   QE  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 727,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 758, 762,
 &end
#
#  46 ARG+  HD3   48  PHE   QE  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 728,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 758, 762,
 &end
#
#  46 ARG+   HE   48  PHE   QE  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat= 730,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 758, 762,
 &end
#
#  46 ARG+   HN   46 ARG+  HB2  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 717, 721, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  46 ARG+   HN   46 ARG+  HB3  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 717, 722, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  46 ARG+   HN   46 ARG+   QB  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 721, 722,
 &end
#
#  46 ARG+   HN   46 ARG+   QG  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 724, 725,
 &end
#
#  46 ARG+   HN   47  GLY   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat= 717, 741, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  46 ARG+   HN   48  PHE   HN  1.80 4.83
 &rst
  ixpk= 0, nxpk= 0, iat= 717, 748, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  46 ARG+   QB   46 ARG+   HE  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 730, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 721, 722,
 &end
#
#  46 ARG+   QB   46 ARG+   QD  1.80 3.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 721, 722,
 igr2= 727, 728,
 &end
#
#  46 ARG+   QB   48  PHE   HN  1.80 5.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 721, 722,
 &end
#
#  46 ARG+   QB   48  PHE   HZ  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 721, 722,
 &end
#
#  46 ARG+   QB   48  PHE   QE  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 721, 722,
 igr2= 758, 762,
 &end
#
#  46 ARG+   QD   48  PHE   HZ  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 760, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 727, 728,
 &end
#
#  47  GLY   HN   48  PHE   HN  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 741, 748, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  48  PHE   HA   49  GLY   HN  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 750, 768, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  48  PHE  HB2   49  GLY   HN  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 752, 768, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  48  PHE  HB3   49  GLY   HN  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 753, 768, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  48  PHE   HN   48  PHE   QE  1.80 5.11
 &rst
  ixpk= 0, nxpk= 0, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 758, 762,
 &end
#
#  48  PHE   QB   49  GLY   HN  1.80 3.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr1= 752, 753,
 &end
#
#  48  PHE   QE   50  PHE   HZ  1.80 5.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 787, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 758, 762,
 &end
#
#  48  PHE   QE   50  PHE   QD  1.80 4.86
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 758, 762,
 igr2= 783, 791,
 &end
#
#  48  PHE   QE   50  PHE   QE  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1= 758, 762,
 igr2= 785, 789,
 &end
#
#  49  GLY  HA2   50  PHE   QD  1.80 5.10
 &rst
  ixpk= 0, nxpk= 0, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 783, 791,
 &end
#
#  49  GLY  HA3   50  PHE   QD  1.80 5.10
 &rst
  ixpk= 0, nxpk= 0, iat= 771,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 783, 791,
 &end
#
#  49  GLY   QA   50  PHE   HN  1.80 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr1= 770, 771,
 &end
#
#  49  GLY   QA   50  PHE   QD  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 770, 771,
 igr2= 783, 791,
 &end
#
#  50  PHE   HA   50  PHE   QD  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 777,  -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr2= 783, 791,
 &end
#
#  50  PHE   HA   51  VAL   HN  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 777, 795, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
#  50  PHE   HA   51  VAL  QG2  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 777,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 805, 806, 807,
 &end
#
#  50  PHE  HB2   51  VAL   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 795, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  50  PHE  HB3   51  VAL   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 780, 795, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  50  PHE   HN   50  PHE   QB  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 775,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 779, 780,
 &end
#
#  50  PHE   HN   50  PHE   QD  1.80 4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 775,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 783, 791,
 &end
#
#  50  PHE   HN   50  PHE   QE  1.80 4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 775,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 785, 789,
 &end
#
#  50  PHE   HZ   80  ALA   QB  1.80 4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 787,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2=1276,1277,1278,
 &end
#
#  50  PHE   QB   51  VAL   HN  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 779, 780,
 &end
#
#  50  PHE   QD   51  VAL   HN  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 795, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 783, 791,
 &end
#
#  50  PHE   QD   80  ALA   QB  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 783, 791,
 igr2=1276,1277,1278,
 &end
#
#  50  PHE   QE   80  ALA   QB  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 785, 789,
 igr2=1276,1277,1278,
 &end
#
#  51  VAL   HA   51  VAL  QG1  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 797,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 801, 802, 803,
 &end
#
#  51  VAL   HA   51  VAL  QG2  1.80 3.27
 &rst
  ixpk= 0, nxpk= 0, iat= 797,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 805, 806, 807,
 &end
#
#  51  VAL   HA   52  THR   HN  1.80 2.99
 &rst
  ixpk= 0, nxpk= 0, iat= 797, 811, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#  51  VAL   HB   52  THR   HN  1.80 5.26
 &rst
  ixpk= 0, nxpk= 0, iat= 799, 811, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#  51  VAL   HN   51  VAL   HB  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 795, 799, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#  51  VAL   HN   51  VAL  QG1  1.80 4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 795,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2= 801, 802, 803,
 &end
#
#  51  VAL   HN   51  VAL  QG2  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 795,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2= 805, 806, 807,
 &end
#
#  51  VAL  QG1   52  THR   HA  1.80 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 813, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 801, 802, 803,
 &end
#
#  51  VAL  QG1   52  THR   HN  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 801, 802, 803,
 &end
#
#  51  VAL  QG1   53  PHE  HB2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 801, 802, 803,
 &end
#
#  51  VAL  QG1   53  PHE   HZ  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 837, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 801, 802, 803,
 &end
#
#  51  VAL  QG1   53  PHE   QE  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 801, 802, 803,
 igr2= 835, 839,
 &end
#
#  51  VAL  QG2   52  THR   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 811, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1= 805, 806, 807,
 &end
#
#  52  THR   HA   52  THR  QG2  1.80 3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 813,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 817, 818, 819,
 &end
#
#  52  THR   HA   53  PHE   HN  1.80 3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 813, 825, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#  52  THR   HA   53  PHE   QD  1.80 4.22
 &rst
  ixpk= 0, nxpk= 0, iat= 813,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2= 833, 841,
 &end
#
#  52  THR   HA   59  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 813,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 927, 928, 929,
 &end
#
#  52  THR   HB   53  PHE   HN  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 815, 825, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  52  THR   HN   52  THR   HB  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat= 811, 815, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  52  THR   HN   52  THR  QG2  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 811,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 817, 818, 819,
 &end
#
#  52  THR  QG2   53  PHE  HB2  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr1= 817, 818, 819,
 &end
#
#  52  THR  QG2   53  PHE   HN  1.80 3.46
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 825, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 817, 818, 819,
 &end
#
#  52  THR  QG2   53  PHE   QD  1.80 5.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
 igr1= 817, 818, 819,
 igr2= 833, 841,
 &end
#
#  53  PHE   HA   53  PHE   QD  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 827,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 833, 841,
 &end
#
#  53  PHE   HA   54 GLU-   HN  1.80 3.27
 &rst
  ixpk= 0, nxpk= 0, iat= 827, 845, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  53  PHE   HA   59  VAL  QG2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 827,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE  HB2   54 GLU-   HN  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 829, 845, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  53  PHE  HB2   55  SER   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 829, 860, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  53  PHE  HB2   58  ILE   HB  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 829, 902, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  53  PHE  HB2   58  ILE  QG2  1.80 5.02
 &rst
  ixpk= 0, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE  HB2   59  VAL  QG2  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE  HB3   54 GLU-   HN  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat= 830, 845, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  53  PHE  HB3   55  SER   HN  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 830, 860, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#  53  PHE  HB3   58  ILE  QG2  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat= 830,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE  HB3   59  VAL   HN  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat= 830, 917, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
#  53  PHE  HB3   59  VAL  QG2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 830,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE   HN   53  PHE  HB2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 825, 829, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  53  PHE   HN   53  PHE  HB3  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat= 825, 830, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  53  PHE   HN   53  PHE   QD  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat= 825,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 833, 841,
 &end
#
#  53  PHE   HN   54 GLU-   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 825, 845, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  53  PHE   HN   59  VAL  QG2  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 825,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE   HZ   58  ILE  QG2  1.80 4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 837,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE   HZ   59  VAL   HA  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 837, 919, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  53  PHE   HZ   62  VAL  QG1  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 837,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 976, 977, 978,
 &end
#
#  53  PHE   HZ   62  VAL  QG2  1.80 3.58
 &rst
  ixpk= 0, nxpk= 0, iat= 837,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 980, 981, 982,
 &end
#
#  53  PHE   QD   54 GLU-   HN  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 845, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 833, 841,
 &end
#
#  53  PHE   QD   55  SER   HN  1.80 5.06
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 833, 841,
 &end
#
#  53  PHE   QD   58  ILE   HB  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 833, 841,
 &end
#
#  53  PHE   QD   58  ILE  QD1  1.80 4.54
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 833, 841,
 igr2= 911, 912, 913,
 &end
#
#  53  PHE   QD   58  ILE  QG2  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 833, 841,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE   QD   59  VAL   HA  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 833, 841,
 &end
#
#  53  PHE   QD   59  VAL  QG2  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr1= 833, 841,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE   QD   62  VAL  QG2  1.80 5.12
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1= 833, 841,
 igr2= 980, 981, 982,
 &end
#
#  53  PHE   QE   58  ILE  QG2  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 835, 839,
 igr2= 904, 905, 906,
 &end
#
#  53  PHE   QE   59  VAL   HA  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 835, 839,
 &end
#
#  53  PHE   QE   59  VAL  QG2  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 835, 839,
 igr2= 927, 928, 929,
 &end
#
#  53  PHE   QE   62  VAL  QG1  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 835, 839,
 igr2= 976, 977, 978,
 &end
#
#  53  PHE   QE   62  VAL  QG2  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 835, 839,
 igr2= 980, 981, 982,
 &end
#
#  54 GLU-   HA   54 GLU-   QG  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 847,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 852, 853,
 &end
#
#  54 GLU-   HN   54 GLU-  HG2  1.80 5.41
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 852, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#  54 GLU-   HN   54 GLU-  HG3  1.80 5.41
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 853, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#  54 GLU-   HN   54 GLU-   QB  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 845,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2= 849, 850,
 &end
#
#  54 GLU-   HN   54 GLU-   QG  1.80 4.62
 &rst
  ixpk= 0, nxpk= 0, iat= 845,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 852, 853,
 &end
#
#  54 GLU-   QB   55  SER   HN  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 849, 850,
 &end
#
#  54 GLU-   QG   55  SER   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 852, 853,
 &end
#
#  55  SER  HB2   58  ILE  QG1  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 864,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 908, 909,
 &end
#
#  55  SER  HB3   58  ILE  QG1  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat= 865,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 908, 909,
 &end
#
#  55  SER   HN   55  SER  HB2  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 860, 864, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  55  SER   HN   55  SER  HB3  1.80 3.67
 &rst
  ixpk= 0, nxpk= 0, iat= 860, 865, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  55  SER   HN   55  SER   QB  1.80 3.16
 &rst
  ixpk= 0, nxpk= 0, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 864, 865,
 &end
#
#  55  SER   HN   56  GLU   HN  2.70 100.00
 &rst
  ixpk= 0, nxpk= 0, iat= 860, 871, r1= 2.20, r2= 2.70, r3=100.00, r4=100.50,  &end
#
#  55  SER   HN   58  ILE   HB  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat= 860, 902, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  55  SER   HN   58  ILE  QD1  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 911, 912, 913,
 &end
#
#  55  SER   QB   57 ASP-   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 864, 865,
 &end
#
#  55  SER   QB   58  ILE   HB  1.80 4.27
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 864, 865,
 &end
#
#  55  SER   QB   58  ILE   HN  1.80 4.09
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 898, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 864, 865,
 &end
#
#  55  SER   QB   58  ILE  QD1  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 864, 865,
 igr2= 911, 912, 913,
 &end
#
#  55  SER   QB   58  ILE  QG1  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 864, 865,
 igr2= 908, 909,
 &end
#
#  55  SER   QB   58  ILE  QG2  1.80 4.84
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
 igr1= 864, 865,
 igr2= 904, 905, 906,
 &end
#
#  56 GLU-   HA   56 GLU-   QG  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 873,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 878, 879,
 &end
#
#  56 GLU-   HA   58  ILE   HN  1.80 4.45
 &rst
  ixpk= 0, nxpk= 0, iat= 873, 898, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#  56 GLU-   HA   59  VAL   HB  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 873, 921, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  56 GLU-   HA   59  VAL   HN  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 873, 917, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  56 GLU-   HA   59  VAL  QG2  1.80 3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 873,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 927, 928, 929,
 &end
#
#  56 GLU-   HN   56 GLU-   QB  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 871,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 875, 876,
 &end
#
#  56 GLU-   HN   56 GLU-   QG  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 871,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 878, 879,
 &end
#
#  56 GLU-   HN   57 ASP-   HN  1.80 3.61
 &rst
  ixpk= 0, nxpk= 0, iat= 871, 886, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  56 GLU-   QB   57 ASP-   HA  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 888, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 875, 876,
 &end
#
#  56 GLU-   QB   57 ASP-   HN  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 875, 876,
 &end
#
#  56 GLU-   QB   59  VAL  QG2  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 875, 876,
 igr2= 927, 928, 929,
 &end
#
#  56 GLU-   QG   57 ASP-   HN  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 878, 879,
 &end
#
#  57 ASP-   HA   58  ILE  QD1  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 888,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 911, 912, 913,
 &end
#
#  57 ASP-   HA   60 GLU-   HN  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 888, 933, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  57 ASP-   HA   60 GLU-   QB  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 888,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 937, 938,
 &end
#
#  57 ASP-   HA   60 GLU-   QG  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 888,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 940, 941,
 &end
#
#  57 ASP-  HB2   58  ILE   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 890, 898, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  57 ASP-  HB2   58  ILE  QD1  1.80 4.24
 &rst
  ixpk= 0, nxpk= 0, iat= 890,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 911, 912, 913,
 &end
#
#  57 ASP-  HB3   58  ILE   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 891, 898, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  57 ASP-  HB3   58  ILE  QD1  1.80 4.24
 &rst
  ixpk= 0, nxpk= 0, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 911, 912, 913,
 &end
#
#  57 ASP-   HN   57 ASP-  HB2  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 886, 890, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  57 ASP-   HN   57 ASP-  HB3  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 886, 891, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  57 ASP-   HN   57 ASP-   QB  1.80 3.19
 &rst
  ixpk= 0, nxpk= 0, iat= 886,  -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
 igr2= 890, 891,
 &end
#
#  57 ASP-   HN   58  ILE   HN  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 886, 898, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#  57 ASP-   HN   58  ILE  QD1  1.80 5.40
 &rst
  ixpk= 0, nxpk= 0, iat= 886,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 911, 912, 913,
 &end
#
#  57 ASP-   QB   58  ILE  QD1  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1= 890, 891,
 igr2= 911, 912, 913,
 &end
#
#  58  ILE   HA   58  ILE  QD1  1.80 2.90
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
 igr2= 911, 912, 913,
 &end
#
#  58  ILE   HA   58  ILE  QG1  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 908, 909,
 &end
#
#  58  ILE   HA   58  ILE  QG2  1.80 3.08
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 904, 905, 906,
 &end
#
#  58  ILE   HA   61 LYS+  HB2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 900, 952, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  58  ILE   HA   61 LYS+  HB3  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 900, 953, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  58  ILE   HA   61 LYS+   HN  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 900, 948, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  58  ILE   HA   61 LYS+   QB  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 952, 953,
 &end
#
#  58  ILE   HA   61 LYS+   QD  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 958, 959,
 &end
#
#  58  ILE   HB   58  ILE  QD1  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat= 902,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 911, 912, 913,
 &end
#
#  58  ILE   HB   59  VAL   HN  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat= 902, 917, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  58  ILE   HB   59  VAL  QG2  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat= 902,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 927, 928, 929,
 &end
#
#  58  ILE   HN   58  ILE   HB  1.80 3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 898, 902, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#  58  ILE   HN   58  ILE  QD1  1.80 3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 911, 912, 913,
 &end
#
#  58  ILE   HN   58  ILE  QG1  1.80 3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 908, 909,
 &end
#
#  58  ILE   HN   58  ILE  QG2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 904, 905, 906,
 &end
#
#  58  ILE   HN   59  VAL   HN  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 898, 917, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  58  ILE   HN   59  VAL  QG2  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 927, 928, 929,
 &end
#
#  58  ILE  QD1   61 LYS+   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 948, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 911, 912, 913,
 &end
#
#  58  ILE  QD1   61 LYS+   QB  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 911, 912, 913,
 igr2= 952, 953,
 &end
#
#  58  ILE  QD1   61 LYS+   QD  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 911, 912, 913,
 igr2= 958, 959,
 &end
#
#  58  ILE  QD1   62  VAL   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 970, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 911, 912, 913,
 &end
#
#  58  ILE  QG1   59  VAL   HN  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr1= 908, 909,
 &end
#
#  58  ILE  QG1   62  VAL  QG2  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
 igr1= 908, 909,
 igr2= 980, 981, 982,
 &end
#
#  58  ILE  QG2   59  VAL   HN  1.80 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 904, 905, 906,
 &end
#
#  58  ILE  QG2   59  VAL  QG2  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr1= 904, 905, 906,
 igr2= 927, 928, 929,
 &end
#
#  58  ILE  QG2   61 LYS+   HN  1.80 5.18
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 948, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 904, 905, 906,
 &end
#
#  58  ILE  QG2   61 LYS+   QB  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 904, 905, 906,
 igr2= 952, 953,
 &end
#
#  58  ILE  QG2   62  VAL   HB  1.80 4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 974, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 904, 905, 906,
 &end
#
#  58  ILE  QG2   62  VAL   HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 970, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 904, 905, 906,
 &end
#
#  58  ILE  QG2   62  VAL  QG1  1.80 4.20
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 904, 905, 906,
 igr2= 976, 977, 978,
 &end
#
#  58  ILE  QG2   62  VAL  QG2  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
 igr1= 904, 905, 906,
 igr2= 980, 981, 982,
 &end
#
#  59  VAL   HA   53  PHE  HD1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 833, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  59  VAL   HA   53  PHE  HD2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 841, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  59  VAL   HA   53  PHE  HE1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 835, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  59  VAL   HA   53  PHE  HE2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 839, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  59  VAL   HA   59  VAL  QG1  1.80 3.06
 &rst
  ixpk= 0, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
 igr2= 923, 924, 925,
 &end
#
#  59  VAL   HA   59  VAL  QG2  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 927, 928, 929,
 &end
#
#  59  VAL   HA   62  VAL   HB  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 974, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#  59  VAL   HA   62  VAL   HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 970, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  59  VAL   HA   62  VAL  QG1  1.80 4.84
 &rst
  ixpk= 0, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr2= 976, 977, 978,
 &end
#
#  59  VAL   HA   62  VAL  QG2  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 980, 981, 982,
 &end
#
#  59  VAL   HA   63  CYS   HN  1.80 4.98
 &rst
  ixpk= 0, nxpk= 0, iat= 919, 986, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  59  VAL   HB   60 GLU-   HN  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 921, 933, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#  59  VAL   HB   61 LYS+   HN  1.80 5.39
 &rst
  ixpk= 0, nxpk= 0, iat= 921, 948, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  59  VAL   HN   59  VAL   HB  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 917, 921, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#  59  VAL   HN   59  VAL  QG1  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 923, 924, 925,
 &end
#
#  59  VAL   HN   59  VAL  QG2  1.80 2.96
 &rst
  ixpk= 0, nxpk= 0, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 927, 928, 929,
 &end
#
#  59  VAL   HN   60 GLU-   HN  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat= 917, 933, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#  59  VAL  QG1   60 GLU-   HA  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 935, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   60 GLU-   HN  1.80 3.81
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   63  CYS   HN  1.80 4.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 986, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+   HA  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1252, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+  HG2  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+  HG3  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1258, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1250, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 923, 924, 925,
 &end
#
#  59  VAL  QG1   79 LYS+   QE  1.80 3.35
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 923, 924, 925,
 igr2=1263,1264,
 &end
#
#  59  VAL  QG2   60 GLU-   HN  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 927, 928, 929,
 &end
#
#  60 GLU-   HA   60 GLU-   QG  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 940, 941,
 &end
#
#  60 GLU-   HA   63  CYS  HB2  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 990, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  60 GLU-   HA   63  CYS  HB3  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 991, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  60 GLU-   HA   63  CYS   HN  1.80 4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 986, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  60 GLU-   HA   63  CYS   QB  1.80 3.57
 &rst
  ixpk= 0, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 990, 991,
 &end
#
#  60 GLU-   HA   64 GLU-   HN  1.80 4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 997, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  60 GLU-   HA   79 LYS+   QE  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=1263,1264,
 &end
#
#  60 GLU-   HN   60 GLU-   QB  1.80 3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr2= 937, 938,
 &end
#
#  60 GLU-   HN   60 GLU-   QG  1.80 3.49
 &rst
  ixpk= 0, nxpk= 0, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 940, 941,
 &end
#
#  60 GLU-   HN   61 LYS+   HN  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 933, 948, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  60 GLU-   QB   61 LYS+   HN  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 948, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 937, 938,
 &end
#
#  60 GLU-   QG   61 LYS+   HN  1.80 4.34
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 948, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 940, 941,
 &end
#
#  61 LYS+   HA   61 LYS+  HG2  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 955, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  61 LYS+   HA   61 LYS+  HG3  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 956, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  61 LYS+   HA   61 LYS+   QD  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 958, 959,
 &end
#
#  61 LYS+   HA   61 LYS+   QG  1.80 3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2= 955, 956,
 &end
#
#  61 LYS+   HA   64 GLU-   HN  1.80 4.06
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 997, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  61 LYS+   HA   64 GLU-   QB  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2=1001,1002,
 &end
#
#  61 LYS+  HB2   62  VAL   HN  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 952, 970, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#  61 LYS+  HB3   62  VAL   HN  1.80 3.73
 &rst
  ixpk= 0, nxpk= 0, iat= 953, 970, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#  61 LYS+   HN   61 LYS+  HB2  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 952, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  61 LYS+   HN   61 LYS+  HB3  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 953, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  61 LYS+   HN   61 LYS+  HG2  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 955, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  61 LYS+   HN   61 LYS+  HG3  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 956, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  61 LYS+   HN   61 LYS+   QG  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 948,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 955, 956,
 &end
#
#  61 LYS+   HN   62  VAL   HN  1.80 3.47
 &rst
  ixpk= 0, nxpk= 0, iat= 948, 970, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  61 LYS+   QB   62  VAL   HN  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 970, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1= 952, 953,
 &end
#
#  61 LYS+   QD   62  VAL  QG2  1.80 5.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
 igr1= 958, 959,
 igr2= 980, 981, 982,
 &end
#
#  62  VAL   HA   28  PHE  HD1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 972, 436, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  62  VAL   HA   28  PHE  HD2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 972, 444, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  62  VAL   HA   28  PHE  HE1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 972, 438, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  62  VAL   HA   28  PHE  HE2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 972, 442, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  62  VAL   HA   62  VAL  QG1  1.80 3.13
 &rst
  ixpk= 0, nxpk= 0, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 976, 977, 978,
 &end
#
#  62  VAL   HA   62  VAL  QG2  1.80 3.22
 &rst
  ixpk= 0, nxpk= 0, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 980, 981, 982,
 &end
#
#  62  VAL   HA   65  ILE   HB  1.80 3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 972,1016, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  62  VAL   HA   65  ILE   HN  1.80 4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 972,1012, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  62  VAL   HA   65  ILE  QD1  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2=1025,1026,1027,
 &end
#
#  62  VAL   HA   65  ILE  QG2  1.80 5.02
 &rst
  ixpk= 0, nxpk= 0, iat= 972,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2=1018,1019,1020,
 &end
#
#  62  VAL   HA   68 HIS   HE1  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 972,1077, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  62  VAL   HA   68 HIS   HE2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 972,1079, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  62  VAL   HB   63  CYS   HN  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 974, 986, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  62  VAL   HB   68 HIS   HE1  1.80 4.92
 &rst
  ixpk= 0, nxpk= 0, iat= 974,1077, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  62  VAL   HN   62  VAL   HB  1.80 3.56
 &rst
  ixpk= 0, nxpk= 0, iat= 970, 974, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  62  VAL   HN   62  VAL  QG1  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 970,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 976, 977, 978,
 &end
#
#  62  VAL   HN   62  VAL  QG2  1.80 2.88
 &rst
  ixpk= 0, nxpk= 0, iat= 970,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr2= 980, 981, 982,
 &end
#
#  62  VAL  QG1   63  CYS   HN  1.80 4.49
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 986, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   65  ILE   HB  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   68 HIS   HD2  1.80 4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1081, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   68 HIS   HE1  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   68 HIS   HE2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1079, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   77  CYS  HB2  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1221, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG1   77  CYS  HB3  1.80 4.04
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1222, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 976, 977, 978,
 &end
#
#  62  VAL  QG2   63  CYS   HN  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 986, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 980, 981, 982,
 &end
#
#  62  VAL  QG2   68 HIS   HE1  1.80 4.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 980, 981, 982,
 &end
#
#  63  CYS   HA   65  ILE   HB  1.80 4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 988,1016, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#  63  CYS   HA   66 HIS    HN  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat= 988,1031, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#  63  CYS   HA   77  CYS  HB2  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 988,1221, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  63  CYS   HA   77  CYS  HB3  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 988,1222, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  63  CYS  HB2   64 GLU-   HN  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 990, 997, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  63  CYS  HB3   64 GLU-   HN  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 991, 997, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  63  CYS   HN   63  CYS  HB2  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 986, 990, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  63  CYS   HN   63  CYS  HB3  1.80 3.74
 &rst
  ixpk= 0, nxpk= 0, iat= 986, 991, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  63  CYS   HN   63  CYS   QB  1.80 3.16
 &rst
  ixpk= 0, nxpk= 0, iat= 986,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 990, 991,
 &end
#
#  63  CYS   HN   64 GLU-   HN  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 986, 997, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  63  CYS   HN   65  ILE   HN  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 986,1012, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  63  CYS   QB   64 GLU-   HN  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 990, 991,
 &end
#
#  64 GLU-   HA   64 GLU-  HG2  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 999,1004, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  64 GLU-   HA   64 GLU-  HG3  1.80 4.12
 &rst
  ixpk= 0, nxpk= 0, iat= 999,1005, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  64 GLU-   HA   64 GLU-   QG  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 999,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr2=1004,1005,
 &end
#
#  64 GLU-   HN   64 GLU-  HG2  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 997,1004, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#  64 GLU-   HN   64 GLU-  HG3  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 997,1005, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#  64 GLU-   HN   64 GLU-   QB  1.80 2.94
 &rst
  ixpk= 0, nxpk= 0, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2=1001,1002,
 &end
#
#  64 GLU-   HN   64 GLU-   QG  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat= 997,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1004,1005,
 &end
#
#  64 GLU-   HN   65  ILE   HN  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat= 997,1012, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#  64 GLU-   QB   65  ILE   HN  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1012, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1=1001,1002,
 &end
#
#  65  ILE   HA   65  ILE  QD1  1.80 3.88
 &rst
  ixpk= 0, nxpk= 0, iat=1014,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2=1025,1026,1027,
 &end
#
#  65  ILE   HA   65  ILE  QG1  1.80 3.21
 &rst
  ixpk= 0, nxpk= 0, iat=1014,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1022,1023,
 &end
#
#  65  ILE   HA   65  ILE  QG2  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat=1014,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2=1018,1019,1020,
 &end
#
#  65  ILE   HB   65  ILE  QD1  1.80 2.96
 &rst
  ixpk= 0, nxpk= 0, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2=1025,1026,1027,
 &end
#
#  65  ILE   HB   66 HIS    HA  1.80 5.45
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1033, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#  65  ILE   HB   66 HIS    HN  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1031, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#  65  ILE   HB   67  PHE   HN  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1048, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  65  ILE   HB   68 HIS   HD2  1.80 4.08
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1081, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  65  ILE   HB   68 HIS   HE1  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1077, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  65  ILE   HB   68 HIS   HE2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1016,1079, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  65  ILE   HN   65  ILE   HB  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat=1012,1016, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  65  ILE   HN   65  ILE HG12  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1012,1022, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  65  ILE   HN   65  ILE HG13  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1012,1023, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  65  ILE   HN   65  ILE  QD1  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1012,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1025,1026,1027,
 &end
#
#  65  ILE   HN   65  ILE  QG1  1.80 3.15
 &rst
  ixpk= 0, nxpk= 0, iat=1012,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2=1022,1023,
 &end
#
#  65  ILE   HN   65  ILE  QG2  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1012,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2=1018,1019,1020,
 &end
#
#  65  ILE   HN   66 HIS    HN  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=1012,1031, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#  65  ILE  QD1   68 HIS   HE1  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr1=1025,1026,1027,
 &end
#
#  65  ILE  QG1   68 HIS   HE1  1.80 5.17
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1=1022,1023,
 &end
#
#  65  ILE  QG2   66 HIS    HN  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=1018,1019,1020,
 &end
#
#  65  ILE  QG2   67  PHE   HN  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1048, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=1018,1019,1020,
 &end
#
#  65  ILE  QG2   68 HIS   HD2  1.80 4.86
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1081, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=1018,1019,1020,
 &end
#
#  65  ILE  QG2   68 HIS   HE1  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1=1018,1019,1020,
 &end
#
#  66 HIS    HA   77  CYS   HN  1.80 4.69
 &rst
  ixpk= 0, nxpk= 0, iat=1033,1217, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  66 HIS   HB2   67  PHE   HN  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1035,1048, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  66 HIS   HB3   67  PHE   HN  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1036,1048, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  66 HIS   HD2   76 GLU-  HG2  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=1044,1209, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  66 HIS   HD2   76 GLU-  HG3  1.80 4.03
 &rst
  ixpk= 0, nxpk= 0, iat=1044,1210, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  66 HIS   HD2   76 GLU-   QB  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr2=1206,1207,
 &end
#
#  66 HIS   HD2   76 GLU-   QG  1.80 3.48
 &rst
  ixpk= 0, nxpk= 0, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr2=1209,1210,
 &end
#
#  66 HIS   HD2   76  GLU   QG  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1209,1210,
 &end
#
#  66 HIS   HD2   77  CYS   HN  1.80 3.97
 &rst
  ixpk= 0, nxpk= 0, iat=1044,1217, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#  66 HIS    HN   68 HIS   HE1  1.80 5.09
 &rst
  ixpk= 0, nxpk= 0, iat=1031,1077, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
#  66 HIS    HN   68 HIS   HE2  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1031,1079, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  66 HIS    QB   67  PHE   HN  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1048, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1035,1036,
 &end
#
#  67  PHE   HA   67  PHE   QD  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat=1050,  -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
 igr2=1056,1064,
 &end
#
#  67  PHE   HA   68 HIS   HD2  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat=1050,1081, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  67  PHE   HA   68 HIS    HN  1.80 3.12
 &rst
  ixpk= 0, nxpk= 0, iat=1050,1068, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  67  PHE  HB2   74  MET   QE  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1180,1181,1182,
 &end
#
#  67  PHE  HB3   74  MET   QE  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1053,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1180,1181,1182,
 &end
#
#  67  PHE   HN   67  PHE  HB2  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1048,1052, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  67  PHE   HN   67  PHE  HB3  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1048,1053, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  67  PHE   HN   67  PHE   QB  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=1048,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2=1052,1053,
 &end
#
#  67  PHE   HN   67  PHE   QD  1.80 4.18
 &rst
  ixpk= 0, nxpk= 0, iat=1048,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr2=1056,1064,
 &end
#
#  67  PHE   QB   68 HIS    HN  1.80 4.29
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1068, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1=1052,1053,
 &end
#
#  67  PHE   QB   74  MET   QE  1.80 3.11
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1=1052,1053,
 igr2=1180,1181,1182,
 &end
#
#  67  PHE   QB   74  MET   QG  1.80 4.47
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1=1052,1053,
 igr2=1176,1177,
 &end
#
#  67  PHE   QD   68 HIS    HN  1.80 4.80
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1068, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1056,1064,
 &end
#
#  67  PHE   QD   74  MET   QB  1.80 4.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1056,1064,
 igr2=1173,1174,
 &end
#
#  67  PHE   QD   74  MET   QE  1.80 4.56
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1=1056,1064,
 igr2=1180,1181,1182,
 &end
#
#  67  PHE   QD   74  MET   QG  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1=1056,1064,
 igr2=1176,1177,
 &end
#
#  67  PHE   QE   76  GLU   QB  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1058,1062,
 igr2=1206,1207,
 &end
#
#  68 HIS    HA   69 GLU-   HN  1.80 3.06
 &rst
  ixpk= 0, nxpk= 0, iat=1070,1085, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,  &end
#
#  68 HIS   HB2   69 GLU-   HN  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=1072,1085, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  68 HIS   HB2   75  VAL  QG2  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat=1072,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1196,1197,1198,
 &end
#
#  68 HIS   HB3   69 GLU-   HN  1.80 4.33
 &rst
  ixpk= 0, nxpk= 0, iat=1073,1085, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  68 HIS   HB3   75  VAL  QG2  1.80 4.00
 &rst
  ixpk= 0, nxpk= 0, iat=1073,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1196,1197,1198,
 &end
#
#  68 HIS   HD2   75  VAL  QG2  1.80 4.62
 &rst
  ixpk= 0, nxpk= 0, iat=1081,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2=1196,1197,1198,
 &end
#
#  68 HIS   HD2   77  CYS   HN  1.80 4.11
 &rst
  ixpk= 0, nxpk= 0, iat=1081,1217, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  68 HIS   HD2   77  CYS   QB  1.80 3.91
 &rst
  ixpk= 0, nxpk= 0, iat=1081,  -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
 igr2=1221,1222,
 &end
#
#  68 HIS    HN   68 HIS   HD2  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=1068,1081, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  68 HIS    HN   69  GLU   HN  2.70 100.00
 &rst
  ixpk= 0, nxpk= 0, iat=1068,1085, r1= 2.20, r2= 2.70, r3=100.00, r4=100.50,  &end
#
#  68 HIS    HN   74  MET   QE  1.80 4.55
 &rst
  ixpk= 0, nxpk= 0, iat=1068,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr2=1180,1181,1182,
 &end
#
#  68 HIS    HN   75  VAL   HN  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=1068,1186, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  68 HIS    HN   75  VAL  QG2  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=1068,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2=1196,1197,1198,
 &end
#
#  68 HIS    QB   69 GLU-   HN  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1085, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1=1072,1073,
 &end
#
#  68 HIS    QB   75  VAL  QG2  1.80 3.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1=1072,1073,
 igr2=1196,1197,1198,
 &end
#
#  69 GLU-  HG2   72  ASN   HA  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=1092,1135, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  69 GLU-  HG3   72  ASN   HA  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=1093,1135, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  69 GLU-   HN   69 GLU-   QG  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat=1085,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2=1092,1093,
 &end
#
#  69 GLU-   HN   74  MET   QE  1.80 4.58
 &rst
  ixpk= 0, nxpk= 0, iat=1085,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2=1180,1181,1182,
 &end
#
#  69 GLU-   QG   70  ILE   HN  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1100, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr1=1092,1093,
 &end
#
#  69 GLU-   QG   72  ASN   HA  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1=1092,1093,
 &end
#
#  69 GLU-   QG   72  ASN   HN  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1=1092,1093,
 &end
#
#  70  ILE   HA   70  ILE HG12  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1110, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  70  ILE   HA   70  ILE HG13  1.80 3.93
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1111, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  70  ILE   HA   70  ILE  QD1  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=1102,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2=1113,1114,1115,
 &end
#
#  70  ILE   HA   70  ILE  QG1  1.80 3.38
 &rst
  ixpk= 0, nxpk= 0, iat=1102,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2=1110,1111,
 &end
#
#  70  ILE   HA   70  ILE  QG2  1.80 3.16
 &rst
  ixpk= 0, nxpk= 0, iat=1102,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2=1106,1107,1108,
 &end
#
#  70  ILE   HA   71  ASN   HA  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1121, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  70  ILE   HA   71  ASN   HN  1.80 3.08
 &rst
  ixpk= 0, nxpk= 0, iat=1102,1119, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#  70  ILE   HB   70  ILE  QD1  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=1104,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2=1113,1114,1115,
 &end
#
#  70  ILE   HB   75  VAL  QG2  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=1104,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2=1196,1197,1198,
 &end
#
#  70  ILE   HN   70  ILE   HB  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1104, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  70  ILE   HN   70  ILE HG12  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1110, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  70  ILE   HN   70  ILE HG13  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1111, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  70  ILE   HN   70  ILE  QG1  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=1110,1111,
 &end
#
#  70  ILE   HN   70  ILE  QG2  1.80 4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1106,1107,1108,
 &end
#
#  70  ILE   HN   73 LYS+   HN  1.80 3.66
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1147, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#  70  ILE   HN   73 LYS+   QB  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1151,1152,
 &end
#
#  70  ILE   HN   74  MET   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1169, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  70  ILE   HN   75  VAL  QG1  1.80 4.06
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1192,1193,1194,
 &end
#
#  70  ILE   HN   75  VAL  QG2  1.80 5.17
 &rst
  ixpk= 0, nxpk= 0, iat=1100,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2=1196,1197,1198,
 &end
#
#  70  ILE  QD1   75  VAL  QG2  1.80 3.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=1113,1114,1115,
 igr2=1196,1197,1198,
 &end
#
#  70  ILE  QG1   75  VAL  QG2  1.80 4.40
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1=1110,1111,
 igr2=1196,1197,1198,
 &end
#
#  70  ILE  QG2   70  ILE  QD1  1.80 2.85
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=1106,1107,1108,
 igr2=1113,1114,1115,
 &end
#
#  70  ILE  QG2   70  ILE  QG1  1.80 3.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,
 igr1=1106,1107,1108,
 igr2=1110,1111,
 &end
#
#  70  ILE  QG2   71  ASN   HA  1.80 4.13
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1121, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   71  ASN  HB2  1.80 3.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   71  ASN HD21  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1128, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   71  ASN HD22  1.80 4.51
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   71  ASN   HN  1.80 3.44
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1=1106,1107,1108,
 &end
#
#  70  ILE  QG2   72  ASN   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1106,1107,1108,
 &end
#
#  71  ASN   HA   71  ASN HD21  1.80 4.81
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1128, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  71  ASN   HA   72  ASN   HN  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=1121,1133, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#  71  ASN   HN   72  ASN   HN  1.80 3.60
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1133, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  71  ASN   HN   73 LYS+   HN  1.80 4.99
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1147, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#  72  ASN   HN   72  ASN   QB  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2=1137,1138,
 &end
#
#  72  ASN   HN   73 LYS+   HN  1.80 3.56
 &rst
  ixpk= 0, nxpk= 0, iat=1133,1147, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  72  ASN   HN   73 LYS+   QB  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1151,1152,
 &end
#
#  73 LYS+   HA   74  MET   HN  1.80 3.01
 &rst
  ixpk= 0, nxpk= 0, iat=1149,1169, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,  &end
#
#  73 LYS+  HD2   74  MET   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=1157,1169, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  73 LYS+  HD3   74  MET   HN  1.80 4.59
 &rst
  ixpk= 0, nxpk= 0, iat=1158,1169, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  73 LYS+   HN   73 LYS+  HB2  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=1147,1151, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  73 LYS+   HN   73 LYS+  HB3  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=1147,1152, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  73 LYS+   HN   73 LYS+   QB  1.80 3.39
 &rst
  ixpk= 0, nxpk= 0, iat=1147,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2=1151,1152,
 &end
#
#  73 LYS+   QB   73 LYS+   QE  1.80 3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1=1151,1152,
 igr2=1160,1161,
 &end
#
#  73 LYS+   QB   74  MET   HN  1.80 4.07
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1=1151,1152,
 &end
#
#  73 LYS+   QD   74  MET   HN  1.80 3.92
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1157,1158,
 &end
#
#  73 LYS+   QG   73 LYS+  HE2  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1160, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1=1154,1155,
 &end
#
#  73 LYS+   QG   73 LYS+  HE3  1.80 4.23
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1=1154,1155,
 &end
#
#  73 LYS+   QG   74  MET   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1=1154,1155,
 &end
#
#  74  MET   HA   75  VAL   HN  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat=1171,1186, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  74  MET   HA   75  VAL  QG2  1.80 4.70
 &rst
  ixpk= 0, nxpk= 0, iat=1171,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2=1196,1197,1198,
 &end
#
#  74  MET   HN   74  MET  HB2  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1169,1173, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  74  MET   HN   74  MET  HB3  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1169,1174, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  74  MET   HN   74  MET   QB  1.80 3.33
 &rst
  ixpk= 0, nxpk= 0, iat=1169,  -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr2=1173,1174,
 &end
#
#  74  MET   HN   74  MET   QG  1.80 3.92
 &rst
  ixpk= 0, nxpk= 0, iat=1169,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2=1176,1177,
 &end
#
#  74  MET   HN   75  VAL   HA  1.80 5.28
 &rst
  ixpk= 0, nxpk= 0, iat=1169,1188, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
#  74  MET   QB   75  VAL   HN  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1=1173,1174,
 &end
#
#  74  MET   QE   75  VAL   HN  1.80 5.16
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1=1180,1181,1182,
 &end
#
#  74  MET   QG   74  MET   QE  1.80 3.17
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1=1176,1177,
 igr2=1180,1181,1182,
 &end
#
#  75  VAL   HA   75  VAL  QG1  1.80 3.87
 &rst
  ixpk= 0, nxpk= 0, iat=1188,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1192,1193,1194,
 &end
#
#  75  VAL   HA   76 GLU-   HN  1.80 3.49
 &rst
  ixpk= 0, nxpk= 0, iat=1188,1202, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  75  VAL   HB   76 GLU-   HN  1.80 3.58
 &rst
  ixpk= 0, nxpk= 0, iat=1190,1202, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#  75  VAL   HN   75  VAL   HB  1.80 4.15
 &rst
  ixpk= 0, nxpk= 0, iat=1186,1190, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  75  VAL   HN   75  VAL  QG1  1.80 3.90
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2=1192,1193,1194,
 &end
#
#  75  VAL   HN   75  VAL  QG2  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=1196,1197,1198,
 &end
#
#  75  VAL  QG1   76 GLU-   HN  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1192,1193,1194,
 &end
#
#  75  VAL  QG2   76 GLU-   HA  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1204, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=1196,1197,1198,
 &end
#
#  75  VAL  QG2   76 GLU-   HN  1.80 4.39
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr1=1196,1197,1198,
 &end
#
#  76 GLU-   HA   77  CYS   HN  1.80 3.41
 &rst
  ixpk= 0, nxpk= 0, iat=1204,1217, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#  76 GLU-  HG2   77  CYS   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=1209,1217, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  76 GLU-  HG3   77  CYS   HN  1.80 4.26
 &rst
  ixpk= 0, nxpk= 0, iat=1210,1217, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  76 GLU-   HN   76 GLU-  HB2  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1206, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  76 GLU-   HN   76 GLU-  HB3  1.80 3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1202,1207, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  76 GLU-   HN   76 GLU-   QB  1.80 3.30
 &rst
  ixpk= 0, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2=1206,1207,
 &end
#
#  77  CYS   HA   78 LYS+   HN  1.80 2.96
 &rst
  ixpk= 0, nxpk= 0, iat=1219,1228, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
#  77  CYS   HA   78 LYS+   QG  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=1219,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1235,1236,
 &end
#
#  77  CYS  HB2   78 LYS+   HN  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat=1221,1228, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  77  CYS  HB3   78 LYS+   HN  1.80 4.36
 &rst
  ixpk= 0, nxpk= 0, iat=1222,1228, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  77  CYS   HN   77  CYS  HB2  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=1217,1221, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  77  CYS   HN   77  CYS  HB3  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=1217,1222, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  77  CYS   HN   77  CYS   QB  1.80 3.63
 &rst
  ixpk= 0, nxpk= 0, iat=1217,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2=1221,1222,
 &end
#
#  77  CYS   HN   78 LYS+   HN  1.80 4.95
 &rst
  ixpk= 0, nxpk= 0, iat=1217,1228, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  77  CYS   QB   78 LYS+   HN  1.80 3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1=1221,1222,
 &end
#
#  78 LYS+   HA   79 LYS+   HN  1.80 3.26
 &rst
  ixpk= 0, nxpk= 0, iat=1230,1250, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#  78 LYS+  HG2   78 LYS+   QE  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2=1241,1242,
 &end
#
#  78 LYS+  HG3   78 LYS+   QE  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1236,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2=1241,1242,
 &end
#
#  78 LYS+   HN   78 LYS+  HG2  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=1228,1235, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  78 LYS+   HN   78 LYS+  HG3  1.80 4.42
 &rst
  ixpk= 0, nxpk= 0, iat=1228,1236, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  78 LYS+   HN   78 LYS+   QB  1.80 3.68
 &rst
  ixpk= 0, nxpk= 0, iat=1228,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2=1232,1233,
 &end
#
#  78 LYS+   HN   79 LYS+   HN  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=1228,1250, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#  78 LYS+   QB   78 LYS+   QE  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1=1232,1233,
 igr2=1241,1242,
 &end
#
#  78 LYS+   QB   79 LYS+   HN  1.80 3.77
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1250, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1=1232,1233,
 &end
#
#  78 LYS+   QG   78 LYS+   QE  1.80 3.32
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1=1235,1236,
 igr2=1241,1242,
 &end
#
#  79 LYS+   HA   79 LYS+  HG2  1.80 3.76
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1257, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  79 LYS+   HA   79 LYS+  HG3  1.80 4.02
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1258, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  79 LYS+   HA   80  ALA   HN  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1252,1272, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  79 LYS+   HA   80  ALA   QB  1.80 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=1252,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2=1276,1277,1278,
 &end
#
#  79 LYS+  HB2   80  ALA   HN  1.80 4.77
 &rst
  ixpk= 0, nxpk= 0, iat=1254,1272, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#  79 LYS+  HB3   80  ALA   HN  1.80 4.25
 &rst
  ixpk= 0, nxpk= 0, iat=1255,1272, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  79 LYS+  HG2   79 LYS+   QE  1.80 3.89
 &rst
  ixpk= 0, nxpk= 0, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2=1263,1264,
 &end
#
#  79 LYS+  HG3   79 LYS+   QE  1.80 2.94
 &rst
  ixpk= 0, nxpk= 0, iat=1258,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2=1263,1264,
 &end
#
#  79 LYS+  HG3   80  ALA   HN  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1258,1272, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  79 LYS+   HN   79 LYS+  HB2  1.80 3.03
 &rst
  ixpk= 0, nxpk= 0, iat=1250,1254, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
#  79 LYS+   HN   79 LYS+  HB3  1.80 3.86
 &rst
  ixpk= 0, nxpk= 0, iat=1250,1255, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  79 LYS+   HN   79 LYS+  HG2  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=1250,1257, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#  79 LYS+   HN   79 LYS+  HG3  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=1250,1258, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  80  ALA   HA   81  GLN   HN  1.80 3.24
 &rst
  ixpk= 0, nxpk= 0, iat=1274,1282, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#  80  ALA   HN   80  ALA   QB  1.80 3.07
 &rst
  ixpk= 0, nxpk= 0, iat=1272,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2=1276,1277,1278,
 &end
#
#  80  ALA   QB   81  GLN   HN  1.80 3.65
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1282, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1=1276,1277,1278,
 &end
#
#  81  GLN   HA   82  PRO  HD2  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1300, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#  81  GLN   HA   82  PRO  HD3  1.80 3.79
 &rst
  ixpk= 0, nxpk= 0, iat=1284,1301, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#  81  GLN   HN   81  GLN   QG  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=1282,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2=1289,1290,
 &end
#
#  81  GLN   QB   82  PRO   QD  1.80 4.24
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=1286,1287,
 igr2=1300,1301,
 &end
#
#  81  GLN   QG   82  PRO  HD2  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1300, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1=1289,1290,
 &end
#
#  81  GLN   QG   82  PRO  HD3  1.80 4.43
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1301, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1=1289,1290,
 &end
#
#  81  GLN   QG   82  PRO   QD  1.80 3.84
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=1289,1290,
 igr2=1300,1301,
 &end
#
#  82  PRO  HB2   83 LYS+   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=1306,1313, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  82  PRO  HB3   83 LYS+   HN  1.80 4.53
 &rst
  ixpk= 0, nxpk= 0, iat=1307,1313, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  82  PRO  HD2   85  VAL  QG1  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=1300,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1356,1357,1358,
 &end
#
#  82  PRO  HD2   85  VAL  QG2  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=1300,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1360,1361,1362,
 &end
#
#  82  PRO  HD3   85  VAL  QG1  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=1301,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1356,1357,1358,
 &end
#
#  82  PRO  HD3   85  VAL  QG2  1.80 4.97
 &rst
  ixpk= 0, nxpk= 0, iat=1301,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1360,1361,1362,
 &end
#
#  82  PRO   QB   83 LYS+   HN  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1313, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1=1306,1307,
 &end
#
#  82  PRO   QB   85  VAL  QQG  1.80 4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
 igr1=1306,1307,
 igr2=1356,1357,1358,1360,1361,1362,
 &end
#
#  82  PRO   QD   85  VAL  QQG  1.80 3.37
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1=1300,1301,
 igr2=1356,1357,1358,1360,1361,1362,
 &end
#
#  82  PRO   QG   85  VAL   HN  1.80 5.05
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1303,1304,
 &end
#
#  82  PRO   QG   85  VAL  QQG  1.80 3.19
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1=1303,1304,
 igr2=1356,1357,1358,1360,1361,1362,
 &end
#
#  83 LYS+   HA   83 LYS+   QG  1.80 3.62
 &rst
  ixpk= 0, nxpk= 0, iat=1315,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2=1320,1321,
 &end
#
#  83 LYS+   HA   84 GLU-   HN  1.80 3.29
 &rst
  ixpk= 0, nxpk= 0, iat=1315,1335, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#  83 LYS+   HN   83 LYS+   QB  1.80 3.36
 &rst
  ixpk= 0, nxpk= 0, iat=1313,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1317,1318,
 &end
#
#  83 LYS+   HN   83 LYS+   QG  1.80 3.82
 &rst
  ixpk= 0, nxpk= 0, iat=1313,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2=1320,1321,
 &end
#
#  83 LYS+   HN   84 GLU-   HN  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=1313,1335, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  83 LYS+   QB   84 GLU-   HN  1.80 4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1=1317,1318,
 &end
#
#  83 LYS+   QG   83 LYS+   QE  1.80 3.59
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1=1320,1321,
 igr2=1326,1327,
 &end
#
#  83 LYS+   QG   84 GLU-   HN  1.80 4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1=1320,1321,
 &end
#
#  84 GLU-   HA   84 GLU-   QG  1.80 3.52
 &rst
  ixpk= 0, nxpk= 0, iat=1337,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2=1342,1343,
 &end
#
#  84 GLU-   HA   85  VAL   HN  1.80 3.54
 &rst
  ixpk= 0, nxpk= 0, iat=1337,1350, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  84 GLU-   HA   86  MET   HN  1.80 5.04
 &rst
  ixpk= 0, nxpk= 0, iat=1337,1366, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#  84 GLU-   HN   84 GLU-  HB2  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=1335,1339, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  84 GLU-   HN   84 GLU-  HB3  1.80 3.70
 &rst
  ixpk= 0, nxpk= 0, iat=1335,1340, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  84 GLU-   HN   84 GLU-   QB  1.80 3.18
 &rst
  ixpk= 0, nxpk= 0, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2=1339,1340,
 &end
#
#  84 GLU-   HN   84 GLU-   QG  1.80 4.14
 &rst
  ixpk= 0, nxpk= 0, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1342,1343,
 &end
#
#  84 GLU-   HN   85  VAL   HN  1.80 3.96
 &rst
  ixpk= 0, nxpk= 0, iat=1335,1350, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  85  VAL   HA   85  VAL  QG1  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2=1356,1357,1358,
 &end
#
#  85  VAL   HA   85  VAL  QG2  1.80 3.25
 &rst
  ixpk= 0, nxpk= 0, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2=1360,1361,1362,
 &end
#
#  85  VAL   HA   86  MET   HN  1.80 3.56
 &rst
  ixpk= 0, nxpk= 0, iat=1352,1366, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  85  VAL   HN   85  VAL   HB  1.80 3.85
 &rst
  ixpk= 0, nxpk= 0, iat=1350,1354, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#  85  VAL   HN   85  VAL  QG1  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2=1356,1357,1358,
 &end
#
#  85  VAL   HN   85  VAL  QG2  1.80 4.28
 &rst
  ixpk= 0, nxpk= 0, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2=1360,1361,1362,
 &end
#
#  85  VAL   HN   85  VAL  QQG  1.80 3.31
 &rst
  ixpk= 0, nxpk= 0, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=1356,1357,1358,1360,1361,1362,
 &end
#
#  85  VAL   HN   86  MET   HN  1.80 3.42
 &rst
  ixpk= 0, nxpk= 0, iat=1350,1366, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#  85  VAL   HN   86  MET   QB  1.80 5.34
 &rst
  ixpk= 0, nxpk= 0, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1370,1371,
 &end
#
#  85  VAL  QG1   86  MET   HN  1.80 4.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1366, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1=1356,1357,1358,
 &end
#
#  85  VAL  QG2   86  MET   HN  1.80 4.88
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1366, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1=1360,1361,1362,
 &end
#
#  85  VAL  QQG   86  MET   HN  1.80 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1366, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1=1356,1357,1358,1360,1361,1362,
 &end
#
#  85  VAL  QQG   86  MET   QB  1.80 5.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
 igr1=1356,1357,1358,1360,1361,1362,
 igr2=1370,1371,
 &end
#
#  85  VAL  QQG   86  MET   QG  1.80 3.72
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1=1356,1357,1358,1360,1361,1362,
 igr2=1373,1374,
 &end
#
#  86  MET   HA   86  MET   QE  1.80 4.17
 &rst
  ixpk= 0, nxpk= 0, iat=1368,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2=1377,1378,1379,
 &end
#
#  86  MET   HA   87  SER   HN  1.80 3.53
 &rst
  ixpk= 0, nxpk= 0, iat=1368,1383, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#  86  MET   HN   86  MET  HB2  1.80 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=1366,1370, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  86  MET   HN   86  MET  HB3  1.80 4.16
 &rst
  ixpk= 0, nxpk= 0, iat=1366,1371, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  86  MET   HN   86  MET   QB  1.80 3.51
 &rst
  ixpk= 0, nxpk= 0, iat=1366,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2=1370,1371,
 &end
#
#  86  MET   HN   86  MET   QG  1.80 3.83
 &rst
  ixpk= 0, nxpk= 0, iat=1366,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2=1373,1374,
 &end
#
#  86  MET   HN   87  SER   HA  1.80 5.15
 &rst
  ixpk= 0, nxpk= 0, iat=1366,1385, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
#  86  MET   HN   87  SER   HN  1.80 4.01
 &rst
  ixpk= 0, nxpk= 0, iat=1366,1383, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  87  SER   HA   88  PRO   QD  1.80 3.55
 &rst
  ixpk= 0, nxpk= 0, iat=1385,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2=1395,1396,
 &end
#
#  87  SER   HN   87  SER   QB  1.80 3.94
 &rst
  ixpk= 0, nxpk= 0, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1387,1388,
 &end
#
#  97   G   H8   14  VAL  QG1  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 205, 206, 207,
 &end
#
#  97   G   H8   14  VAL  QG2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1528,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 209, 210, 211,
 &end
#
#  97   G   H8   97   G  H1'  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1528,1525, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  98   U  H1'    8  PHE   QD  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1559,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 127, 135,
 &end
#
#  98   U  H1'   98   U  H2'  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=1559,1574, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  98   U   H6   10  GLY   QA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1562,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 157, 158,
 &end
#
#  98   U   H6   11  GLY   QA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1562,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 164, 165,
 &end
#
#  98   U   H6   98   U  H1'  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1562,1559, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  99   A  H1'   99   A  H2'  1.80 3.80
 &rst
  ixpk= 0, nxpk= 0, iat=1589,1607, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  99   A   H2  100   G   Q2  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1634,1635,
 &end
#
#  99   A   H2   50  PHE   QD  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 783, 791,
 &end
#
#  99   A   H2   50  PHE   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 785, 789,
 &end
#
#  99   A   H2   80  ALA   HA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1274, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  99   A   H2   80  ALA   QB  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1276,1277,1278,
 &end
#
#  99   A   H2   81  GLN   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1601,1282, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  99   A   H8   99   A  H1'  1.80 5.50
 &rst
  ixpk= 0, nxpk= 0, iat=1592,1589, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 100   G  H1'  100   G  H2'  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1622,1641, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 100   G  H1'   35  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1622,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 538, 539, 540,
 &end
#
# 100   G  H1'   37  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1622,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 574, 575, 576,
 &end
#
# 100   G   H8  100   G  H1'  1.80 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,1622, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 100   G   H8   35  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 538, 539, 540,
 &end
#
# 100   G   H8   35  MET   QG  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 534, 535,
 &end
#
# 100   G   H8   37  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 574, 575, 576,
 &end
#
# 100   G   H8   50  PHE   QD  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 783, 791,
 &end
#
# 100   G   H8   50  PHE   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1625,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 785, 789,
 &end
#
# 100   G   Q2   81  GLN   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1282, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1634,1635,
 &end
#
# 100   G   Q2   83  LYS   HA  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1315, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1634,1635,
 &end
#
# 100   G   Q2   83  LYS   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1313, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1634,1635,
 &end
#
# 100   G   Q2   84  GLU   HN  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1634,1635,
 &end
#
# 100   G   Q2   86  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1634,1635,
 igr2=1377,1378,1379,
 &end
#
# 100   G   Q2   86  MET   QG  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1634,1635,
 igr2=1373,1374,
 &end
#
# 100   G   Q2    8  PHE   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1634,1635,
 igr2= 129, 133,
 &end
#
# 101   U   H6   35  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1659,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 538, 539, 540,
 &end
#
# 101   U   H6   37  MET   QE  1.80 5.00
 &rst
  ixpk= 0, nxpk= 0, iat=1659,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 574, 575, 576,
 &end
# 1675 atoms read from pdb file leap.pdb.
# 7 ILE CHI1:  (7 ILE N)-(7 ILE CA)-(7 ILE CB)-(7 ILE CG1)  40.0  80.0
 &rst     iat =    99,   101,   103,   109,
	  r1 =  39.0, r2 =  40.0, r3 =  80.0, r4 =  81.0,
	  rk2 = 60.0, rk3 = 60.0,				&end
# 8 PHE CHI1:  (8 PHE N)-(8 PHE CA)-(8 PHE CB)-(8 PHE CG) 160.0 200.0
 &rst     iat =   118,   120,   122,   125,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 9 VAL CHI1:  (9 VAL N)-(9 VAL CA)-(9 VAL CB)-(9 VAL CG1) 160.0 200.0
 &rst     iat =   138,   140,   142,   144,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 12 LEU CHI1:  (12 LEU N)-(12 LEU CA)-(12 LEU CB)-(12 LEU CG) -80.0 -40.0
 &rst     iat =   168,   170,   172,   175,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 12 LEU CHI2:  (12 LEU CA)-(12 LEU CB)-(12 LEU CG)-(12 LEU CD1) 160.0 200.0
 &rst     iat =   170,   172,   175,   177,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 21 VAL CHI1:  (21 VAL N)-(21 VAL CA)-(21 VAL CB)-(21 VAL CG1) 160.0 200.0
 &rst     iat =   299,   301,   303,   305,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 25 PHE CHI1:  (25 PHE N)-(25 PHE CA)-(25 PHE CB)-(25 PHE CG) -80.0 -40.0
 &rst     iat =   375,   377,   379,   382,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 31 VAL CHI1:  (31 VAL N)-(31 VAL CA)-(31 VAL CB)-(31 VAL CG1) 160.0 200.0
 &rst     iat =   476,   478,   480,   482,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 36 LEU CHI1:  (36 LEU N)-(36 LEU CA)-(36 LEU CB)-(36 LEU CG) -80.0 -40.0
 &rst     iat =   543,   545,   547,   550,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 36 LEU CHI2:  (36 LEU CA)-(36 LEU CB)-(36 LEU CG)-(36 LEU CD1) 160.0 200.0
 &rst     iat =   545,   547,   550,   552,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 38 PHE CHI1:  (38 PHE N)-(38 PHE CA)-(38 PHE CB)-(38 PHE CG) -80.0 -40.0
 &rst     iat =   579,   581,   583,   586,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 48 PHE CHI1:  (48 PHE N)-(48 PHE CA)-(48 PHE CB)-(48 PHE CG)  40.0  80.0
 &rst     iat =   747,   749,   751,   754,
	  r1 =  39.0, r2 =  40.0, r3 =  80.0, r4 =  81.0,
	&end
# 51 VAL CHI1:  (51 VAL N)-(51 VAL CA)-(51 VAL CB)-(51 VAL CG1) 160.0 200.0
 &rst     iat =   794,   796,   798,   800,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 58 ILE CHI1:  (58 ILE N)-(58 ILE CA)-(58 ILE CB)-(58 ILE CG1) -80.0 -40.0
 &rst     iat =   897,   899,   901,   907,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 59 VAL CHI1:  (59 VAL N)-(59 VAL CA)-(59 VAL CB)-(59 VAL CG1) 160.0 200.0
 &rst     iat =   916,   918,   920,   922,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 62 VAL CHI1:  (62 VAL N)-(62 VAL CA)-(62 VAL CB)-(62 VAL CG1) 160.0 200.0
 &rst     iat =   969,   971,   973,   975,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 70 ILE CHI1:  (70 ILE N)-(70 ILE CA)-(70 ILE CB)-(70 ILE CG1) -80.0 -40.0
 &rst     iat =  1099,  1101,  1103,  1109,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 70 ILE CHI21:  (70 ILE CA)-(70 ILE CB)-(70 ILE CG1)-(70 ILE CD1) 160.0 200.0
 &rst     iat =  1101,  1103,  1109,  1112,
	  r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
	&end
# 75 VAL CHI1:  (75 VAL N)-(75 VAL CA)-(75 VAL CB)-(75 VAL CG1) -80.0 -40.0
 &rst     iat =  1185,  1187,  1189,  1191,
	  r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
	&end
# 97 RG NU0:  (97 G5 C4')-(97 G5 O4')-(97 G5 C1')-(97 G5 C2') -37.3  -7.3
 &rst     iat =  1521,  1523,  1524,  1543,
	  r1 = -38.3, r2 = -37.3, r3 =  -7.3, r4 =  -6.3,
	&end
# 97 RG NU1:  (97 G5 O4')-(97 G5 C1')-(97 G5 C2')-(97 G5 C3')  19.8  49.8
 &rst     iat =  1523,  1524,  1543,  1541,
	  r1 =  18.8, r2 =  19.8, r3 =  49.8, r4 =  50.8,
	&end
# 97 RG NU2:  (97 G5 C1')-(97 G5 C2')-(97 G5 C3')-(97 G5 C4') -49.0 -19.0
 &rst     iat =  1524,  1543,  1541,  1521,
	  r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0,
	&end
# 97 RG NU3:  (97 G5 C2')-(97 G5 C3')-(97 G5 C4')-(97 G5 O4')   5.2  35.2
 &rst     iat =  1543,  1541,  1521,  1523,
	  r1 =   4.2, r2 =   5.2, r3 =  35.2, r4 =  36.2,
	&end
# 97 RG NU4:  (97 G5 C3')-(97 G5 C4')-(97 G5 O4')-(97 G5 C1') -13.7  16.3
 &rst     iat =  1541,  1521,  1523,  1524,
	  r1 = -14.7, r2 = -13.7, r3 =  16.3, r4 =  17.3,
	&end
# 98 RU CHI:  (98 U O4')-(98 U C1')-(98 U N1)-(98 U C2) 120.0 300.0
 &rst     iat =  1557,  1558,  1560,  1569,
	  r1 = 119.0, r2 = 120.0, r3 = 300.0, r4 = 301.0,
	&end
# 98 RU NU0:  (98 U C4')-(98 U O4')-(98 U C1')-(98 U C2') -37.3  -7.3
 &rst     iat =  1555,  1557,  1558,  1573,
	  r1 = -38.3, r2 = -37.3, r3 =  -7.3, r4 =  -6.3,
	&end
# 98 RU NU1:  (98 U O4')-(98 U C1')-(98 U C2')-(98 U C3')  19.8  49.8
 &rst     iat =  1557,  1558,  1573,  1571,
	  r1 =  18.8, r2 =  19.8, r3 =  49.8, r4 =  50.8,
	&end
# 98 RU NU2:  (98 U C1')-(98 U C2')-(98 U C3')-(98 U C4') -49.0 -19.0
 &rst     iat =  1558,  1573,  1571,  1555,
	  r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0,
	&end
# 98 RU NU3:  (98 U C2')-(98 U C3')-(98 U C4')-(98 U O4')   5.2  35.2
 &rst     iat =  1573,  1571,  1555,  1557,
	  r1 =   4.2, r2 =   5.2, r3 =  35.2, r4 =  36.2,
	&end
# 98 RU NU4:  (98 U C3')-(98 U C4')-(98 U O4')-(98 U C1') -13.7  16.3
 &rst     iat =  1571,  1555,  1557,  1558,
	  r1 = -14.7, r2 = -13.7, r3 =  16.3, r4 =  17.3,
	&end
# 99 RA CHI:  (99 A O4')-(99 A C1')-(99 A N9)-(99 A C4) 120.0 300.0
 &rst     iat =  1587,  1588,  1590,  1603,
	  r1 = 119.0, r2 = 120.0, r3 = 300.0, r4 = 301.0,
	&end
# 100 RG CHI:  (100 G O4')-(100 G C1')-(100 G N9)-(100 G C4) -30.0  90.0
 &rst     iat =  1620,  1621,  1623,  1637,
	  r1 = -31.0, r2 = -30.0, r3 =  90.0, r4 =  91.0,
	&end
# 100 RG NU0:  (100 G C4')-(100 G O4')-(100 G C1')-(100 G C2') -37.3  -7.3
 &rst     iat =  1618,  1620,  1621,  1640,
	  r1 = -38.3, r2 = -37.3, r3 =  -7.3, r4 =  -6.3,
	&end
# 100 RG NU1:  (100 G O4')-(100 G C1')-(100 G C2')-(100 G C3')  19.8  49.8
 &rst     iat =  1620,  1621,  1640,  1638,
	  r1 =  18.8, r2 =  19.8, r3 =  49.8, r4 =  50.8,
	&end
# 100 RG NU2:  (100 G C1')-(100 G C2')-(100 G C3')-(100 G C4') -49.0 -19.0
 &rst     iat =  1621,  1640,  1638,  1618,
	  r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0,
	&end
# 100 RG NU3:  (100 G C2')-(100 G C3')-(100 G C4')-(100 G O4')   5.2  35.2
 &rst     iat =  1640,  1638,  1618,  1620,
	  r1 =   4.2, r2 =   5.2, r3 =  35.2, r4 =  36.2,
	&end
# 100 RG NU4:  (100 G C3')-(100 G C4')-(100 G O4')-(100 G C1') -13.7  16.3
 &rst     iat =  1638,  1618,  1620,  1621,
	  r1 = -14.7, r2 = -13.7, r3 =  16.3, r4 =  17.3,
	&end
# 101 RU NU0:  (101 U3 C4')-(101 U3 O4')-(101 U3 C1')-(101 U3 C2') -37.3  -7.3
 &rst     iat =  1652,  1654,  1655,  1670,
	  r1 = -38.3, r2 = -37.3, r3 =  -7.3, r4 =  -6.3,
	&end
# 101 RU NU1:  (101 U3 O4')-(101 U3 C1')-(101 U3 C2')-(101 U3 C3')  19.8  49.8
 &rst     iat =  1654,  1655,  1670,  1668,
	  r1 =  18.8, r2 =  19.8, r3 =  49.8, r4 =  50.8,
	&end
# 101 RU NU2:  (101 U3 C1')-(101 U3 C2')-(101 U3 C3')-(101 U3 C4') -49.0 -19.0
 &rst     iat =  1655,  1670,  1668,  1652,
	  r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0,
	&end
# 101 RU NU3:  (101 U3 C2')-(101 U3 C3')-(101 U3 C4')-(101 U3 O4')   5.2  35.2
 &rst     iat =  1670,  1668,  1652,  1654,
	  r1 =   4.2, r2 =   5.2, r3 =  35.2, r4 =  36.2,
	&end
# 101 RU NU4:  (101 U3 C3')-(101 U3 C4')-(101 U3 O4')-(101 U3 C1') -13.7  16.3
 &rst     iat =  1668,  1652,  1654,  1655,
	  r1 = -14.7, r2 = -13.7, r3 =  16.3, r4 =  17.3,
	&end
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY 105          1H        GLY 105   0.712  15.125   6.271
    2    H2   GLY 105          2H        GLY 105   1.496  15.931   7.461
    3    H3   GLY 105          3H        GLY 105   0.650  16.762   6.328
    4    HA2  GLY 105          1HA       GLY 105  -0.588  16.729   8.379
    5    HA3  GLY 105          2HA       GLY 105  -1.430  15.829   7.106
    6    H    SER 106           H        SER 106  -2.523  14.825   8.981
    7    HA   SER 106           HA       SER 106  -1.210  13.316  10.973
    8    HB2  SER 106          1HB       SER 106  -4.028  13.028   9.857
    9    HB3  SER 106          2HB       SER 106  -3.451  12.364  11.398
   10    HG   SER 106           HG       SER 106  -4.499  14.391  11.671
   11    H    HIS 107           H        HIS 107  -1.987  12.333   7.703
   12    HA   HIS 107           HA       HIS 107  -0.726   9.690   8.117
   13    HB2  HIS 107          1HB       HIS 107  -2.565   8.515   7.000
   14    HB3  HIS 107          2HB       HIS 107  -3.109   9.252   8.501
   15    HD2  HIS 107          2HD       HIS 107  -3.724   9.312   4.732
   16    HE1  HIS 107          1HE       HIS 107  -6.395  12.198   6.377
   17    HE2  HIS 107          2HE       HIS 107  -5.739  10.962   4.253
   18    H    MET 108           H        MET 108   0.015   8.709   6.208
   19    HA   MET 108           HA       MET 108   0.369  10.481   3.848
   20    HB2  MET 108          1HB       MET 108   2.316   9.286   4.781
   21    HB3  MET 108          2HB       MET 108   1.500   7.747   4.544
   22    HG2  MET 108          1HG       MET 108   3.168   8.171   2.801
   23    HG3  MET 108          2HG       MET 108   1.556   8.003   2.132
   24    HE1  MET 108          1HE       MET 108   3.230  11.244   3.859
   25    HE2  MET 108          2HE       MET 108   4.523  10.414   2.960
   26    HE3  MET 108          3HE       MET 108   3.924  11.993   2.408
   27    H    LYS 109           H        LYS 109  -0.232   9.696   1.688
   28    HA   LYS 109           HA       LYS 109  -2.775   8.271   1.560
   29    HB2  LYS 109          1HB       LYS 109  -1.990  10.317   0.183
   30    HB3  LYS 109          2HB       LYS 109  -1.060   9.171  -0.781
   31    HG2  LYS 109          1HG       LYS 109  -3.768   8.157  -0.485
   32    HG3  LYS 109          2HG       LYS 109  -3.876   9.865  -0.888
   33    HD2  LYS 109          1HD       LYS 109  -2.316   7.793  -2.464
   34    HD3  LYS 109          2HD       LYS 109  -3.944   8.355  -2.858
   35    HE2  LYS 109          1HE       LYS 109  -3.020  10.705  -3.063
   36    HE3  LYS 109          2HE       LYS 109  -1.400  10.031  -2.832
   37    HZ1  LYS 109          1HZ       LYS 109  -3.257   9.445  -5.077
   38    HZ2  LYS 109          2HZ       LYS 109  -1.904   8.577  -4.802
   39    HZ3  LYS 109          3HZ       LYS 109  -1.796  10.180  -5.174
   40    H    LYS 110           H        LYS 110  -1.186   6.580   2.709
   41    HA   LYS 110           HA       LYS 110  -0.558   4.327   0.892
   42    HB2  LYS 110          1HB       LYS 110   1.432   5.865   0.977
   43    HB3  LYS 110          2HB       LYS 110   1.465   5.693   2.731
   44    HG2  LYS 110          1HG       LYS 110   2.021   3.289   2.490
   45    HG3  LYS 110          2HG       LYS 110   1.875   3.446   0.735
   46    HD2  LYS 110          1HD       LYS 110   4.196   3.493   1.203
   47    HD3  LYS 110          2HD       LYS 110   3.726   5.125   0.733
   48    HE2  LYS 110          1HE       LYS 110   3.661   5.818   3.107
   49    HE3  LYS 110          2HE       LYS 110   4.015   4.166   3.622
   50    HZ1  LYS 110          1HZ       LYS 110   5.975   5.565   3.620
   51    HZ2  LYS 110          2HZ       LYS 110   5.862   5.842   2.004
   52    HZ3  LYS 110          3HZ       LYS 110   6.183   4.335   2.581
   53    H    ILE 111           H        ILE 111  -0.546   2.332   1.983
   54    HA   ILE 111           HA       ILE 111  -1.345   2.395   4.873
   55    HB   ILE 111           HB       ILE 111  -2.445   0.321   4.654
   56   HG12  ILE 111          1HG1      ILE 111  -1.295   0.162   1.876
   57   HG13  ILE 111          2HG1      ILE 111  -1.026  -0.926   3.225
   58   HG21  ILE 111          1HG2      ILE 111  -3.688   2.317   4.028
   59   HG22  ILE 111          2HG2      ILE 111  -3.326   2.034   2.303
   60   HG23  ILE 111          3HG2      ILE 111  -4.313   0.880   3.234
   61   HD11  ILE 111          1HD1      ILE 111  -3.603  -0.669   1.657
   62   HD12  ILE 111          2HD1      ILE 111  -2.458  -2.020   1.636
   63   HD13  ILE 111          3HD1      ILE 111  -3.389  -1.677   3.108
   64    H    PHE 112           H        PHE 112  -0.521   0.932   6.241
   65    HA   PHE 112           HA       PHE 112   2.148  -0.322   5.813
   66    HB2  PHE 112          1HB       PHE 112   1.356   0.985   7.947
   67    HB3  PHE 112          2HB       PHE 112   0.219  -0.315   8.203
   68    HD1  PHE 112          1HD       PHE 112   1.016  -2.589   8.896
   69    HD2  PHE 112          2HD       PHE 112   3.728   0.700   8.306
   70    HE1  PHE 112          1HE       PHE 112   2.785  -3.805  10.155
   71    HE2  PHE 112          2HE       PHE 112   5.492  -0.508   9.537
   72    HZ   PHE 112           HZ       PHE 112   5.020  -2.768  10.488
   73    H    VAL 113           H        VAL 113   2.187  -2.618   5.643
   74    HA   VAL 113           HA       VAL 113  -0.287  -4.189   6.158
   75    HB   VAL 113           HB       VAL 113   1.566  -4.746   3.823
   76   HG11  VAL 113          1HG1      VAL 113  -0.187  -6.376   3.204
   77   HG12  VAL 113          2HG1      VAL 113   0.518  -6.755   4.779
   78   HG13  VAL 113          3HG1      VAL 113  -1.080  -5.978   4.689
   79   HG21  VAL 113          1HG2      VAL 113  -0.404  -4.139   2.408
   80   HG22  VAL 113          2HG2      VAL 113  -1.193  -3.475   3.859
   81   HG23  VAL 113          3HG2      VAL 113   0.336  -2.778   3.256
   82    H    GLY 114           H        GLY 114   0.187  -5.359   7.912
   83    HA2  GLY 114          1HA       GLY 114   2.975  -6.438   8.270
   84    HA3  GLY 114          2HA       GLY 114   1.926  -5.921   9.577
   85    H    GLY 115           H        GLY 115   3.295  -8.496   9.109
   86    HA2  GLY 115          1HA       GLY 115   2.675 -10.615   9.934
   87    HA3  GLY 115          2HA       GLY 115   0.984 -10.312   9.552
   88    H    LEU 116           H        LEU 116   3.337  -9.607   7.070
   89    HA   LEU 116           HA       LEU 116   2.050 -11.356   5.166
   90    HB2  LEU 116          1HB       LEU 116   4.567  -9.656   5.153
   91    HB3  LEU 116          2HB       LEU 116   4.139 -10.653   3.770
   92    HG   LEU 116           HG       LEU 116   2.129  -8.666   4.886
   93   HD11  LEU 116          1HD1      LEU 116   2.950  -7.049   3.201
   94   HD12  LEU 116          2HD1      LEU 116   4.298  -8.148   2.818
   95   HD13  LEU 116          3HD1      LEU 116   4.183  -7.396   4.422
   96   HD21  LEU 116          1HD2      LEU 116   1.440 -10.423   3.161
   97   HD22  LEU 116          2HD2      LEU 116   2.622  -9.708   2.056
   98   HD23  LEU 116          3HD2      LEU 116   1.241  -8.746   2.622
   99    H    SER 117           H        SER 117   2.513 -13.355   4.493
  100    HA   SER 117           HA       SER 117   4.350 -15.090   5.859
  101    HB2  SER 117          1HB       SER 117   2.402 -16.013   4.776
  102    HB3  SER 117          2HB       SER 117   2.915 -15.389   3.199
  103    HG   SER 117           HG       SER 117   3.394 -17.679   3.700
  104    H    VAL 118           H        VAL 118   6.281 -15.996   5.198
  105    HA   VAL 118           HA       VAL 118   8.169 -14.405   3.764
  106    HB   VAL 118           HB       VAL 118   8.565 -17.364   4.153
  107   HG11  VAL 118          1HG1      VAL 118  10.361 -16.087   3.051
  108   HG12  VAL 118          2HG1      VAL 118  10.409 -14.952   4.418
  109   HG13  VAL 118          3HG1      VAL 118  10.881 -16.651   4.639
  110   HG21  VAL 118          1HG2      VAL 118   8.669 -15.287   6.370
  111   HG22  VAL 118          2HG2      VAL 118   7.676 -16.763   6.314
  112   HG23  VAL 118          3HG2      VAL 118   9.425 -16.891   6.459
  113    H    ASN 119           H        ASN 119   5.860 -16.740   2.638
  114    HA   ASN 119           HA       ASN 119   7.103 -17.245   0.042
  115    HB2  ASN 119          1HB       ASN 119   5.541 -18.804   1.255
  116    HB3  ASN 119          2HB       ASN 119   4.244 -17.626   1.042
  117   HD21  ASN 119          1HD2      ASN 119   2.883 -18.699  -0.389
  118   HD22  ASN 119          2HD2      ASN 119   3.419 -19.328  -1.941
  119    H    THR 120           H        THR 120   4.978 -14.759   1.375
  120    HA   THR 120           HA       THR 120   3.922 -13.857  -1.136
  121    HB   THR 120           HB       THR 120   3.911 -12.324   1.453
  122    HG1  THR 120          1HG       THR 120   2.072 -13.435   1.937
  123   HG21  THR 120          1HG2      THR 120   1.997 -12.348  -0.915
  124   HG22  THR 120          2HG2      THR 120   3.087 -11.027  -0.452
  125   HG23  THR 120          3HG2      THR 120   1.743 -11.476   0.609
  126    H    THR 121           H        THR 121   4.586 -12.550  -2.586
  127    HA   THR 121           HA       THR 121   7.036 -10.974  -2.150
  128    HB   THR 121           HB       THR 121   7.504 -10.967  -4.351
  129    HG1  THR 121          1HG       THR 121   5.910 -11.465  -5.948
  130   HG21  THR 121          1HG2      THR 121   7.274 -13.178  -5.257
  131   HG22  THR 121          2HG2      THR 121   5.874 -13.531  -4.217
  132   HG23  THR 121          3HG2      THR 121   7.493 -13.321  -3.503
  133    H    VAL 122           H        VAL 122   7.312  -8.878  -3.236
  134    HA   VAL 122           HA       VAL 122   5.318  -6.977  -2.455
  135    HB   VAL 122           HB       VAL 122   7.780  -6.534  -2.764
  136   HG11  VAL 122          1HG1      VAL 122   7.063  -6.132  -5.701
  137   HG12  VAL 122          2HG1      VAL 122   8.615  -5.807  -4.911
  138   HG13  VAL 122          3HG1      VAL 122   8.047  -7.476  -5.071
  139   HG21  VAL 122          1HG2      VAL 122   6.091  -4.769  -2.384
  140   HG22  VAL 122          2HG2      VAL 122   7.422  -4.217  -3.430
  141   HG23  VAL 122          3HG2      VAL 122   5.851  -4.629  -4.138
  142    H    GLU 123           H        GLU 123   5.763  -8.747  -5.475
  143    HA   GLU 123           HA       GLU 123   3.807  -7.161  -6.957
  144    HB2  GLU 123          1HB       GLU 123   5.027  -9.890  -7.550
  145    HB3  GLU 123          2HB       GLU 123   3.981  -8.959  -8.635
  146    HG2  GLU 123          1HG       GLU 123   5.647  -7.078  -8.557
  147    HG3  GLU 123          2HG       GLU 123   6.730  -8.117  -7.624
  148    H    ASP 124           H        ASP 124   3.727 -10.246  -5.103
  149    HA   ASP 124           HA       ASP 124   1.004 -10.928  -5.586
  150    HB2  ASP 124          1HB       ASP 124   2.647 -11.233  -3.050
  151    HB3  ASP 124          2HB       ASP 124   1.031 -11.873  -3.258
  152    H    VAL 125           H        VAL 125   2.374  -8.704  -3.171
  153    HA   VAL 125           HA       VAL 125  -0.137  -7.922  -1.971
  154    HB   VAL 125           HB       VAL 125   2.666  -6.734  -2.043
  155   HG11  VAL 125          1HG1      VAL 125   2.046  -5.275  -0.182
  156   HG12  VAL 125          2HG1      VAL 125   1.141  -4.859  -1.640
  157   HG13  VAL 125          3HG1      VAL 125   0.352  -5.775  -0.334
  158   HG21  VAL 125          1HG2      VAL 125   2.673  -7.539   0.329
  159   HG22  VAL 125          2HG2      VAL 125   1.047  -8.199   0.094
  160   HG23  VAL 125          3HG2      VAL 125   2.419  -8.856  -0.816
  161    H    LYS 126           H        LYS 126   1.939  -6.347  -4.476
  162    HA   LYS 126           HA       LYS 126   0.281  -4.080  -4.876
  163    HB2  LYS 126          1HB       LYS 126   2.663  -4.393  -5.573
  164    HB3  LYS 126          2HB       LYS 126   2.137  -5.457  -6.875
  165    HG2  LYS 126          1HG       LYS 126   1.005  -3.634  -8.003
  166    HG3  LYS 126          2HG       LYS 126   1.211  -2.568  -6.596
  167    HD2  LYS 126          1HD       LYS 126   3.652  -2.613  -6.861
  168    HD3  LYS 126          2HD       LYS 126   3.505  -3.721  -8.240
  169    HE2  LYS 126          1HE       LYS 126   2.294  -2.024  -9.528
  170    HE3  LYS 126          2HE       LYS 126   2.279  -0.929  -8.142
  171    HZ1  LYS 126          1HZ       LYS 126   4.070  -0.374  -9.693
  172    HZ2  LYS 126          2HZ       LYS 126   4.738  -1.855  -9.536
  173    HZ3  LYS 126          3HZ       LYS 126   4.720  -0.824  -8.261
  174    H    HIS 127           H        HIS 127   0.211  -7.212  -6.618
  175    HA   HIS 127           HA       HIS 127  -2.047  -6.444  -8.286
  176    HB2  HIS 127          1HB       HIS 127  -0.745  -9.110  -7.692
  177    HB3  HIS 127          2HB       HIS 127  -2.146  -8.926  -8.744
  178    HD2  HIS 127          2HD       HIS 127   1.427  -9.174  -9.088
  179    HE1  HIS 127          1HE       HIS 127   0.262  -6.850 -12.468
  180    HE2  HIS 127          2HE       HIS 127   2.146  -8.227 -11.446
  181    H    TYR 128           H        TYR 128  -1.833  -7.943  -5.050
  182    HA   TYR 128           HA       TYR 128  -4.600  -8.706  -5.004
  183    HB2  TYR 128          1HB       TYR 128  -3.108  -9.837  -3.564
  184    HB3  TYR 128          2HB       TYR 128  -2.598  -8.340  -2.795
  185    HD1  TYR 128          1HD       TYR 128  -4.039  -7.180  -1.124
  186    HD2  TYR 128          2HD       TYR 128  -5.219 -10.894  -2.979
  187    HE1  TYR 128          1HE       TYR 128  -5.778  -7.507   0.627
  188    HE2  TYR 128          2HE       TYR 128  -6.939 -11.227  -1.215
  189    HH   TYR 128           HH       TYR 128  -7.984 -10.337   0.602
  190    H    PHE 129           H        PHE 129  -3.012  -5.784  -3.632
  191    HA   PHE 129           HA       PHE 129  -5.498  -4.771  -2.690
  192    HB2  PHE 129          1HB       PHE 129  -2.797  -3.499  -2.901
  193    HB3  PHE 129          2HB       PHE 129  -4.213  -2.606  -2.354
  194    HD1  PHE 129          1HD       PHE 129  -1.647  -4.917  -1.345
  195    HD2  PHE 129          2HD       PHE 129  -5.626  -3.573  -0.410
  196    HE1  PHE 129          1HE       PHE 129  -1.527  -6.077   0.854
  197    HE2  PHE 129          2HE       PHE 129  -5.504  -4.742   1.775
  198    HZ   PHE 129           HZ       PHE 129  -3.465  -6.034   2.383
  199    H    GLU 130           H        GLU 130  -4.285  -4.548  -5.850
  200    HA   GLU 130           HA       GLU 130  -5.783  -2.392  -6.907
  201    HB2  GLU 130          1HB       GLU 130  -4.691  -4.982  -7.959
  202    HB3  GLU 130          2HB       GLU 130  -5.778  -4.087  -8.990
  203    HG2  GLU 130          1HG       GLU 130  -3.364  -2.776  -7.677
  204    HG3  GLU 130          2HG       GLU 130  -3.224  -3.656  -9.178
  205    H    GLN 131           H        GLN 131  -7.105  -5.361  -5.590
  206    HA   GLN 131           HA       GLN 131  -9.532  -5.405  -7.123
  207    HB2  GLN 131          1HB       GLN 131 -10.327  -6.956  -5.527
  208    HB3  GLN 131          2HB       GLN 131  -8.598  -7.257  -5.689
  209    HG2  GLN 131          1HG       GLN 131  -8.290  -5.836  -3.570
  210    HG3  GLN 131          2HG       GLN 131 -10.045  -5.853  -3.400
  211   HE21  GLN 131          1HE2      GLN 131  -7.153  -7.916  -3.527
  212   HE22  GLN 131          2HE2      GLN 131  -7.870  -9.273  -2.667
  213    H    PHE 132           H        PHE 132  -8.547  -3.424  -4.359
  214    HA   PHE 132           HA       PHE 132 -11.290  -2.533  -3.763
  215    HB2  PHE 132          1HB       PHE 132  -8.603  -1.611  -2.657
  216    HB3  PHE 132          2HB       PHE 132 -10.191  -1.233  -2.000
  217    HD1  PHE 132          1HD       PHE 132 -11.731  -3.343  -1.430
  218    HD2  PHE 132          2HD       PHE 132  -7.445  -3.475  -1.816
  219    HE1  PHE 132          1HE       PHE 132 -11.678  -5.480  -0.167
  220    HE2  PHE 132          2HE       PHE 132  -7.388  -5.580  -0.493
  221    HZ   PHE 132           HZ       PHE 132  -9.506  -6.598   0.310
  222    H    GLY 133           H        GLY 133  -8.426  -1.289  -5.367
  223    HA2  GLY 133          1HA       GLY 133  -9.595   0.533  -7.111
  224    HA3  GLY 133          2HA       GLY 133  -9.182   1.459  -5.663
  225    H    LYS 134           H        LYS 134  -7.863   2.212  -7.871
  226    HA   LYS 134           HA       LYS 134  -5.712   0.568  -8.658
  227    HB2  LYS 134          1HB       LYS 134  -6.925   2.400  -9.941
  228    HB3  LYS 134          2HB       LYS 134  -5.846   3.559  -9.181
  229    HG2  LYS 134          1HG       LYS 134  -4.771   1.101 -10.610
  230    HG3  LYS 134          2HG       LYS 134  -5.340   2.459 -11.539
  231    HD2  LYS 134          1HD       LYS 134  -3.703   3.950 -10.694
  232    HD3  LYS 134          2HD       LYS 134  -3.171   2.829  -9.443
  233    HE2  LYS 134          1HE       LYS 134  -3.024   2.209 -12.425
  234    HE3  LYS 134          2HE       LYS 134  -1.703   2.980 -11.541
  235    HZ1  LYS 134          1HZ       LYS 134  -1.486   0.516 -11.705
  236    HZ2  LYS 134          2HZ       LYS 134  -2.805   0.323 -10.735
  237    HZ3  LYS 134          3HZ       LYS 134  -1.489   1.063 -10.159
  238    H    VAL 135           H        VAL 135  -3.694   0.383  -8.209
  239    HA   VAL 135           HA       VAL 135  -2.636   1.557  -5.663
  240    HB   VAL 135           HB       VAL 135  -1.886  -0.931  -7.247
  241   HG11  VAL 135          1HG1      VAL 135   0.157  -0.138  -6.225
  242   HG12  VAL 135          2HG1      VAL 135  -0.677   0.159  -4.686
  243   HG13  VAL 135          3HG1      VAL 135  -0.453  -1.497  -5.276
  244   HG21  VAL 135          1HG2      VAL 135  -3.154  -0.611  -4.490
  245   HG22  VAL 135          2HG2      VAL 135  -4.011  -1.100  -5.968
  246   HG23  VAL 135          3HG2      VAL 135  -2.751  -2.144  -5.307
  247    H    ASP 136           H        ASP 136  -0.944   2.936  -5.699
  248    HA   ASP 136           HA       ASP 136   0.219   3.777  -8.255
  249    HB2  ASP 136          1HB       ASP 136  -0.257   5.535  -6.775
  250    HB3  ASP 136          2HB       ASP 136   0.531   4.730  -5.422
  251    H    ASP 137           H        ASP 137   1.514   2.230  -5.270
  252    HA   ASP 137           HA       ASP 137   3.211   0.508  -6.814
  253    HB2  ASP 137          1HB       ASP 137   4.452   2.882  -6.644
  254    HB3  ASP 137          2HB       ASP 137   4.763   2.393  -4.987
  255    H    ALA 138           H        ALA 138   4.745  -0.708  -5.206
  256    HA   ALA 138           HA       ALA 138   3.816  -0.755  -2.403
  257    HB1  ALA 138          1HB       ALA 138   3.552  -3.193  -2.400
  258    HB2  ALA 138          2HB       ALA 138   2.447  -2.472  -3.586
  259    HB3  ALA 138          3HB       ALA 138   3.945  -3.260  -4.128
  260    H    MET 139           H        MET 139   5.301  -1.768  -0.945
  261    HA   MET 139           HA       MET 139   7.941  -2.651  -1.911
  262    HB2  MET 139          1HB       MET 139   9.187  -1.092  -0.476
  263    HB3  MET 139          2HB       MET 139   8.360  -0.285  -1.804
  264    HG2  MET 139          1HG       MET 139   6.582   0.473  -0.289
  265    HG3  MET 139          2HG       MET 139   7.341  -0.358   1.066
  266    HE1  MET 139          1HE       MET 139  10.425   1.745   1.952
  267    HE2  MET 139          2HE       MET 139   9.330   0.428   2.410
  268    HE3  MET 139          3HE       MET 139  10.397   0.251   0.998
  269    H    LEU 140           H        LEU 140   8.768  -4.245  -0.606
  270    HA   LEU 140           HA       LEU 140   7.583  -4.583   2.125
  271    HB2  LEU 140          1HB       LEU 140   8.960  -6.754   0.545
  272    HB3  LEU 140          2HB       LEU 140   8.130  -6.892   2.091
  273    HG   LEU 140           HG       LEU 140   6.879  -6.428  -0.640
  274   HD11  LEU 140          1HD1      LEU 140   5.752  -8.568  -0.134
  275   HD12  LEU 140          2HD1      LEU 140   6.597  -8.651   1.421
  276   HD13  LEU 140          3HD1      LEU 140   7.517  -8.749  -0.097
  277   HD21  LEU 140          1HD2      LEU 140   5.542  -5.095   0.858
  278   HD22  LEU 140          2HD2      LEU 140   5.558  -6.374   2.091
  279   HD23  LEU 140          3HD2      LEU 140   4.685  -6.596   0.551
  280    H    MET 141           H        MET 141   8.977  -5.019   3.868
  281    HA   MET 141           HA       MET 141  11.418  -3.456   3.624
  282    HB2  MET 141          1HB       MET 141  10.314  -4.865   6.076
  283    HB3  MET 141          2HB       MET 141  11.537  -3.593   6.022
  284    HG2  MET 141          1HG       MET 141   8.570  -3.419   5.616
  285    HG3  MET 141          2HG       MET 141   9.616  -2.486   6.667
  286    HE1  MET 141          1HE       MET 141  11.121   0.211   4.330
  287    HE2  MET 141          2HE       MET 141  11.074  -0.504   5.959
  288    HE3  MET 141          3HE       MET 141  11.874  -1.368   4.627
  289    H    PHE 142           H        PHE 142  12.436  -4.967   2.075
  290    HA   PHE 142           HA       PHE 142  13.488  -7.454   2.936
  291    HB2  PHE 142          1HB       PHE 142  14.100  -5.733   0.593
  292    HB3  PHE 142          2HB       PHE 142  15.101  -7.122   0.975
  293    HD1  PHE 142          1HD       PHE 142  11.801  -6.068  -0.259
  294    HD2  PHE 142          2HD       PHE 142  14.222  -9.423   0.952
  295    HE1  PHE 142          1HE       PHE 142  10.199  -7.622  -1.350
  296    HE2  PHE 142          2HE       PHE 142  12.608 -10.975  -0.124
  297    HZ   PHE 142           HZ       PHE 142  10.592 -10.077  -1.270
  298    H    ASP 143           H        ASP 143  15.258  -8.281   3.757
  299    HA   ASP 143           HA       ASP 143  17.398  -6.421   4.682
  300    HB2  ASP 143          1HB       ASP 143  16.252  -7.015   6.617
  301    HB3  ASP 143          2HB       ASP 143  16.095  -8.699   6.119
  302    H    LYS 144           H        LYS 144  19.189  -6.621   3.562
  303    HA   LYS 144           HA       LYS 144  19.673  -8.818   1.833
  304    HB2  LYS 144          1HB       LYS 144  20.445  -6.475   1.470
  305    HB3  LYS 144          2HB       LYS 144  21.608  -6.660   2.780
  306    HG2  LYS 144          1HG       LYS 144  22.680  -6.856   0.584
  307    HG3  LYS 144          2HG       LYS 144  22.842  -8.357   1.490
  308    HD2  LYS 144          1HD       LYS 144  20.888  -9.290   0.191
  309    HD3  LYS 144          2HD       LYS 144  20.845  -7.793  -0.757
  310    HE2  LYS 144          1HE       LYS 144  23.121  -8.270  -1.591
  311    HE3  LYS 144          2HE       LYS 144  23.228  -9.683  -0.527
  312    HZ1  LYS 144          1HZ       LYS 144  21.328  -9.366  -2.787
  313    HZ2  LYS 144          2HZ       LYS 144  21.289 -10.614  -1.733
  314    HZ3  LYS 144          3HZ       LYS 144  22.586 -10.408  -2.722
  315    H    THR 145           H        THR 145  20.407  -8.562   5.179
  316    HA   THR 145           HA       THR 145  22.515 -10.482   5.324
  317    HB   THR 145           HB       THR 145  20.574 -10.296   7.579
  318    HG1  THR 145          1HG       THR 145  20.718  -8.207   7.079
  319   HG21  THR 145          1HG2      THR 145  22.660 -10.271   8.907
  320   HG22  THR 145          2HG2      THR 145  23.620 -10.310   7.412
  321   HG23  THR 145          3HG2      THR 145  22.587 -11.689   7.855
  322    H    THR 146           H        THR 146  19.127 -10.967   4.793
  323    HA   THR 146           HA       THR 146  19.643 -13.881   4.591
  324    HB   THR 146           HB       THR 146  17.786 -14.599   5.660
  325    HG1  THR 146          1HG       THR 146  16.040 -13.350   6.113
  326   HG21  THR 146          1HG2      THR 146  18.344 -12.078   7.288
  327   HG22  THR 146          2HG2      THR 146  19.323 -13.565   7.354
  328   HG23  THR 146          3HG2      THR 146  17.629 -13.599   7.857
  329    H    ASN 147           H        ASN 147  18.391 -11.187   2.998
  330    HA   ASN 147           HA       ASN 147  17.478 -10.802   1.014
  331    HB2  ASN 147          1HB       ASN 147  17.797 -13.724   0.256
  332    HB3  ASN 147          2HB       ASN 147  17.515 -12.369  -0.819
  333   HD21  ASN 147          1HD2      ASN 147  19.919 -14.104   1.019
  334   HD22  ASN 147          2HD2      ASN 147  21.293 -13.214   0.374
  335    H    ARG 148           H        ARG 148  15.897 -12.111   3.422
  336    HA   ARG 148           HA       ARG 148  13.250 -12.275   2.012
  337    HB2  ARG 148          1HB       ARG 148  14.183 -13.212   4.750
  338    HB3  ARG 148          2HB       ARG 148  12.497 -12.986   4.360
  339    HG2  ARG 148          1HG       ARG 148  13.044 -15.276   4.217
  340    HG3  ARG 148          2HG       ARG 148  12.548 -14.678   2.638
  341    HD2  ARG 148          1HD       ARG 148  15.477 -14.988   3.364
  342    HD3  ARG 148          2HD       ARG 148  14.496 -16.372   2.869
  343    HE   ARG 148           HE       ARG 148  14.496 -14.001   1.091
  344   HH11  ARG 148          1HH1      ARG 148  16.214 -17.370  -0.159
  345   HH12  ARG 148          2HH1      ARG 148  15.754 -17.246   1.518
  346   HH21  ARG 148          1HH2      ARG 148  15.118 -14.200  -0.968
  347   HH22  ARG 148          2HH2      ARG 148  15.844 -15.677  -1.544
  348    H    HIS 149           H        HIS 149  11.437 -11.239   3.242
  349    HA   HIS 149           HA       HIS 149  12.209  -8.500   4.102
  350    HB2  HIS 149          1HB       HIS 149   9.882  -7.895   3.750
  351    HB3  HIS 149          2HB       HIS 149  10.601  -8.581   2.300
  352    HD2  HIS 149          2HD       HIS 149   9.244 -10.440   1.139
  353    HE1  HIS 149          1HE       HIS 149   6.479 -11.361   4.246
  354    HE2  HIS 149          2HE       HIS 149   7.082 -11.774   1.798
  355    H    ARG 150           H        ARG 150  11.303  -7.506   5.871
  356    HA   ARG 150           HA       ARG 150  11.436  -9.014   8.302
  357    HB2  ARG 150          1HB       ARG 150  12.043  -6.501   7.514
  358    HB3  ARG 150          2HB       ARG 150  10.472  -6.151   8.193
  359    HG2  ARG 150          1HG       ARG 150  12.862  -7.411   9.643
  360    HG3  ARG 150          2HG       ARG 150  12.386  -5.708   9.684
  361    HD2  ARG 150          1HD       ARG 150  10.109  -6.582  10.520
  362    HD3  ARG 150          2HD       ARG 150  10.972  -8.077  10.914
  363    HE   ARG 150           HE       ARG 150  12.468  -6.054  12.116
  364   HH11  ARG 150          1HH1      ARG 150   9.133  -7.072  12.317
  365   HH12  ARG 150          2HH1      ARG 150   8.819  -5.994  13.694
  366   HH21  ARG 150          1HH2      ARG 150  11.925  -4.810  14.021
  367   HH22  ARG 150          2HH2      ARG 150  10.254  -4.900  14.582
  368    H    GLY 151           H        GLY 151   9.013  -9.662   6.545
  369    HA2  GLY 151          1HA       GLY 151   6.887 -10.437   6.973
  370    HA3  GLY 151          2HA       GLY 151   7.117 -10.045   8.678
  371    H    PHE 152           H        PHE 152   7.567  -7.217   6.797
  372    HA   PHE 152           HA       PHE 152   4.720  -6.586   6.536
  373    HB2  PHE 152          1HB       PHE 152   4.697  -4.659   7.908
  374    HB3  PHE 152          2HB       PHE 152   5.321  -5.947   8.903
  375    HD1  PHE 152          1HD       PHE 152   5.971  -2.681   7.397
  376    HD2  PHE 152          2HD       PHE 152   7.728  -5.933   9.608
  377    HE1  PHE 152          1HE       PHE 152   7.788  -1.177   8.163
  378    HE2  PHE 152          2HE       PHE 152   9.577  -4.428  10.336
  379    HZ   PHE 152           HZ       PHE 152   9.602  -2.055   9.622
  380    H    GLY 153           H        GLY 153   4.418  -4.456   5.479
  381    HA2  GLY 153          1HA       GLY 153   6.629  -3.097   4.159
  382    HA3  GLY 153          2HA       GLY 153   5.665  -4.101   3.066
  383    H    PHE 154           H        PHE 154   5.357  -1.960   2.094
  384    HA   PHE 154           HA       PHE 154   2.932  -0.626   3.141
  385    HB2  PHE 154          1HB       PHE 154   5.376   0.727   1.966
  386    HB3  PHE 154          2HB       PHE 154   3.837   1.513   2.269
  387    HD1  PHE 154          1HD       PHE 154   3.146   2.187   4.492
  388    HD2  PHE 154          2HD       PHE 154   6.756  -0.087   3.887
  389    HE1  PHE 154          1HE       PHE 154   3.854   2.686   6.819
  390    HE2  PHE 154          2HE       PHE 154   7.418   0.332   6.223
  391    HZ   PHE 154           HZ       PHE 154   5.983   1.748   7.700
  392    H    VAL 155           H        VAL 155   1.508   0.335   1.694
  393    HA   VAL 155           HA       VAL 155   1.954  -0.103  -1.209
  394    HB   VAL 155           HB       VAL 155  -0.741  -0.738  -0.014
  395   HG11  VAL 155          1HG1      VAL 155   0.477  -1.240  -2.749
  396   HG12  VAL 155          2HG1      VAL 155  -1.132  -1.771  -2.210
  397   HG13  VAL 155          3HG1      VAL 155  -0.782  -0.047  -2.352
  398   HG21  VAL 155          1HG2      VAL 155   1.449  -2.677  -0.797
  399   HG22  VAL 155          2HG2      VAL 155   0.767  -2.451   0.828
  400   HG23  VAL 155          3HG2      VAL 155  -0.245  -3.108  -0.453
  401    H    THR 156           H        THR 156   1.787   1.675  -2.285
  402    HA   THR 156           HA       THR 156   0.387   4.017  -1.186
  403    HB   THR 156           HB       THR 156   2.073   4.112  -3.661
  404    HG1  THR 156          1HG       THR 156   3.835   4.501  -2.380
  405   HG21  THR 156          1HG2      THR 156   2.552   6.404  -2.802
  406   HG22  THR 156          2HG2      THR 156   1.459   6.113  -1.433
  407   HG23  THR 156          3HG2      THR 156   0.829   6.162  -3.095
  408    H    PHE 157           H        PHE 157  -1.204   5.244  -2.294
  409    HA   PHE 157           HA       PHE 157  -2.680   3.605  -4.276
  410    HB2  PHE 157          1HB       PHE 157  -3.632   5.077  -1.858
  411    HB3  PHE 157          2HB       PHE 157  -4.723   4.632  -3.159
  412    HD1  PHE 157          1HD       PHE 157  -2.379   3.227  -0.626
  413    HD2  PHE 157          2HD       PHE 157  -5.489   2.372  -3.480
  414    HE1  PHE 157          1HE       PHE 157  -2.533   0.914   0.223
  415    HE2  PHE 157          2HE       PHE 157  -5.670   0.068  -2.583
  416    HZ   PHE 157           HZ       PHE 157  -4.170  -0.682  -0.752
  417    H    GLU 158           H        GLU 158  -4.268   4.522  -5.628
  418    HA   GLU 158           HA       GLU 158  -3.446   6.973  -6.963
  419    HB2  GLU 158          1HB       GLU 158  -4.537   5.186  -8.186
  420    HB3  GLU 158          2HB       GLU 158  -5.942   5.257  -7.126
  421    HG2  GLU 158          1HG       GLU 158  -6.517   6.258  -9.206
  422    HG3  GLU 158          2HG       GLU 158  -6.513   7.505  -7.972
  423    H    SER 159           H        SER 159  -5.999   6.175  -4.582
  424    HA   SER 159           HA       SER 159  -6.293   9.068  -3.916
  425    HB2  SER 159          1HB       SER 159  -8.111   8.494  -5.452
  426    HB3  SER 159          2HB       SER 159  -8.560   7.110  -4.430
  427    HG   SER 159           HG       SER 159  -9.744   9.187  -4.126
  428    H    GLU 160           H        GLU 160  -6.751   9.528  -1.767
  429    HA   GLU 160           HA       GLU 160  -6.266   7.468   0.217
  430    HB2  GLU 160          1HB       GLU 160  -6.826   9.107   1.881
  431    HB3  GLU 160          2HB       GLU 160  -5.600   9.694   0.755
  432    HG2  GLU 160          1HG       GLU 160  -7.253  11.095  -0.381
  433    HG3  GLU 160          2HG       GLU 160  -8.548  10.444   0.631
  434    H    ASP 161           H        ASP 161  -9.129   8.439  -1.485
  435    HA   ASP 161           HA       ASP 161 -11.044   7.395   0.398
  436    HB2  ASP 161          1HB       ASP 161 -11.150   7.675  -2.616
  437    HB3  ASP 161          2HB       ASP 161 -12.466   7.007  -1.666
  438    H    ILE 162           H        ILE 162  -8.902   5.773  -1.876
  439    HA   ILE 162           HA       ILE 162 -10.076   3.131  -1.356
  440    HB   ILE 162           HB       ILE 162  -7.336   3.684  -2.514
  441   HG12  ILE 162          1HG1      ILE 162  -8.769   4.860  -3.988
  442   HG13  ILE 162          2HG1      ILE 162  -8.327   3.330  -4.727
  443   HG21  ILE 162          1HG2      ILE 162  -7.731   1.440  -3.568
  444   HG22  ILE 162          2HG2      ILE 162  -7.660   1.391  -1.809
  445   HG23  ILE 162          3HG2      ILE 162  -9.230   1.293  -2.625
  446   HD11  ILE 162          1HD1      ILE 162 -10.669   3.796  -5.187
  447   HD12  ILE 162          2HD1      ILE 162 -10.596   2.410  -4.081
  448   HD13  ILE 162          3HD1      ILE 162 -11.023   4.019  -3.467
  449    H    VAL 163           H        VAL 163  -7.240   5.025  -0.196
  450    HA   VAL 163           HA       VAL 163  -6.103   3.054   1.470
  451    HB   VAL 163           HB       VAL 163  -6.334   6.065   1.955
  452   HG11  VAL 163          1HG1      VAL 163  -5.710   4.929   4.078
  453   HG12  VAL 163          2HG1      VAL 163  -4.323   4.212   3.233
  454   HG13  VAL 163          3HG1      VAL 163  -4.435   5.964   3.427
  455   HG21  VAL 163          1HG2      VAL 163  -4.045   4.432   0.798
  456   HG22  VAL 163          2HG2      VAL 163  -5.157   5.442  -0.148
  457   HG23  VAL 163          3HG2      VAL 163  -4.079   6.193   1.032
  458    H    GLU 164           H        GLU 164  -8.756   5.379   2.228
  459    HA   GLU 164           HA       GLU 164  -9.417   4.420   4.843
  460    HB2  GLU 164          1HB       GLU 164 -11.073   5.731   2.657
  461    HB3  GLU 164          2HB       GLU 164 -11.718   5.393   4.251
  462    HG2  GLU 164          1HG       GLU 164  -9.271   7.147   3.776
  463    HG3  GLU 164          2HG       GLU 164 -10.922   7.754   3.821
  464    H    LYS 165           H        LYS 165 -10.830   3.463   1.668
  465    HA   LYS 165           HA       LYS 165 -12.727   1.574   2.580
  466    HB2  LYS 165          1HB       LYS 165 -12.558   2.537   0.313
  467    HB3  LYS 165          2HB       LYS 165 -11.071   1.648   0.023
  468    HG2  LYS 165          1HG       LYS 165 -12.274  -0.498   0.133
  469    HG3  LYS 165          2HG       LYS 165 -13.793   0.372   0.456
  470    HD2  LYS 165          1HD       LYS 165 -13.562   1.572  -1.708
  471    HD3  LYS 165          2HD       LYS 165 -12.033   0.728  -2.021
  472    HE2  LYS 165          1HE       LYS 165 -13.235  -1.447  -2.002
  473    HE3  LYS 165          2HE       LYS 165 -14.759  -0.603  -1.697
  474    HZ1  LYS 165          1HZ       LYS 165 -13.056  -0.198  -4.108
  475    HZ2  LYS 165          2HZ       LYS 165 -14.497   0.531  -3.831
  476    HZ3  LYS 165          3HZ       LYS 165 -14.438  -1.082  -4.075
  477    H    VAL 166           H        VAL 166  -9.364   1.046   1.657
  478    HA   VAL 166           HA       VAL 166  -9.253  -1.790   2.217
  479    HB   VAL 166           HB       VAL 166  -7.006   0.249   2.098
  480   HG11  VAL 166          1HG1      VAL 166  -5.617  -1.720   1.463
  481   HG12  VAL 166          2HG1      VAL 166  -6.233  -1.844   3.118
  482   HG13  VAL 166          3HG1      VAL 166  -6.990  -2.777   1.804
  483   HG21  VAL 166          1HG2      VAL 166  -6.744  -0.223  -0.206
  484   HG22  VAL 166          2HG2      VAL 166  -7.855  -1.608  -0.144
  485   HG23  VAL 166          3HG2      VAL 166  -8.469   0.033  -0.048
  486    H    CYS 167           H        CYS 167  -8.221   1.091   4.158
  487    HA   CYS 167           HA       CYS 167  -7.368  -0.454   6.415
  488    HB2  CYS 167          1HB       CYS 167  -8.182   2.464   6.123
  489    HB3  CYS 167          2HB       CYS 167  -7.605   1.760   7.644
  490    HG   CYS 167           HG       CYS 167  -6.140   2.093   4.735
  491    H    GLU 168           H        GLU 168 -10.658   0.779   5.662
  492    HA   GLU 168           HA       GLU 168 -11.843   0.289   8.163
  493    HB2  GLU 168          1HB       GLU 168 -12.773   1.661   6.393
  494    HB3  GLU 168          2HB       GLU 168 -12.901   0.265   5.303
  495    HG2  GLU 168          1HG       GLU 168 -14.533  -0.775   6.740
  496    HG3  GLU 168          2HG       GLU 168 -14.308   0.489   7.963
  497    H    ILE 169           H        ILE 169 -11.073  -1.963   5.534
  498    HA   ILE 169           HA       ILE 169 -12.549  -4.238   6.584
  499    HB   ILE 169           HB       ILE 169 -10.226  -3.980   4.654
  500   HG12  ILE 169          1HG1      ILE 169 -13.120  -4.754   4.050
  501   HG13  ILE 169          2HG1      ILE 169 -12.627  -3.069   4.098
  502   HG21  ILE 169          1HG2      ILE 169 -11.827  -6.481   5.339
  503   HG22  ILE 169          2HG2      ILE 169 -10.730  -6.330   3.950
  504   HG23  ILE 169          3HG2      ILE 169 -10.083  -6.222   5.573
  505   HD11  ILE 169          1HD1      ILE 169 -11.486  -5.148   2.214
  506   HD12  ILE 169          2HD1      ILE 169 -12.603  -3.831   1.814
  507   HD13  ILE 169          3HD1      ILE 169 -10.950  -3.455   2.335
  508    H    HIS 170           H        HIS 170  -9.355  -2.915   7.107
  509    HA   HIS 170           HA       HIS 170  -7.753  -3.140   8.651
  510    HB2  HIS 170          1HB       HIS 170  -9.632  -2.789  10.163
  511    HB3  HIS 170          2HB       HIS 170  -9.891  -4.521  10.290
  512    HD2  HIS 170          2HD       HIS 170  -6.236  -3.305  10.487
  513    HE1  HIS 170          1HE       HIS 170  -7.447  -4.294  14.453
  514    HE2  HIS 170          2HE       HIS 170  -5.461  -3.713  12.978
  515    H    PHE 171           H        PHE 171  -9.360  -6.347   8.696
  516    HA   PHE 171           HA       PHE 171  -6.686  -7.540   8.279
  517    HB2  PHE 171          1HB       PHE 171  -8.914  -8.673   9.853
  518    HB3  PHE 171          2HB       PHE 171  -7.773  -9.727   9.035
  519    HD1  PHE 171          1HD       PHE 171  -8.094  -7.163  11.697
  520    HD2  PHE 171          2HD       PHE 171  -5.431  -9.861   9.637
  521    HE1  PHE 171          1HE       PHE 171  -6.407  -6.883  13.500
  522    HE2  PHE 171          2HE       PHE 171  -3.745  -9.573  11.441
  523    HZ   PHE 171           HZ       PHE 171  -4.234  -8.090  13.374
  524    H    HIS 172           H        HIS 172  -6.074  -8.226   6.520
  525    HA   HIS 172           HA       HIS 172  -7.986  -9.042   4.361
  526    HB2  HIS 172          1HB       HIS 172  -5.243  -7.732   4.277
  527    HB3  HIS 172          2HB       HIS 172  -6.089  -8.342   2.864
  528    HD2  HIS 172          2HD       HIS 172  -6.538  -5.603   5.621
  529    HE1  HIS 172          1HE       HIS 172  -8.778  -4.373   2.231
  530    HE2  HIS 172          2HE       HIS 172  -7.960  -3.686   4.516
  531    H    GLU 173           H        GLU 173  -6.740 -10.577   2.711
  532    HA   GLU 173           HA       GLU 173  -5.071 -12.546   4.178
  533    HB2  GLU 173          1HB       GLU 173  -7.419 -13.213   4.544
  534    HB3  GLU 173          2HB       GLU 173  -7.658 -13.292   2.791
  535    HG2  GLU 173          1HG       GLU 173  -5.846 -15.048   2.683
  536    HG3  GLU 173          2HG       GLU 173  -5.738 -14.986   4.444
  537    H    ILE 174           H        ILE 174  -3.411 -13.204   3.040
  538    HA   ILE 174           HA       ILE 174  -3.463 -13.247   0.068
  539    HB   ILE 174           HB       ILE 174  -1.217 -11.938   1.642
  540   HG12  ILE 174          1HG1      ILE 174  -3.470 -10.563   0.129
  541   HG13  ILE 174          2HG1      ILE 174  -3.177 -10.496   1.868
  542   HG21  ILE 174          1HG2      ILE 174  -1.832 -12.018  -1.352
  543   HG22  ILE 174          2HG2      ILE 174  -0.435 -11.228  -0.600
  544   HG23  ILE 174          3HG2      ILE 174  -0.575 -12.973  -0.530
  545   HD11  ILE 174          1HD1      ILE 174  -0.974  -9.376   1.418
  546   HD12  ILE 174          2HD1      ILE 174  -1.467  -9.235  -0.291
  547   HD13  ILE 174          3HD1      ILE 174  -2.418  -8.448   0.974
  548    H    ASN 175           H        ASN 175  -2.405 -14.999  -0.757
  549    HA   ASN 175           HA       ASN 175  -1.624 -17.133  -0.765
  550    HB2  ASN 175          1HB       ASN 175   0.573 -15.779   0.829
  551    HB3  ASN 175          2HB       ASN 175   0.718 -17.381   0.119
  552   HD21  ASN 175          1HD2      ASN 175   2.057 -14.630  -2.166
  553   HD22  ASN 175          2HD2      ASN 175   2.059 -14.715  -0.397
  554    H    ASN 176           H        ASN 176  -3.657 -16.987   0.995
  555    HA   ASN 176           HA       ASN 176  -4.751 -18.051   2.631
  556    HB2  ASN 176          1HB       ASN 176  -3.539 -19.954   1.225
  557    HB3  ASN 176          2HB       ASN 176  -2.714 -20.265   2.749
  558   HD21  ASN 176          1HD2      ASN 176  -4.398 -20.338   4.699
  559   HD22  ASN 176          2HD2      ASN 176  -5.823 -21.328   4.355
  560    H    LYS 177           H        LYS 177  -2.589 -16.127   3.484
  561    HA   LYS 177           HA       LYS 177  -2.876 -16.758   6.380
  562    HB2  LYS 177          1HB       LYS 177  -0.519 -17.153   5.778
  563    HB3  LYS 177          2HB       LYS 177  -0.399 -15.513   5.118
  564    HG2  LYS 177          1HG       LYS 177  -0.816 -14.545   7.346
  565    HG3  LYS 177          2HG       LYS 177  -1.107 -16.169   8.020
  566    HD2  LYS 177          1HD       LYS 177   1.242 -16.744   7.486
  567    HD3  LYS 177          2HD       LYS 177   1.451 -15.118   6.799
  568    HE2  LYS 177          1HE       LYS 177   2.431 -15.088   8.983
  569    HE3  LYS 177          2HE       LYS 177   0.962 -14.113   9.013
  570    HZ1  LYS 177          1HZ       LYS 177   1.137 -15.582  10.953
  571    HZ2  LYS 177          2HZ       LYS 177   1.163 -16.911  10.010
  572    HZ3  LYS 177          3HZ       LYS 177  -0.183 -15.982  10.086
  573    H    MET 178           H        MET 178  -2.934 -14.848   7.728
  574    HA   MET 178           HA       MET 178  -4.486 -12.722   6.320
  575    HB2  MET 178          1HB       MET 178  -4.657 -13.548   9.229
  576    HB3  MET 178          2HB       MET 178  -5.445 -12.136   8.511
  577    HG2  MET 178          1HG       MET 178  -6.408 -13.820   6.767
  578    HG3  MET 178          2HG       MET 178  -5.967 -15.054   7.950
  579    HE1  MET 178          1HE       MET 178  -7.623 -11.510   7.689
  580    HE2  MET 178          2HE       MET 178  -8.619 -12.596   6.703
  581    HE3  MET 178          3HE       MET 178  -9.296 -11.871   8.177
  582    H    VAL 179           H        VAL 179  -4.155 -10.593   6.615
  583    HA   VAL 179           HA       VAL 179  -1.686  -9.720   8.027
  584    HB   VAL 179           HB       VAL 179  -0.998  -8.330   6.188
  585   HG11  VAL 179          1HG1      VAL 179  -0.121 -10.016   4.735
  586   HG12  VAL 179          2HG1      VAL 179  -0.165 -10.646   6.390
  587   HG13  VAL 179          3HG1      VAL 179  -1.378 -11.181   5.201
  588   HG21  VAL 179          1HG2      VAL 179  -1.919  -8.594   3.904
  589   HG22  VAL 179          2HG2      VAL 179  -3.255  -9.559   4.558
  590   HG23  VAL 179          3HG2      VAL 179  -3.068  -7.847   5.017
  591    H    GLU 180           H        GLU 180  -1.611  -7.678   8.737
  592    HA   GLU 180           HA       GLU 180  -4.267  -6.385   9.169
  593    HB2  GLU 180          1HB       GLU 180  -2.758  -7.038  11.112
  594    HB3  GLU 180          2HB       GLU 180  -1.638  -5.787  10.556
  595    HG2  GLU 180          1HG       GLU 180  -3.577  -4.138  10.715
  596    HG3  GLU 180          2HG       GLU 180  -4.544  -5.437  11.409
  597    H    CYS 181           H        CYS 181  -4.787  -4.657   7.969
  598    HA   CYS 181           HA       CYS 181  -2.634  -2.986   6.786
  599    HB2  CYS 181          1HB       CYS 181  -5.492  -3.351   5.875
  600    HB3  CYS 181          2HB       CYS 181  -4.325  -2.221   5.174
  601    HG   CYS 181           HG       CYS 181  -4.488  -4.299   3.612
  602    H    LYS 182           H        LYS 182  -2.390  -0.948   7.307
  603    HA   LYS 182           HA       LYS 182  -4.365   0.543   8.993
  604    HB2  LYS 182          1HB       LYS 182  -1.427   0.059   9.680
  605    HB3  LYS 182          2HB       LYS 182  -2.492   1.165  10.542
  606    HG2  LYS 182          1HG       LYS 182  -3.870  -0.636  11.344
  607    HG3  LYS 182          2HG       LYS 182  -3.037  -1.825  10.339
  608    HD2  LYS 182          1HD       LYS 182  -1.615  -0.283  12.538
  609    HD3  LYS 182          2HD       LYS 182  -2.431  -1.829  12.773
  610    HE2  LYS 182          1HE       LYS 182  -0.992  -2.648  10.733
  611    HE3  LYS 182          2HE       LYS 182   0.030  -1.247  11.091
  612    HZ1  LYS 182          1HZ       LYS 182  -0.675  -3.448  12.971
  613    HZ2  LYS 182          2HZ       LYS 182   0.292  -2.163  13.364
  614    HZ3  LYS 182          3HZ       LYS 182   0.761  -3.283  12.257
  615    H    LYS 183           H        LYS 183  -3.961   2.901   8.981
  616    HA   LYS 183           HA       LYS 183  -2.818   3.967   6.540
  617    HB2  LYS 183          1HB       LYS 183  -3.500   5.298   9.195
  618    HB3  LYS 183          2HB       LYS 183  -2.876   6.165   7.787
  619    HG2  LYS 183          1HG       LYS 183  -4.806   5.389   6.433
  620    HG3  LYS 183          2HG       LYS 183  -5.483   4.581   7.864
  621    HD2  LYS 183          1HD       LYS 183  -5.621   6.737   9.049
  622    HD3  LYS 183          2HD       LYS 183  -4.838   7.558   7.684
  623    HE2  LYS 183          1HE       LYS 183  -6.724   6.883   6.207
  624    HE3  LYS 183          2HE       LYS 183  -7.535   6.151   7.600
  625    HZ1  LYS 183          1HZ       LYS 183  -7.594   8.353   8.638
  626    HZ2  LYS 183          2HZ       LYS 183  -8.329   8.391   7.174
  627    HZ3  LYS 183          3HZ       LYS 183  -6.827   9.031   7.356
  628    H    ALA 184           H        ALA 184  -0.781   4.628   6.006
  629    HA   ALA 184           HA       ALA 184   1.429   3.865   7.713
  630    HB1  ALA 184          1HB       ALA 184   1.383   5.512   5.162
  631    HB2  ALA 184          2HB       ALA 184   2.822   4.812   5.931
  632    HB3  ALA 184          3HB       ALA 184   1.561   3.748   5.272
  633    H    GLN 185           H        GLN 185   2.078   4.922   9.433
  634    HA   GLN 185           HA       GLN 185   1.383   7.603  10.110
  635    HB2  GLN 185          1HB       GLN 185   3.455   5.697  11.259
  636    HB3  GLN 185          2HB       GLN 185   3.030   7.248  11.989
  637    HG2  GLN 185          1HG       GLN 185   0.682   6.537  12.237
  638    HG3  GLN 185          2HG       GLN 185   1.032   4.993  11.466
  639   HE21  GLN 185          1HE2      GLN 185   1.909   6.989  14.330
  640   HE22  GLN 185          2HE2      GLN 185   2.448   5.618  15.298
  641    HA   PRO 186           HA       PRO 186   4.130   9.966   7.800
  642    HB2  PRO 186          1HB       PRO 186   4.185  12.352   9.060
  643    HB3  PRO 186          2HB       PRO 186   2.684  11.582   8.473
  644    HG2  PRO 186          1HG       PRO 186   3.834  11.430  11.296
  645    HG3  PRO 186          2HG       PRO 186   2.196  11.999  10.813
  646    HD2  PRO 186          1HD       PRO 186   2.639   9.437  11.560
  647    HD3  PRO 186          2HD       PRO 186   1.519   9.817  10.221
  648    H    LYS 187           H        LYS 187   5.714   8.290   9.294
  649    HA   LYS 187           HA       LYS 187   7.849   7.732   9.915
  650    HB2  LYS 187          1HB       LYS 187   8.431   9.950   7.934
  651    HB3  LYS 187          2HB       LYS 187   9.688   8.922   8.626
  652    HG2  LYS 187          1HG       LYS 187   8.489   6.903   7.823
  653    HG3  LYS 187          2HG       LYS 187   7.311   7.939   7.000
  654    HD2  LYS 187          1HD       LYS 187  10.314   7.894   6.454
  655    HD3  LYS 187          2HD       LYS 187   9.099   7.003   5.525
  656    HE2  LYS 187          1HE       LYS 187   7.977   9.126   4.916
  657    HE3  LYS 187          2HE       LYS 187   9.194  10.040   5.820
  658    HZ1  LYS 187          1HZ       LYS 187  10.883   9.204   4.304
  659    HZ2  LYS 187          2HZ       LYS 187   9.700   9.902   3.422
  660    HZ3  LYS 187          3HZ       LYS 187   9.806   8.267   3.507
  661    H    GLU 188           H        GLU 188   7.019  10.805  10.977
  662    HA   GLU 188           HA       GLU 188   9.336  11.439  12.575
  663    HB2  GLU 188          1HB       GLU 188   6.383  11.981  13.101
  664    HB3  GLU 188          2HB       GLU 188   7.695  12.702  14.020
  665    HG2  GLU 188          1HG       GLU 188   7.207  13.094  11.036
  666    HG3  GLU 188          2HG       GLU 188   6.740  14.211  12.306
  667    H    VAL 189           H        VAL 189   6.698   9.207  13.084
  668    HA   VAL 189           HA       VAL 189   7.287   8.478  15.786
  669    HB   VAL 189           HB       VAL 189   5.668   6.787  15.580
  670   HG11  VAL 189          1HG1      VAL 189   4.702   9.005  13.706
  671   HG12  VAL 189          2HG1      VAL 189   3.749   8.002  14.810
  672   HG13  VAL 189          3HG1      VAL 189   4.873   9.187  15.468
  673   HG21  VAL 189          1HG2      VAL 189   4.678   6.050  13.467
  674   HG22  VAL 189          2HG2      VAL 189   5.780   7.091  12.542
  675   HG23  VAL 189          3HG2      VAL 189   6.401   5.702  13.471
  676    H    MET 190           H        MET 190   9.224   7.848  13.121
  677    HA   MET 190           HA       MET 190  10.274   5.249  13.942
  678    HB2  MET 190          1HB       MET 190  11.453   7.472  12.235
  679    HB3  MET 190          2HB       MET 190  12.182   5.883  12.473
  680    HG2  MET 190          1HG       MET 190  10.377   4.759  11.366
  681    HG3  MET 190          2HG       MET 190   9.387   6.214  11.339
  682    HE1  MET 190          1HE       MET 190  13.172   5.657   8.709
  683    HE2  MET 190          2HE       MET 190  13.296   6.089  10.423
  684    HE3  MET 190          3HE       MET 190  12.637   4.503   9.951
  685    H    SER 191           H        SER 191  10.496   8.390  15.290
  686    HA   SER 191           HA       SER 191  13.023   8.394  16.569
  687    HB2  SER 191          1HB       SER 191  11.562  10.330  16.526
  688    HB3  SER 191          2HB       SER 191  10.309   9.460  17.430
  689    HG   SER 191           HG       SER 191  11.617  10.882  18.722
  690    HA   PRO 192           HA       PRO 192  12.757   5.077  19.590
  691    HB2  PRO 192          1HB       PRO 192  13.951   7.103  21.495
  692    HB3  PRO 192          2HB       PRO 192  14.404   5.385  21.252
  693    HG2  PRO 192          1HG       PRO 192  15.887   7.322  20.104
  694    HG3  PRO 192          2HG       PRO 192  15.421   5.886  19.133
  695    HD2  PRO 192          1HD       PRO 192  14.150   8.633  19.159
  696    HD3  PRO 192          2HD       PRO 192  14.583   7.597  17.765
  697    H    THR 193           H        THR 193  11.296   8.192  20.301
  698    HA   THR 193           HA       THR 193   9.717   7.306  22.556
  699    HB   THR 193           HB       THR 193   8.660   9.346  22.582
  700    HG1  THR 193          1HG       THR 193   8.602  10.737  20.831
  701   HG21  THR 193          1HG2      THR 193  11.129   9.562  23.012
  702   HG22  THR 193          2HG2      THR 193  10.363  11.048  22.428
  703   HG23  THR 193          3HG2      THR 193  11.344  10.069  21.321
  704    H    GLY 194           H        GLY 194   9.345   6.686  19.215
  705    HA2  GLY 194          1HA       GLY 194   6.534   5.719  19.645
  706    HA3  GLY 194          2HA       GLY 194   6.993   6.683  18.244
  707    H    SER 195           H        SER 195   9.680   4.913  18.350
  708    HA   SER 195           HA       SER 195   9.001   3.324  16.171
  709    HB2  SER 195          1HB       SER 195  11.207   2.304  16.427
  710    HB3  SER 195          2HB       SER 195  11.268   4.056  16.680
  711    HG   SER 195           HG       SER 195  12.445   2.782  18.263
  712    H    ALA 196           H        ALA 196   8.591   2.442  19.512
  713    HA   ALA 196           HA       ALA 196   8.122  -0.405  19.009
  714    HB1  ALA 196          1HB       ALA 196   7.553   1.349  21.437
  715    HB2  ALA 196          2HB       ALA 196   7.473  -0.427  21.381
  716    HB3  ALA 196          3HB       ALA 196   9.027   0.394  21.155
  717    H    ARG 197           H        ARG 197   6.706   0.683  17.120
  718    HA   ARG 197           HA       ARG 197   4.729   1.122  16.116
  719    HB2  ARG 197          1HB       ARG 197   3.092  -0.597  16.266
  720    HB3  ARG 197          2HB       ARG 197   4.700  -1.299  16.380
  721    HG2  ARG 197          1HG       ARG 197   4.403  -1.575  18.851
  722    HG3  ARG 197          2HG       ARG 197   2.794  -0.850  18.723
  723    HD2  ARG 197          1HD       ARG 197   2.350  -3.122  18.756
  724    HD3  ARG 197          2HD       ARG 197   2.275  -2.747  17.039
  725    HE   ARG 197           HE       ARG 197   4.571  -3.677  16.791
  726   HH11  ARG 197          1HH1      ARG 197   2.893  -4.715  19.709
  727   HH12  ARG 197          2HH1      ARG 197   3.920  -6.116  19.860
  728   HH21  ARG 197          1HH2      ARG 197   5.769  -5.321  17.056
  729   HH22  ARG 197          2HH2      ARG 197   5.555  -6.475  18.377
  730    H    GLY 198           H        GLY 198   5.150   2.999  18.095
  731    HA2  GLY 198          1HA       GLY 198   2.743   3.380  19.709
  732    HA3  GLY 198          2HA       GLY 198   4.180   4.389  19.680
  733    H    ARG 199           H        ARG 199   1.898   5.604  19.949
  734    HA   ARG 199           HA       ARG 199   1.598   7.231  17.489
  735    HB2  ARG 199          1HB       ARG 199  -0.744   6.144  19.129
  736    HB3  ARG 199          2HB       ARG 199  -0.849   7.531  18.053
  737    HG2  ARG 199          1HG       ARG 199  -1.638   5.866  16.688
  738    HG3  ARG 199          2HG       ARG 199   0.036   6.000  16.192
  739    HD2  ARG 199          1HD       ARG 199   0.125   4.019  18.184
  740    HD3  ARG 199          2HD       ARG 199  -1.452   3.766  17.443
  741    HE   ARG 199           HE       ARG 199   0.883   4.039  15.628
  742   HH11  ARG 199          1HH1      ARG 199  -1.178   1.699  17.224
  743   HH12  ARG 199          2HH1      ARG 199  -0.701   0.425  16.139
  744   HH21  ARG 199          1HH2      ARG 199   1.404   2.459  14.291
  745   HH22  ARG 199          2HH2      ARG 199   0.817   0.836  14.524
  746    H    SER 200           H        SER 200   1.139   9.390  17.827
  747    HA   SER 200           HA       SER 200   2.368  10.622  20.079
  748    HB2  SER 200          1HB       SER 200   0.543  11.802  17.949
  749    HB3  SER 200          2HB       SER 200   1.531  12.734  19.091
  750    HG   SER 200           HG       SER 200   2.652  12.411  17.103
  751    H5'    G 201           H5'        G 201  10.960 -11.620  12.367
  752   H5''    G 201           H5"        G 201  11.196  -9.938  11.889
  753    H4'    G 201           H4'        G 201   8.789  -9.946  11.045
  754    H3'    G 201           H3'        G 201   8.498 -12.365  12.373
  755    H2'    G 201           H2'        G 201  10.135 -13.482  11.072
  756   HO2'    G 201           HO2        G 201   7.540 -13.898  10.024
  757    H1'    G 201           H1'        G 201   8.889 -12.169   8.642
  758    H8     G 201          8H          G 201   9.957 -13.334   6.658
  759    H1     G 201          1H          G 201  15.649 -13.998   9.606
  760    H21    G 201          1H2         G 201  15.475 -13.201  11.707
  761    H22    G 201          2H2         G 201  13.944 -12.549  12.265
  762   HO5'    G 201           HO5        G 201  10.501 -10.178  14.114
  763    H5'    U 202           H5'        U 202   7.196  -8.912  13.181
  764   H5''    U 202           H5"        U 202   5.445  -9.096  13.325
  765    H4'    U 202           H4'        U 202   6.897  -6.972  11.693
  766    H3'    U 202           H3'        U 202   6.442  -6.938  14.395
  767    H2'    U 202           H2'        U 202   4.136  -7.456  14.237
  768   HO2'    U 202           HO2        U 202   4.604  -4.936  14.927
  769    H1'    U 202           H1'        U 202   3.834  -5.426  12.023
  770    H3     U 202          3H          U 202  -0.609  -6.230  12.549
  771    H5     U 202          5H          U 202   1.031 -10.090  12.510
  772    H6     U 202          6H          U 202   3.256  -9.104  12.274
  773    H5'    A 203           H5'        A 203   7.802  -3.156  12.060
  774   H5''    A 203           H5"        A 203   9.020  -2.683  13.253
  775    H4'    A 203           H4'        A 203   8.656  -0.922  11.632
  776    H3'    A 203           H3'        A 203   8.631  -0.438  14.402
  777    H2'    A 203           H2'        A 203   6.218  -0.352  14.437
  778   HO2'    A 203           HO2        A 203   7.360   2.227  14.167
  779    H1'    A 203           H1'        A 203   6.616   1.260  11.889
  780    H8     A 203          8H          A 203   3.883  -0.892  13.691
  781    H61    A 203          1H6         A 203   0.133   2.822  10.252
  782    H62    A 203          2H6         A 203   0.078   1.583  11.515
  783    H2     A 203          2H          A 203   4.183   3.757   9.247
  784    H5'    G 204           H5'        G 204   9.728   2.303  10.286
  785   H5''    G 204           H5"        G 204   8.748   0.835  10.150
  786    H4'    G 204           H4'        G 204  10.705  -0.130   8.753
  787    H3'    G 204           H3'        G 204  12.095   2.119   9.487
  788    H2'    G 204           H2'        G 204  10.443   3.579   8.501
  789   HO2'    G 204           HO2        G 204  12.788   3.641   7.410
  790    H1'    G 204           H1'        G 204  10.632   1.738   6.120
  791    H8     G 204          8H          G 204   9.378   2.718   4.169
  792    H1     G 204          1H          G 204   5.324   6.057   7.888
  793    H21    G 204          1H2         G 204   5.849   5.710  10.042
  794    H22    G 204          2H2         G 204   7.080   4.525  10.453
  795    H5'    U 205           H5'        U 205  13.627  -0.280   5.452
  796   H5''    U 205           H5"        U 205  15.376  -0.103   5.524
  797    H4'    U 205           H4'        U 205  14.601  -0.339   3.213
  798    H3'    U 205           H3'        U 205  16.414   1.610   4.092
  799   HO3'    U 205           HO3        U 205  17.120   1.480   1.946
  800    H2'    U 205           H2'        U 205  14.846   3.370   3.983
  801   HO2'    U 205           HO2        U 205  15.968   3.209   1.346
  802    H1'    U 205           H1'        U 205  13.770   2.094   1.441
  803    H3     U 205          3H          U 205  10.827   5.488   0.716
  804    H5     U 205          5H          U 205  11.048   5.341   4.892
  805    H6     U 205          6H          U 205  12.619   3.478   4.705
  Start of MODEL    2
    1    H1   GLY 105          1H        GLY 105   2.866  19.763  -3.293
    2    H2   GLY 105          2H        GLY 105   2.815  20.644  -1.915
    3    H3   GLY 105          3H        GLY 105   2.021  21.167  -3.251
    4    HA2  GLY 105          1HA       GLY 105   0.453  20.258  -1.672
    5    HA3  GLY 105          2HA       GLY 105   0.503  19.310  -3.170
    6    H    SER 106           H        SER 106  -0.530  18.073  -1.042
    7    HA   SER 106           HA       SER 106   1.320  15.857  -0.556
    8    HB2  SER 106          1HB       SER 106   1.088  15.862   1.871
    9    HB3  SER 106          2HB       SER 106   1.893  17.334   1.321
   10    HG   SER 106           HG       SER 106   0.023  18.494   1.670
   11    H    HIS 107           H        HIS 107   0.253  14.023   0.540
   12    HA   HIS 107           HA       HIS 107  -2.678  13.884   0.571
   13    HB2  HIS 107          1HB       HIS 107  -2.839  12.136  -1.105
   14    HB3  HIS 107          2HB       HIS 107  -2.163  13.581  -1.825
   15    HD2  HIS 107          2HD       HIS 107  -0.226  13.075  -3.432
   16    HE1  HIS 107          1HE       HIS 107   1.212   9.417  -1.778
   17    HE2  HIS 107          2HE       HIS 107   1.506  11.103  -3.667
   18    H    MET 108           H        MET 108  -3.360  11.561   1.052
   19    HA   MET 108           HA       MET 108  -1.413  10.189   2.856
   20    HB2  MET 108          1HB       MET 108  -3.611  11.604   3.668
   21    HB3  MET 108          2HB       MET 108  -4.319  10.008   3.527
   22    HG2  MET 108          1HG       MET 108  -1.832  10.738   5.144
   23    HG3  MET 108          2HG       MET 108  -3.465  10.636   5.771
   24    HE1  MET 108          1HE       MET 108  -0.834   8.217   3.786
   25    HE2  MET 108          2HE       MET 108  -0.193   8.924   5.290
   26    HE3  MET 108          3HE       MET 108  -0.539   7.189   5.195
   27    H    LYS 109           H        LYS 109  -1.698   9.544   0.087
   28    HA   LYS 109           HA       LYS 109  -3.559   7.348  -0.242
   29    HB2  LYS 109          1HB       LYS 109  -1.301   8.263  -2.051
   30    HB3  LYS 109          2HB       LYS 109  -2.527   7.062  -2.456
   31    HG2  LYS 109          1HG       LYS 109  -4.270   8.864  -1.849
   32    HG3  LYS 109          2HG       LYS 109  -2.952  10.026  -2.001
   33    HD2  LYS 109          1HD       LYS 109  -3.916   8.062  -4.103
   34    HD3  LYS 109          2HD       LYS 109  -4.283   9.786  -4.084
   35    HE2  LYS 109          1HE       LYS 109  -2.088  10.422  -4.663
   36    HE3  LYS 109          2HE       LYS 109  -1.385   8.901  -4.104
   37    HZ1  LYS 109          1HZ       LYS 109  -1.499   9.025  -6.553
   38    HZ2  LYS 109          2HZ       LYS 109  -3.151   9.045  -6.480
   39    HZ3  LYS 109          3HZ       LYS 109  -2.303   7.754  -5.945
   40    H    LYS 110           H        LYS 110  -0.780   7.165   1.513
   41    HA   LYS 110           HA       LYS 110  -0.060   4.442   0.537
   42    HB2  LYS 110          1HB       LYS 110   1.685   6.239   0.555
   43    HB3  LYS 110          2HB       LYS 110   1.587   6.250   2.320
   44    HG2  LYS 110          1HG       LYS 110   2.262   3.838   2.348
   45    HG3  LYS 110          2HG       LYS 110   2.270   3.829   0.584
   46    HD2  LYS 110          1HD       LYS 110   4.545   4.033   1.242
   47    HD3  LYS 110          2HD       LYS 110   4.066   5.629   0.651
   48    HE2  LYS 110          1HE       LYS 110   3.682   6.354   3.022
   49    HE3  LYS 110          2HE       LYS 110   4.174   4.746   3.575
   50    HZ1  LYS 110          1HZ       LYS 110   5.937   6.651   2.128
   51    HZ2  LYS 110          2HZ       LYS 110   6.388   5.164   2.673
   52    HZ3  LYS 110          3HZ       LYS 110   5.981   6.316   3.735
   53    H    ILE 111           H        ILE 111  -0.327   2.677   1.687
   54    HA   ILE 111           HA       ILE 111  -0.978   2.854   4.612
   55    HB   ILE 111           HB       ILE 111  -2.072   0.696   4.451
   56   HG12  ILE 111          1HG1      ILE 111  -1.743   0.889   1.440
   57   HG13  ILE 111          2HG1      ILE 111  -0.839  -0.214   2.470
   58   HG21  ILE 111          1HG2      ILE 111  -3.364   2.797   4.219
   59   HG22  ILE 111          2HG2      ILE 111  -3.279   2.631   2.445
   60   HG23  ILE 111          3HG2      ILE 111  -4.131   1.420   3.428
   61   HD11  ILE 111          1HD1      ILE 111  -2.931  -1.347   3.139
   62   HD12  ILE 111          2HD1      ILE 111  -3.840  -0.308   2.008
   63   HD13  ILE 111          3HD1      ILE 111  -2.615  -1.432   1.400
   64    H    PHE 112           H        PHE 112  -0.163   1.321   5.942
   65    HA   PHE 112           HA       PHE 112   2.329  -0.131   5.210
   66    HB2  PHE 112          1HB       PHE 112   2.441   1.399   7.142
   67    HB3  PHE 112          2HB       PHE 112   1.044   0.627   7.871
   68    HD1  PHE 112          1HD       PHE 112   1.229  -1.729   8.776
   69    HD2  PHE 112          2HD       PHE 112   4.642   0.436   7.323
   70    HE1  PHE 112          1HE       PHE 112   2.712  -3.183  10.122
   71    HE2  PHE 112          2HE       PHE 112   6.137  -1.046   8.607
   72    HZ   PHE 112           HZ       PHE 112   5.188  -2.860  10.024
   73    H    VAL 113           H        VAL 113   2.286  -2.373   5.335
   74    HA   VAL 113           HA       VAL 113  -0.200  -3.752   6.218
   75    HB   VAL 113           HB       VAL 113   1.308  -4.456   3.688
   76   HG11  VAL 113          1HG1      VAL 113  -1.265  -5.544   4.915
   77   HG12  VAL 113          2HG1      VAL 113  -0.597  -5.998   3.330
   78   HG13  VAL 113          3HG1      VAL 113   0.290  -6.405   4.798
   79   HG21  VAL 113          1HG2      VAL 113   0.070  -2.398   3.321
   80   HG22  VAL 113          2HG2      VAL 113  -0.741  -3.733   2.510
   81   HG23  VAL 113          3HG2      VAL 113  -1.402  -3.109   4.042
   82    H    GLY 114           H        GLY 114   0.367  -4.906   7.933
   83    HA2  GLY 114          1HA       GLY 114   3.064  -6.220   8.036
   84    HA3  GLY 114          2HA       GLY 114   2.122  -5.735   9.436
   85    H    GLY 115           H        GLY 115   3.300  -8.333   8.801
   86    HA2  GLY 115          1HA       GLY 115   2.567 -10.392   9.696
   87    HA3  GLY 115          2HA       GLY 115   0.895 -10.026   9.270
   88    H    LEU 116           H        LEU 116   3.141  -9.407   6.739
   89    HA   LEU 116           HA       LEU 116   2.062 -11.423   4.946
   90    HB2  LEU 116          1HB       LEU 116   4.541  -9.655   4.807
   91    HB3  LEU 116          2HB       LEU 116   3.960 -10.628   3.471
   92    HG   LEU 116           HG       LEU 116   2.184  -8.494   4.725
   93   HD11  LEU 116          1HD1      LEU 116   4.304  -7.411   4.063
   94   HD12  LEU 116          2HD1      LEU 116   2.977  -6.945   2.989
   95   HD13  LEU 116          3HD1      LEU 116   4.183  -8.141   2.453
   96   HD21  LEU 116          1HD2      LEU 116   1.240 -10.225   3.091
   97   HD22  LEU 116          2HD2      LEU 116   2.357  -9.580   1.886
   98   HD23  LEU 116          3HD2      LEU 116   1.099  -8.530   2.570
   99    H    SER 117           H        SER 117   2.943 -13.402   4.343
  100    HA   SER 117           HA       SER 117   5.022 -14.657   5.961
  101    HB2  SER 117          1HB       SER 117   3.437 -16.134   5.027
  102    HB3  SER 117          2HB       SER 117   3.613 -15.453   3.403
  103    HG   SER 117           HG       SER 117   4.726 -17.509   3.862
  104    H    VAL 118           H        VAL 118   7.189 -14.961   5.500
  105    HA   VAL 118           HA       VAL 118   8.526 -13.099   3.801
  106    HB   VAL 118           HB       VAL 118  10.560 -14.033   4.419
  107   HG11  VAL 118          1HG1      VAL 118   9.262 -12.944   6.268
  108   HG12  VAL 118          2HG1      VAL 118   8.764 -14.562   6.820
  109   HG13  VAL 118          3HG1      VAL 118  10.477 -14.108   6.818
  110   HG21  VAL 118          1HG2      VAL 118  10.230 -16.408   3.926
  111   HG22  VAL 118          2HG2      VAL 118  10.822 -16.209   5.574
  112   HG23  VAL 118          3HG2      VAL 118   9.105 -16.560   5.292
  113    H    ASN 119           H        ASN 119   6.948 -15.931   2.838
  114    HA   ASN 119           HA       ASN 119   8.494 -16.216   0.318
  115    HB2  ASN 119          1HB       ASN 119   6.037 -17.626   1.434
  116    HB3  ASN 119          2HB       ASN 119   6.727 -17.963  -0.149
  117   HD21  ASN 119          1HD2      ASN 119   6.526 -19.554   2.521
  118   HD22  ASN 119          2HD2      ASN 119   8.158 -20.192   2.652
  119    H    THR 120           H        THR 120   5.988 -14.179   1.430
  120    HA   THR 120           HA       THR 120   4.506 -13.928  -1.076
  121    HB   THR 120           HB       THR 120   4.570 -12.120   1.366
  122    HG1  THR 120          1HG       THR 120   3.802 -14.059   1.944
  123   HG21  THR 120          1HG2      THR 120   2.282 -11.455   0.576
  124   HG22  THR 120          2HG2      THR 120   2.655 -12.206  -0.982
  125   HG23  THR 120          3HG2      THR 120   3.622 -10.837  -0.403
  126    H    THR 121           H        THR 121   4.859 -12.609  -2.754
  127    HA   THR 121           HA       THR 121   7.245 -10.892  -2.687
  128    HB   THR 121           HB       THR 121   7.438 -10.901  -4.907
  129    HG1  THR 121          1HG       THR 121   5.680 -11.464  -6.301
  130   HG21  THR 121          1HG2      THR 121   5.919 -13.509  -4.555
  131   HG22  THR 121          2HG2      THR 121   7.609 -13.236  -4.054
  132   HG23  THR 121          3HG2      THR 121   7.165 -13.124  -5.767
  133    H    VAL 122           H        VAL 122   7.333  -8.806  -3.715
  134    HA   VAL 122           HA       VAL 122   5.360  -6.969  -2.726
  135    HB   VAL 122           HB       VAL 122   7.774  -6.465  -3.207
  136   HG11  VAL 122          1HG1      VAL 122   6.852  -6.063  -6.087
  137   HG12  VAL 122          2HG1      VAL 122   8.444  -5.703  -5.402
  138   HG13  VAL 122          3HG1      VAL 122   7.909  -7.383  -5.533
  139   HG21  VAL 122          1HG2      VAL 122   7.338  -4.158  -3.821
  140   HG22  VAL 122          2HG2      VAL 122   5.727  -4.580  -4.423
  141   HG23  VAL 122          3HG2      VAL 122   6.090  -4.737  -2.691
  142    H    GLU 123           H        GLU 123   5.616  -8.687  -5.785
  143    HA   GLU 123           HA       GLU 123   3.519  -7.150  -7.112
  144    HB2  GLU 123          1HB       GLU 123   4.772  -9.841  -7.808
  145    HB3  GLU 123          2HB       GLU 123   3.636  -8.930  -8.816
  146    HG2  GLU 123          1HG       GLU 123   5.257  -7.010  -8.832
  147    HG3  GLU 123          2HG       GLU 123   6.422  -8.024  -7.975
  148    H    ASP 124           H        ASP 124   3.637 -10.198  -5.210
  149    HA   ASP 124           HA       ASP 124   0.911 -10.984  -5.540
  150    HB2  ASP 124          1HB       ASP 124   2.644 -11.150  -3.049
  151    HB3  ASP 124          2HB       ASP 124   1.084 -11.916  -3.235
  152    H    VAL 125           H        VAL 125   2.372  -8.686  -3.236
  153    HA   VAL 125           HA       VAL 125  -0.088  -7.988  -1.910
  154    HB   VAL 125           HB       VAL 125   2.591  -6.544  -2.070
  155   HG11  VAL 125          1HG1      VAL 125   1.872  -5.349  -0.032
  156   HG12  VAL 125          2HG1      VAL 125   0.830  -4.946  -1.400
  157   HG13  VAL 125          3HG1      VAL 125   0.262  -6.089  -0.159
  158   HG21  VAL 125          1HG2      VAL 125   1.332  -8.396   0.004
  159   HG22  VAL 125          2HG2      VAL 125   2.739  -8.757  -1.009
  160   HG23  VAL 125          3HG2      VAL 125   2.851  -7.510   0.235
  161    H    LYS 126           H        LYS 126   1.754  -6.306  -4.532
  162    HA   LYS 126           HA       LYS 126  -0.122  -4.179  -4.841
  163    HB2  LYS 126          1HB       LYS 126   2.180  -4.186  -5.753
  164    HB3  LYS 126          2HB       LYS 126   1.712  -5.397  -6.958
  165    HG2  LYS 126          1HG       LYS 126   0.151  -3.840  -7.999
  166    HG3  LYS 126          2HG       LYS 126   0.350  -2.694  -6.668
  167    HD2  LYS 126          1HD       LYS 126   2.837  -2.579  -7.328
  168    HD3  LYS 126          2HD       LYS 126   2.371  -3.388  -8.830
  169    HE2  LYS 126          1HE       LYS 126   1.215  -0.766  -7.761
  170    HE3  LYS 126          2HE       LYS 126   2.496  -0.867  -8.965
  171    HZ1  LYS 126          1HZ       LYS 126   0.214  -0.530  -9.869
  172    HZ2  LYS 126          2HZ       LYS 126  -0.226  -2.020  -9.404
  173    HZ3  LYS 126          3HZ       LYS 126   0.966  -1.846 -10.513
  174    H    HIS 127           H        HIS 127   0.001  -7.323  -6.592
  175    HA   HIS 127           HA       HIS 127  -2.333  -6.911  -8.165
  176    HB2  HIS 127          1HB       HIS 127  -0.566  -8.641  -8.519
  177    HB3  HIS 127          2HB       HIS 127  -1.164  -9.519  -7.107
  178    HD2  HIS 127          2HD       HIS 127  -2.343  -8.317 -10.597
  179    HE1  HIS 127          1HE       HIS 127  -4.797 -11.654  -9.558
  180    HE2  HIS 127          2HE       HIS 127  -4.246  -9.978 -11.396
  181    H    TYR 128           H        TYR 128  -2.019  -8.321  -4.849
  182    HA   TYR 128           HA       TYR 128  -4.784  -8.983  -4.645
  183    HB2  TYR 128          1HB       TYR 128  -3.245 -10.043  -3.187
  184    HB3  TYR 128          2HB       TYR 128  -2.709  -8.505  -2.520
  185    HD1  TYR 128          1HD       TYR 128  -4.074  -7.261  -0.859
  186    HD2  TYR 128          2HD       TYR 128  -5.417 -10.995  -2.562
  187    HE1  TYR 128          1HE       TYR 128  -5.819  -7.444   0.905
  188    HE2  TYR 128          2HE       TYR 128  -7.144 -11.186  -0.784
  189    HH   TYR 128           HH       TYR 128  -8.152 -10.174   0.995
  190    H    PHE 129           H        PHE 129  -3.118  -6.021  -3.458
  191    HA   PHE 129           HA       PHE 129  -5.586  -4.868  -2.594
  192    HB2  PHE 129          1HB       PHE 129  -2.845  -3.712  -2.907
  193    HB3  PHE 129          2HB       PHE 129  -4.229  -2.715  -2.492
  194    HD1  PHE 129          1HD       PHE 129  -5.709  -3.428  -0.461
  195    HD2  PHE 129          2HD       PHE 129  -1.739  -4.936  -1.168
  196    HE1  PHE 129          1HE       PHE 129  -5.573  -4.198   1.899
  197    HE2  PHE 129          2HE       PHE 129  -1.612  -5.704   1.187
  198    HZ   PHE 129           HZ       PHE 129  -3.528  -5.333   2.725
  199    H    GLU 130           H        GLU 130  -4.302  -4.963  -5.762
  200    HA   GLU 130           HA       GLU 130  -5.925  -2.891  -6.875
  201    HB2  GLU 130          1HB       GLU 130  -4.486  -5.269  -8.028
  202    HB3  GLU 130          2HB       GLU 130  -5.522  -4.265  -9.050
  203    HG2  GLU 130          1HG       GLU 130  -4.272  -2.275  -8.571
  204    HG3  GLU 130          2HG       GLU 130  -3.316  -3.086  -7.340
  205    H    GLN 131           H        GLN 131  -7.151  -5.611  -5.347
  206    HA   GLN 131           HA       GLN 131  -9.470  -5.996  -7.079
  207    HB2  GLN 131          1HB       GLN 131 -10.358  -7.332  -5.365
  208    HB3  GLN 131          2HB       GLN 131  -8.624  -7.640  -5.366
  209    HG2  GLN 131          1HG       GLN 131  -8.476  -5.946  -3.428
  210    HG3  GLN 131          2HG       GLN 131 -10.242  -5.988  -3.374
  211   HE21  GLN 131          1HE2      GLN 131  -7.320  -8.007  -3.121
  212   HE22  GLN 131          2HE2      GLN 131  -8.061  -9.265  -2.138
  213    H    PHE 132           H        PHE 132  -8.606  -3.685  -4.531
  214    HA   PHE 132           HA       PHE 132 -11.353  -2.715  -4.181
  215    HB2  PHE 132          1HB       PHE 132  -8.711  -1.701  -3.060
  216    HB3  PHE 132          2HB       PHE 132 -10.320  -1.263  -2.501
  217    HD1  PHE 132          1HD       PHE 132  -7.578  -3.393  -1.907
  218    HD2  PHE 132          2HD       PHE 132 -11.884  -3.344  -1.816
  219    HE1  PHE 132          1HE       PHE 132  -7.563  -5.334  -0.361
  220    HE2  PHE 132          2HE       PHE 132 -11.869  -5.300  -0.281
  221    HZ   PHE 132           HZ       PHE 132  -9.708  -6.297   0.448
  222    H    GLY 133           H        GLY 133  -8.680  -1.844  -6.177
  223    HA2  GLY 133          1HA       GLY 133  -9.887   0.205  -7.694
  224    HA3  GLY 133          2HA       GLY 133  -8.952   0.975  -6.402
  225    H    LYS 134           H        LYS 134  -7.536   1.810  -8.138
  226    HA   LYS 134           HA       LYS 134  -5.570  -0.210  -9.153
  227    HB2  LYS 134          1HB       LYS 134  -6.481   1.012 -10.920
  228    HB3  LYS 134          2HB       LYS 134  -6.288   2.555 -10.122
  229    HG2  LYS 134          1HG       LYS 134  -3.807   0.915 -10.790
  230    HG3  LYS 134          2HG       LYS 134  -4.684   1.760 -12.070
  231    HD2  LYS 134          1HD       LYS 134  -4.566   3.859 -10.746
  232    HD3  LYS 134          2HD       LYS 134  -3.455   3.064  -9.609
  233    HE2  LYS 134          1HE       LYS 134  -1.823   2.768 -11.418
  234    HE3  LYS 134          2HE       LYS 134  -2.992   3.399 -12.596
  235    HZ1  LYS 134          1HZ       LYS 134  -1.776   4.919 -10.348
  236    HZ2  LYS 134          2HZ       LYS 134  -3.026   5.482 -11.184
  237    HZ3  LYS 134          3HZ       LYS 134  -1.583   5.219 -11.954
  238    H    VAL 135           H        VAL 135  -3.413  -0.004  -8.762
  239    HA   VAL 135           HA       VAL 135  -2.650   1.592  -6.338
  240    HB   VAL 135           HB       VAL 135  -1.807  -1.200  -7.165
  241   HG11  VAL 135          1HG1      VAL 135  -0.532  -1.301  -5.085
  242   HG12  VAL 135          2HG1      VAL 135   0.108  -0.015  -6.109
  243   HG13  VAL 135          3HG1      VAL 135  -0.930   0.379  -4.724
  244   HG21  VAL 135          1HG2      VAL 135  -2.862  -1.877  -5.032
  245   HG22  VAL 135          2HG2      VAL 135  -3.344  -0.195  -4.719
  246   HG23  VAL 135          3HG2      VAL 135  -4.051  -1.095  -6.076
  247    H    ASP 136           H        ASP 136  -0.955   2.866  -6.486
  248    HA   ASP 136           HA       ASP 136   0.371   3.367  -9.029
  249    HB2  ASP 136          1HB       ASP 136   0.582   4.614  -6.270
  250    HB3  ASP 136          2HB       ASP 136   1.642   5.058  -7.596
  251    H    ASP 137           H        ASP 137   1.433   2.071  -5.870
  252    HA   ASP 137           HA       ASP 137   3.741   0.714  -7.074
  253    HB2  ASP 137          1HB       ASP 137   4.367   3.211  -6.776
  254    HB3  ASP 137          2HB       ASP 137   4.185   2.959  -5.043
  255    H    ALA 138           H        ALA 138   4.939  -0.505  -5.426
  256    HA   ALA 138           HA       ALA 138   3.936  -0.641  -2.698
  257    HB1  ALA 138          1HB       ALA 138   2.450  -2.267  -3.820
  258    HB2  ALA 138          2HB       ALA 138   3.862  -3.117  -4.483
  259    HB3  ALA 138          3HB       ALA 138   3.577  -3.093  -2.729
  260    H    MET 139           H        MET 139   5.436  -1.667  -1.248
  261    HA   MET 139           HA       MET 139   8.006  -2.687  -2.267
  262    HB2  MET 139          1HB       MET 139   9.384  -1.075  -1.026
  263    HB3  MET 139          2HB       MET 139   8.491  -0.329  -2.348
  264    HG2  MET 139          1HG       MET 139   6.824   0.548  -0.737
  265    HG3  MET 139          2HG       MET 139   7.728  -0.183   0.595
  266    HE1  MET 139          1HE       MET 139   8.221   3.675   1.090
  267    HE2  MET 139          2HE       MET 139   6.789   2.809   0.501
  268    HE3  MET 139          3HE       MET 139   7.731   2.157   1.865
  269    H    LEU 140           H        LEU 140   8.846  -4.225  -0.925
  270    HA   LEU 140           HA       LEU 140   7.729  -4.444   1.847
  271    HB2  LEU 140          1HB       LEU 140   9.094  -6.673   0.351
  272    HB3  LEU 140          2HB       LEU 140   8.176  -6.754   1.848
  273    HG   LEU 140           HG       LEU 140   7.102  -6.325  -0.967
  274   HD11  LEU 140          1HD1      LEU 140   7.669  -8.645  -0.359
  275   HD12  LEU 140          2HD1      LEU 140   5.914  -8.440  -0.508
  276   HD13  LEU 140          3HD1      LEU 140   6.657  -8.513   1.097
  277   HD21  LEU 140          1HD2      LEU 140   5.554  -6.297   1.652
  278   HD22  LEU 140          2HD2      LEU 140   4.838  -6.410   0.023
  279   HD23  LEU 140          3HD2      LEU 140   5.704  -4.956   0.491
  280    H    MET 141           H        MET 141   9.137  -4.762   3.603
  281    HA   MET 141           HA       MET 141  11.724  -3.429   3.140
  282    HB2  MET 141          1HB       MET 141  10.168  -4.026   5.663
  283    HB3  MET 141          2HB       MET 141  11.779  -3.287   5.646
  284    HG2  MET 141          1HG       MET 141   9.312  -2.176   4.260
  285    HG3  MET 141          2HG       MET 141  10.018  -1.572   5.748
  286    HE1  MET 141          1HE       MET 141  10.691   0.304   1.875
  287    HE2  MET 141          2HE       MET 141   9.811  -1.235   2.009
  288    HE3  MET 141          3HE       MET 141   9.333   0.160   3.011
  289    H    PHE 142           H        PHE 142  12.858  -4.925   2.073
  290    HA   PHE 142           HA       PHE 142  13.698  -7.427   3.196
  291    HB2  PHE 142          1HB       PHE 142  14.469  -5.910   0.761
  292    HB3  PHE 142          2HB       PHE 142  15.459  -7.238   1.325
  293    HD1  PHE 142          1HD       PHE 142  11.965  -6.408   0.260
  294    HD2  PHE 142          2HD       PHE 142  14.897  -9.490   0.918
  295    HE1  PHE 142          1HE       PHE 142  10.525  -8.037  -0.949
  296    HE2  PHE 142          2HE       PHE 142  13.454 -11.120  -0.284
  297    HZ   PHE 142           HZ       PHE 142  11.266 -10.395  -1.216
  298    H    ASP 143           H        ASP 143  15.383  -8.174   4.238
  299    HA   ASP 143           HA       ASP 143  17.458  -6.271   5.172
  300    HB2  ASP 143          1HB       ASP 143  16.592  -8.958   6.210
  301    HB3  ASP 143          2HB       ASP 143  18.139  -8.232   6.641
  302    H    LYS 144           H        LYS 144  19.454  -6.251   4.474
  303    HA   LYS 144           HA       LYS 144  20.073  -7.473   2.001
  304    HB2  LYS 144          1HB       LYS 144  20.936  -5.318   2.798
  305    HB3  LYS 144          2HB       LYS 144  21.919  -6.132   4.022
  306    HG2  LYS 144          1HG       LYS 144  23.238  -7.252   2.268
  307    HG3  LYS 144          2HG       LYS 144  22.227  -6.527   1.009
  308    HD2  LYS 144          1HD       LYS 144  23.966  -4.981   2.986
  309    HD3  LYS 144          2HD       LYS 144  24.430  -5.403   1.331
  310    HE2  LYS 144          1HE       LYS 144  22.483  -4.110   0.458
  311    HE3  LYS 144          2HE       LYS 144  22.067  -3.636   2.110
  312    HZ1  LYS 144          1HZ       LYS 144  24.234  -2.528   2.267
  313    HZ2  LYS 144          2HZ       LYS 144  23.386  -1.925   1.012
  314    HZ3  LYS 144          3HZ       LYS 144  24.615  -2.961   0.738
  315    H    THR 145           H        THR 145  21.067  -8.497   5.246
  316    HA   THR 145           HA       THR 145  22.976 -10.535   4.372
  317    HB   THR 145           HB       THR 145  22.608 -11.258   6.841
  318    HG1  THR 145          1HG       THR 145  21.626  -9.666   8.124
  319   HG21  THR 145          1HG2      THR 145  24.514  -9.845   6.121
  320   HG22  THR 145          2HG2      THR 145  23.925  -9.369   7.721
  321   HG23  THR 145          3HG2      THR 145  23.507  -8.390   6.295
  322    H    THR 146           H        THR 146  19.689 -10.637   5.867
  323    HA   THR 146           HA       THR 146  19.409 -13.452   5.529
  324    HB   THR 146           HB       THR 146  17.396 -13.382   6.559
  325    HG1  THR 146          1HG       THR 146  16.034 -11.570   6.512
  326   HG21  THR 146          1HG2      THR 146  18.491 -10.690   7.491
  327   HG22  THR 146          2HG2      THR 146  19.115 -12.268   8.029
  328   HG23  THR 146          3HG2      THR 146  17.441 -11.808   8.383
  329    H    ASN 147           H        ASN 147  18.824 -10.988   3.288
  330    HA   ASN 147           HA       ASN 147  17.813 -10.760   1.345
  331    HB2  ASN 147          1HB       ASN 147  18.102 -12.491  -0.378
  332    HB3  ASN 147          2HB       ASN 147  19.556 -12.072   0.501
  333   HD21  ASN 147          1HD2      ASN 147  20.632 -13.673   1.733
  334   HD22  ASN 147          2HD2      ASN 147  20.145 -15.357   1.630
  335    H    ARG 148           H        ARG 148  16.098 -11.417   3.537
  336    HA   ARG 148           HA       ARG 148  13.590 -11.905   1.997
  337    HB2  ARG 148          1HB       ARG 148  14.265 -12.977   4.772
  338    HB3  ARG 148          2HB       ARG 148  12.657 -13.000   4.064
  339    HG2  ARG 148          1HG       ARG 148  15.078 -14.491   2.965
  340    HG3  ARG 148          2HG       ARG 148  13.769 -15.179   3.926
  341    HD2  ARG 148          1HD       ARG 148  12.149 -14.485   2.140
  342    HD3  ARG 148          2HD       ARG 148  13.514 -13.977   1.138
  343    HE   ARG 148           HE       ARG 148  14.359 -16.344   1.309
  344   HH11  ARG 148          1HH1      ARG 148  10.885 -15.756   1.421
  345   HH12  ARG 148          2HH1      ARG 148  10.531 -17.439   1.082
  346   HH21  ARG 148          1HH2      ARG 148  13.781 -18.435   0.789
  347   HH22  ARG 148          2HH2      ARG 148  12.096 -18.846   0.636
  348    H    HIS 149           H        HIS 149  11.685 -10.930   3.010
  349    HA   HIS 149           HA       HIS 149  12.352  -8.350   4.304
  350    HB2  HIS 149          1HB       HIS 149  10.083  -7.675   3.807
  351    HB3  HIS 149          2HB       HIS 149  10.902  -8.239   2.363
  352    HD2  HIS 149          2HD       HIS 149   9.737 -10.126   0.993
  353    HE1  HIS 149          1HE       HIS 149   6.510 -10.940   3.646
  354    HE2  HIS 149          2HE       HIS 149   7.449 -11.362   1.307
  355    H    ARG 150           H        ARG 150  11.238  -7.520   6.054
  356    HA   ARG 150           HA       ARG 150  11.103  -9.328   8.317
  357    HB2  ARG 150          1HB       ARG 150  10.559  -6.368   7.961
  358    HB3  ARG 150          2HB       ARG 150  10.249  -7.187   9.494
  359    HG2  ARG 150          1HG       ARG 150  12.597  -7.943   9.615
  360    HG3  ARG 150          2HG       ARG 150  12.942  -7.084   8.105
  361    HD2  ARG 150          1HD       ARG 150  13.652  -5.726   9.990
  362    HD3  ARG 150          2HD       ARG 150  12.296  -4.949   9.164
  363    HE   ARG 150           HE       ARG 150  11.442  -6.607  11.427
  364   HH11  ARG 150          1HH1      ARG 150  12.680  -3.416  10.703
  365   HH12  ARG 150          2HH1      ARG 150  11.786  -2.633  11.956
  366   HH21  ARG 150          1HH2      ARG 150  10.335  -5.711  12.923
  367   HH22  ARG 150          2HH2      ARG 150  10.365  -3.992  13.272
  368    H    GLY 151           H        GLY 151   8.819  -9.378   6.050
  369    HA2  GLY 151          1HA       GLY 151   6.688 -10.243   6.116
  370    HA3  GLY 151          2HA       GLY 151   6.692 -10.222   7.876
  371    H    PHE 152           H        PHE 152   7.475  -7.217   6.224
  372    HA   PHE 152           HA       PHE 152   4.682  -6.391   6.057
  373    HB2  PHE 152          1HB       PHE 152   4.896  -4.380   7.378
  374    HB3  PHE 152          2HB       PHE 152   5.220  -5.787   8.368
  375    HD1  PHE 152          1HD       PHE 152   7.397  -6.163   9.383
  376    HD2  PHE 152          2HD       PHE 152   6.719  -2.824   6.744
  377    HE1  PHE 152          1HE       PHE 152   9.468  -5.092  10.192
  378    HE2  PHE 152          2HE       PHE 152   8.802  -1.759   7.545
  379    HZ   PHE 152           HZ       PHE 152  10.210  -2.901   9.256
  380    H    GLY 153           H        GLY 153   4.350  -4.344   4.957
  381    HA2  GLY 153          1HA       GLY 153   6.605  -3.012   3.662
  382    HA3  GLY 153          2HA       GLY 153   5.614  -3.968   2.556
  383    H    PHE 154           H        PHE 154   5.519  -1.735   1.690
  384    HA   PHE 154           HA       PHE 154   3.152  -0.276   2.719
  385    HB2  PHE 154          1HB       PHE 154   5.619   0.818   1.367
  386    HB3  PHE 154          2HB       PHE 154   4.150   1.741   1.636
  387    HD1  PHE 154          1HD       PHE 154   7.022   0.104   3.318
  388    HD2  PHE 154          2HD       PHE 154   3.498   2.530   3.838
  389    HE1  PHE 154          1HE       PHE 154   7.805   0.751   5.571
  390    HE2  PHE 154          2HE       PHE 154   4.299   3.207   6.079
  391    HZ   PHE 154           HZ       PHE 154   6.455   2.316   6.957
  392    H    VAL 155           H        VAL 155   1.686   0.627   1.307
  393    HA   VAL 155           HA       VAL 155   1.870  -0.053  -1.577
  394    HB   VAL 155           HB       VAL 155  -0.679  -0.581  -0.044
  395   HG11  VAL 155          1HG1      VAL 155   0.248  -1.364  -2.827
  396   HG12  VAL 155          2HG1      VAL 155  -1.294  -1.835  -2.076
  397   HG13  VAL 155          3HG1      VAL 155  -0.979  -0.135  -2.424
  398   HG21  VAL 155          1HG2      VAL 155  -0.245  -2.991  -0.299
  399   HG22  VAL 155          2HG2      VAL 155   1.404  -2.627  -0.865
  400   HG23  VAL 155          3HG2      VAL 155   0.903  -2.231   0.796
  401    H    THR 156           H        THR 156   1.368   1.610  -2.854
  402    HA   THR 156           HA       THR 156  -0.103   3.907  -1.683
  403    HB   THR 156           HB       THR 156   1.738   4.231  -4.008
  404    HG1  THR 156          1HG       THR 156   3.331   4.783  -2.570
  405   HG21  THR 156          1HG2      THR 156   0.746   6.124  -1.829
  406   HG22  THR 156          2HG2      THR 156   0.186   6.091  -3.519
  407   HG23  THR 156          3HG2      THR 156   1.856   6.546  -3.155
  408    H    PHE 157           H        PHE 157  -1.976   4.595  -2.472
  409    HA   PHE 157           HA       PHE 157  -3.119   3.056  -4.650
  410    HB2  PHE 157          1HB       PHE 157  -4.225   4.660  -2.381
  411    HB3  PHE 157          2HB       PHE 157  -5.250   4.146  -3.709
  412    HD1  PHE 157          1HD       PHE 157  -2.802   2.740  -1.198
  413    HD2  PHE 157          2HD       PHE 157  -6.214   2.010  -3.730
  414    HE1  PHE 157          1HE       PHE 157  -3.015   0.458  -0.273
  415    HE2  PHE 157          2HE       PHE 157  -6.468  -0.244  -2.724
  416    HZ   PHE 157           HZ       PHE 157  -4.861  -1.025  -0.995
  417    H    GLU 158           H        GLU 158  -4.643   3.852  -6.161
  418    HA   GLU 158           HA       GLU 158  -3.847   6.095  -7.768
  419    HB2  GLU 158          1HB       GLU 158  -5.194   4.270  -8.654
  420    HB3  GLU 158          2HB       GLU 158  -6.466   4.577  -7.499
  421    HG2  GLU 158          1HG       GLU 158  -7.158   5.331  -9.659
  422    HG3  GLU 158          2HG       GLU 158  -7.039   6.695  -8.569
  423    H    SER 159           H        SER 159  -6.382   5.759  -5.284
  424    HA   SER 159           HA       SER 159  -6.568   8.714  -4.983
  425    HB2  SER 159          1HB       SER 159  -8.405   8.054  -6.429
  426    HB3  SER 159          2HB       SER 159  -8.887   6.779  -5.292
  427    HG   SER 159           HG       SER 159 -10.061   8.841  -5.145
  428    H    GLU 160           H        GLU 160  -6.965   9.451  -2.978
  429    HA   GLU 160           HA       GLU 160  -6.298   7.840  -0.688
  430    HB2  GLU 160          1HB       GLU 160  -5.877  10.289  -1.057
  431    HB3  GLU 160          2HB       GLU 160  -7.602  10.594  -0.841
  432    HG2  GLU 160          1HG       GLU 160  -7.517   9.782   1.454
  433    HG3  GLU 160          2HG       GLU 160  -5.848   9.228   1.227
  434    H    ASP 161           H        ASP 161  -9.351   8.558  -2.289
  435    HA   ASP 161           HA       ASP 161 -11.097   7.815  -0.127
  436    HB2  ASP 161          1HB       ASP 161 -11.490   7.914  -3.123
  437    HB3  ASP 161          2HB       ASP 161 -12.746   7.382  -2.016
  438    H    ILE 162           H        ILE 162  -9.258   5.807  -2.345
  439    HA   ILE 162           HA       ILE 162 -10.731   3.361  -1.672
  440    HB   ILE 162           HB       ILE 162  -7.917   3.568  -2.793
  441   HG12  ILE 162          1HG1      ILE 162  -9.259   4.737  -4.370
  442   HG13  ILE 162          2HG1      ILE 162  -8.888   3.137  -4.999
  443   HG21  ILE 162          1HG2      ILE 162  -8.365   1.362  -1.968
  444   HG22  ILE 162          2HG2      ILE 162  -9.978   1.323  -2.706
  445   HG23  ILE 162          3HG2      ILE 162  -8.524   1.282  -3.721
  446   HD11  ILE 162          1HD1      ILE 162 -11.198   2.377  -4.404
  447   HD12  ILE 162          2HD1      ILE 162 -11.566   4.017  -3.825
  448   HD13  ILE 162          3HD1      ILE 162 -11.192   3.743  -5.535
  449    H    VAL 163           H        VAL 163  -7.741   4.972  -0.521
  450    HA   VAL 163           HA       VAL 163  -6.791   2.932   1.179
  451    HB   VAL 163           HB       VAL 163  -6.645   5.972   1.487
  452   HG11  VAL 163          1HG1      VAL 163  -4.655   5.505   2.983
  453   HG12  VAL 163          2HG1      VAL 163  -6.230   5.183   3.706
  454   HG13  VAL 163          3HG1      VAL 163  -5.253   3.834   3.111
  455   HG21  VAL 163          1HG2      VAL 163  -4.720   3.872   0.436
  456   HG22  VAL 163          2HG2      VAL 163  -5.561   5.135  -0.500
  457   HG23  VAL 163          3HG2      VAL 163  -4.330   5.579   0.693
  458    H    GLU 164           H        GLU 164  -9.197   5.503   1.866
  459    HA   GLU 164           HA       GLU 164  -9.718   4.842   4.592
  460    HB2  GLU 164          1HB       GLU 164 -11.648   5.882   2.477
  461    HB3  GLU 164          2HB       GLU 164 -11.965   5.871   4.205
  462    HG2  GLU 164          1HG       GLU 164  -9.757   7.442   2.815
  463    HG3  GLU 164          2HG       GLU 164 -11.298   8.089   3.360
  464    H    LYS 165           H        LYS 165 -11.263   3.484   1.645
  465    HA   LYS 165           HA       LYS 165 -13.083   1.740   3.038
  466    HB2  LYS 165          1HB       LYS 165 -13.229   2.551   0.648
  467    HB3  LYS 165          2HB       LYS 165 -11.929   1.435   0.226
  468    HG2  LYS 165          1HG       LYS 165 -13.332  -0.481   0.977
  469    HG3  LYS 165          2HG       LYS 165 -14.625   0.656   1.415
  470    HD2  LYS 165          1HD       LYS 165 -14.605   1.455  -1.005
  471    HD3  LYS 165          2HD       LYS 165 -13.518   0.117  -1.382
  472    HE2  LYS 165          1HE       LYS 165 -16.336  -0.103  -0.210
  473    HE3  LYS 165          2HE       LYS 165 -15.914  -0.349  -1.905
  474    HZ1  LYS 165          1HZ       LYS 165 -14.957  -2.036   0.349
  475    HZ2  LYS 165          2HZ       LYS 165 -14.541  -2.247  -1.224
  476    HZ3  LYS 165          3HZ       LYS 165 -16.085  -2.458  -0.749
  477    H    VAL 166           H        VAL 166  -9.884   1.156   1.617
  478    HA   VAL 166           HA       VAL 166  -9.648  -1.629   2.295
  479    HB   VAL 166           HB       VAL 166  -7.475   0.445   1.850
  480   HG11  VAL 166          1HG1      VAL 166  -6.574  -1.646   2.872
  481   HG12  VAL 166          2HG1      VAL 166  -7.339  -2.581   1.567
  482   HG13  VAL 166          3HG1      VAL 166  -6.043  -1.425   1.206
  483   HG21  VAL 166          1HG2      VAL 166  -8.750  -1.517  -0.097
  484   HG22  VAL 166          2HG2      VAL 166  -9.077   0.207  -0.090
  485   HG23  VAL 166          3HG2      VAL 166  -7.459  -0.350  -0.468
  486    H    CYS 167           H        CYS 167  -8.614   1.313   4.045
  487    HA   CYS 167           HA       CYS 167  -7.480  -0.106   6.282
  488    HB2  CYS 167          1HB       CYS 167  -6.863   2.198   5.581
  489    HB3  CYS 167          2HB       CYS 167  -8.484   2.764   6.016
  490    HG   CYS 167           HG       CYS 167  -6.164   1.385   7.961
  491    H    GLU 168           H        GLU 168 -10.806   1.170   5.719
  492    HA   GLU 168           HA       GLU 168 -11.805   0.512   8.329
  493    HB2  GLU 168          1HB       GLU 168 -13.093   0.923   5.624
  494    HB3  GLU 168          2HB       GLU 168 -14.057   0.411   6.996
  495    HG2  GLU 168          1HG       GLU 168 -12.308   2.908   7.027
  496    HG3  GLU 168          2HG       GLU 168 -14.003   2.899   6.550
  497    H    ILE 169           H        ILE 169 -11.236  -1.602   5.531
  498    HA   ILE 169           HA       ILE 169 -12.623  -3.906   6.644
  499    HB   ILE 169           HB       ILE 169 -10.338  -3.690   4.662
  500   HG12  ILE 169          1HG1      ILE 169 -13.263  -4.438   4.156
  501   HG13  ILE 169          2HG1      ILE 169 -12.716  -2.772   4.082
  502   HG21  ILE 169          1HG2      ILE 169 -10.858  -6.050   4.049
  503   HG22  ILE 169          2HG2      ILE 169 -10.200  -5.883   5.660
  504   HG23  ILE 169          3HG2      ILE 169 -11.946  -6.145   5.450
  505   HD11  ILE 169          1HD1      ILE 169 -11.077  -3.373   2.304
  506   HD12  ILE 169          2HD1      ILE 169 -11.754  -5.019   2.284
  507   HD13  ILE 169          3HD1      ILE 169 -12.770  -3.637   1.850
  508    H    HIS 170           H        HIS 170  -9.422  -2.526   6.982
  509    HA   HIS 170           HA       HIS 170  -7.741  -2.668   8.445
  510    HB2  HIS 170          1HB       HIS 170  -9.581  -2.276  10.035
  511    HB3  HIS 170          2HB       HIS 170  -9.732  -4.007  10.293
  512    HD2  HIS 170          2HD       HIS 170  -6.098  -2.901  10.148
  513    HE1  HIS 170          1HE       HIS 170  -7.094  -3.052  14.285
  514    HE2  HIS 170          2HE       HIS 170  -5.180  -2.856  12.611
  515    H    PHE 171           H        PHE 171  -9.343  -5.858   8.753
  516    HA   PHE 171           HA       PHE 171  -6.696  -7.110   8.385
  517    HB2  PHE 171          1HB       PHE 171  -9.019  -8.116   9.941
  518    HB3  PHE 171          2HB       PHE 171  -7.784  -9.192   9.312
  519    HD1  PHE 171          1HD       PHE 171  -5.411  -9.020  10.015
  520    HD2  PHE 171          2HD       PHE 171  -8.474  -6.554  11.781
  521    HE1  PHE 171          1HE       PHE 171  -3.900  -8.509  11.919
  522    HE2  PHE 171          2HE       PHE 171  -6.953  -6.023  13.670
  523    HZ   PHE 171           HZ       PHE 171  -4.665  -7.002  13.745
  524    H    HIS 172           H        HIS 172  -6.095  -8.170   6.785
  525    HA   HIS 172           HA       HIS 172  -7.983  -8.968   4.595
  526    HB2  HIS 172          1HB       HIS 172  -5.312  -7.515   4.509
  527    HB3  HIS 172          2HB       HIS 172  -6.091  -8.199   3.100
  528    HD2  HIS 172          2HD       HIS 172  -6.674  -5.359   5.727
  529    HE1  HIS 172          1HE       HIS 172  -8.822  -4.306   2.225
  530    HE2  HIS 172          2HE       HIS 172  -8.063  -3.505   4.496
  531    H    GLU 173           H        GLU 173  -6.607 -10.468   2.967
  532    HA   GLU 173           HA       GLU 173  -4.786 -12.261   4.478
  533    HB2  GLU 173          1HB       GLU 173  -6.899 -13.253   4.898
  534    HB3  GLU 173          2HB       GLU 173  -7.382 -13.174   3.210
  535    HG2  GLU 173          1HG       GLU 173  -4.944 -14.776   4.108
  536    HG3  GLU 173          2HG       GLU 173  -6.563 -15.430   4.242
  537    H    ILE 174           H        ILE 174  -3.089 -12.944   3.382
  538    HA   ILE 174           HA       ILE 174  -3.122 -13.037   0.414
  539    HB   ILE 174           HB       ILE 174  -0.979 -11.564   1.997
  540   HG12  ILE 174          1HG1      ILE 174  -3.166 -10.491   0.168
  541   HG13  ILE 174          2HG1      ILE 174  -3.008 -10.203   1.900
  542   HG21  ILE 174          1HG2      ILE 174  -0.086 -12.758   0.013
  543   HG22  ILE 174          2HG2      ILE 174  -1.307 -11.970  -1.014
  544   HG23  ILE 174          3HG2      ILE 174  -0.028 -11.027  -0.225
  545   HD11  ILE 174          1HD1      ILE 174  -1.217  -9.100  -0.274
  546   HD12  ILE 174          2HD1      ILE 174  -2.309  -8.225   0.805
  547   HD13  ILE 174          3HD1      ILE 174  -0.859  -8.992   1.470
  548    H    ASN 175           H        ASN 175  -2.123 -14.818  -0.341
  549    HA   ASN 175           HA       ASN 175  -1.232 -16.902  -0.333
  550    HB2  ASN 175          1HB       ASN 175   0.969 -15.357   1.069
  551    HB3  ASN 175          2HB       ASN 175   1.176 -16.985   0.438
  552   HD21  ASN 175          1HD2      ASN 175   2.453 -14.431  -0.304
  553   HD22  ASN 175          2HD2      ASN 175   2.320 -14.403  -2.068
  554    H    ASN 176           H        ASN 176  -3.167 -16.774   1.619
  555    HA   ASN 176           HA       ASN 176  -4.053 -17.862   3.320
  556    HB2  ASN 176          1HB       ASN 176  -3.218 -19.826   1.989
  557    HB3  ASN 176          2HB       ASN 176  -1.830 -19.908   3.075
  558   HD21  ASN 176          1HD2      ASN 176  -2.416 -22.012   3.826
  559   HD22  ASN 176          2HD2      ASN 176  -3.833 -22.249   4.840
  560    H    LYS 177           H        LYS 177  -2.245 -15.730   3.916
  561    HA   LYS 177           HA       LYS 177  -2.137 -16.218   6.837
  562    HB2  LYS 177          1HB       LYS 177   0.025 -14.778   5.242
  563    HB3  LYS 177          2HB       LYS 177  -0.127 -14.687   6.997
  564    HG2  LYS 177          1HG       LYS 177   0.312 -17.247   5.454
  565    HG3  LYS 177          2HG       LYS 177   1.575 -16.278   6.218
  566    HD2  LYS 177          1HD       LYS 177   0.626 -16.624   8.427
  567    HD3  LYS 177          2HD       LYS 177  -0.722 -17.560   7.766
  568    HE2  LYS 177          1HE       LYS 177   2.208 -18.299   7.470
  569    HE3  LYS 177          2HE       LYS 177   1.141 -18.934   8.731
  570    HZ1  LYS 177          1HZ       LYS 177   0.760 -19.330   5.810
  571    HZ2  LYS 177          2HZ       LYS 177  -0.290 -19.837   6.950
  572    HZ3  LYS 177          3HZ       LYS 177   1.213 -20.477   6.883
  573    H    MET 178           H        MET 178  -2.631 -14.539   8.113
  574    HA   MET 178           HA       MET 178  -4.415 -12.556   6.839
  575    HB2  MET 178          1HB       MET 178  -5.426 -13.807   8.571
  576    HB3  MET 178          2HB       MET 178  -4.115 -13.475   9.708
  577    HG2  MET 178          1HG       MET 178  -4.814 -11.358  10.162
  578    HG3  MET 178          2HG       MET 178  -5.480 -11.083   8.555
  579    HE1  MET 178          1HE       MET 178  -7.584 -13.061   7.829
  580    HE2  MET 178          2HE       MET 178  -9.036 -12.353   8.569
  581    HE3  MET 178          3HE       MET 178  -7.823 -11.301   7.807
  582    H    VAL 179           H        VAL 179  -4.075 -10.443   6.774
  583    HA   VAL 179           HA       VAL 179  -1.634  -9.318   8.022
  584    HB   VAL 179           HB       VAL 179  -0.976  -8.150   6.079
  585   HG11  VAL 179          1HG1      VAL 179  -1.582 -10.991   5.187
  586   HG12  VAL 179          2HG1      VAL 179  -0.275  -9.916   4.650
  587   HG13  VAL 179          3HG1      VAL 179  -0.288 -10.515   6.316
  588   HG21  VAL 179          1HG2      VAL 179  -2.050  -8.415   3.871
  589   HG22  VAL 179          2HG2      VAL 179  -3.397  -9.282   4.635
  590   HG23  VAL 179          3HG2      VAL 179  -3.081  -7.571   5.027
  591    H    GLU 180           H        GLU 180  -1.540  -7.063   8.215
  592    HA   GLU 180           HA       GLU 180  -4.259  -5.890   8.767
  593    HB2  GLU 180          1HB       GLU 180  -2.868  -6.614  10.731
  594    HB3  GLU 180          2HB       GLU 180  -1.675  -5.397  10.263
  595    HG2  GLU 180          1HG       GLU 180  -3.593  -3.678  10.370
  596    HG3  GLU 180          2HG       GLU 180  -4.569  -4.957  11.093
  597    H    CYS 181           H        CYS 181  -4.774  -4.289   7.419
  598    HA   CYS 181           HA       CYS 181  -2.759  -2.448   6.280
  599    HB2  CYS 181          1HB       CYS 181  -4.473  -2.966   4.729
  600    HB3  CYS 181          2HB       CYS 181  -5.749  -2.747   5.928
  601    HG   CYS 181           HG       CYS 181  -5.513  -0.209   6.234
  602    H    LYS 182           H        LYS 182  -2.203  -0.579   7.126
  603    HA   LYS 182           HA       LYS 182  -3.981   0.988   8.877
  604    HB2  LYS 182          1HB       LYS 182  -2.187   1.224  10.630
  605    HB3  LYS 182          2HB       LYS 182  -3.001  -0.329  10.544
  606    HG2  LYS 182          1HG       LYS 182  -0.811  -0.850   8.959
  607    HG3  LYS 182          2HG       LYS 182  -0.130   0.337  10.054
  608    HD2  LYS 182          1HD       LYS 182  -1.638  -2.175  10.897
  609    HD3  LYS 182          2HD       LYS 182   0.113  -2.094  10.753
  610    HE2  LYS 182          1HE       LYS 182   0.328  -0.511  12.515
  611    HE3  LYS 182          2HE       LYS 182  -1.425  -0.213  12.575
  612    HZ1  LYS 182          1HZ       LYS 182  -0.693  -1.728  14.348
  613    HZ2  LYS 182          2HZ       LYS 182  -0.133  -2.802  13.238
  614    HZ3  LYS 182          3HZ       LYS 182  -1.741  -2.486  13.336
  615    H    LYS 183           H        LYS 183  -3.450   3.208   8.962
  616    HA   LYS 183           HA       LYS 183  -2.364   4.155   6.480
  617    HB2  LYS 183          1HB       LYS 183  -3.271   5.581   8.998
  618    HB3  LYS 183          2HB       LYS 183  -2.670   6.448   7.579
  619    HG2  LYS 183          1HG       LYS 183  -4.394   5.482   6.151
  620    HG3  LYS 183          2HG       LYS 183  -4.969   4.447   7.464
  621    HD2  LYS 183          1HD       LYS 183  -5.580   6.477   8.783
  622    HD3  LYS 183          2HD       LYS 183  -5.080   7.492   7.410
  623    HE2  LYS 183          1HE       LYS 183  -6.740   6.351   5.963
  624    HE3  LYS 183          2HE       LYS 183  -7.216   5.308   7.310
  625    HZ1  LYS 183          1HZ       LYS 183  -7.543   8.259   7.231
  626    HZ2  LYS 183          2HZ       LYS 183  -7.987   7.299   8.490
  627    HZ3  LYS 183          3HZ       LYS 183  -8.734   7.172   7.033
  628    H    ALA 184           H        ALA 184  -0.482   5.014   5.837
  629    HA   ALA 184           HA       ALA 184   1.837   4.289   7.326
  630    HB1  ALA 184          1HB       ALA 184   1.594   5.996   4.831
  631    HB2  ALA 184          2HB       ALA 184   3.084   5.272   5.472
  632    HB3  ALA 184          3HB       ALA 184   1.770   4.223   4.895
  633    H    GLN 185           H        GLN 185   2.819   5.307   8.914
  634    HA   GLN 185           HA       GLN 185   2.814   8.282   9.123
  635    HB2  GLN 185          1HB       GLN 185   2.416   6.165  11.242
  636    HB3  GLN 185          2HB       GLN 185   2.806   7.835  11.646
  637    HG2  GLN 185          1HG       GLN 185   0.737   8.663  10.951
  638    HG3  GLN 185          2HG       GLN 185   0.425   7.322   9.855
  639   HE21  GLN 185          1HE2      GLN 185  -0.367   5.285  10.680
  640   HE22  GLN 185          2HE2      GLN 185  -0.993   5.190  12.326
  641    HA   PRO 186           HA       PRO 186   7.164   8.135   9.234
  642    HB2  PRO 186          1HB       PRO 186   7.201  10.039  11.570
  643    HB3  PRO 186          2HB       PRO 186   8.027  10.174   9.988
  644    HG2  PRO 186          1HG       PRO 186   5.789  11.613  10.484
  645    HG3  PRO 186          2HG       PRO 186   5.989  10.793   8.899
  646    HD2  PRO 186          1HD       PRO 186   4.419   9.841  11.315
  647    HD3  PRO 186          2HD       PRO 186   3.922   9.928   9.601
  648    H    LYS 187           H        LYS 187   9.033   7.196  10.199
  649    HA   LYS 187           HA       LYS 187   8.565   5.375  12.358
  650    HB2  LYS 187          1HB       LYS 187  10.858   4.727  12.189
  651    HB3  LYS 187          2HB       LYS 187  10.196   4.899  10.570
  652    HG2  LYS 187          1HG       LYS 187  11.426   6.944  10.179
  653    HG3  LYS 187          2HG       LYS 187  11.824   7.107  11.894
  654    HD2  LYS 187          1HD       LYS 187  13.805   6.331  10.853
  655    HD3  LYS 187          2HD       LYS 187  13.140   4.983  11.776
  656    HE2  LYS 187          1HE       LYS 187  12.048   4.253   9.508
  657    HE3  LYS 187          2HE       LYS 187  13.164   5.408   8.765
  658    HZ1  LYS 187          1HZ       LYS 187  14.327   3.358   8.787
  659    HZ2  LYS 187          2HZ       LYS 187  13.778   2.947  10.271
  660    HZ3  LYS 187          3HZ       LYS 187  14.938   4.114  10.094
  661    H    GLU 188           H        GLU 188   9.378   8.628  12.487
  662    HA   GLU 188           HA       GLU 188  10.604   8.757  15.094
  663    HB2  GLU 188          1HB       GLU 188  10.728  10.607  13.484
  664    HB3  GLU 188          2HB       GLU 188   8.978  10.755  13.484
  665    HG2  GLU 188          1HG       GLU 188   9.879  12.548  14.760
  666    HG3  GLU 188          2HG       GLU 188   9.001  11.488  15.847
  667    H    VAL 189           H        VAL 189   7.193   8.804  14.037
  668    HA   VAL 189           HA       VAL 189   6.246   9.141  16.777
  669    HB   VAL 189           HB       VAL 189   4.144   9.449  16.101
  670   HG11  VAL 189          1HG1      VAL 189   4.114  10.943  14.207
  671   HG12  VAL 189          2HG1      VAL 189   5.644  11.162  15.068
  672   HG13  VAL 189          3HG1      VAL 189   5.600  10.243  13.544
  673   HG21  VAL 189          1HG2      VAL 189   3.105   8.743  13.989
  674   HG22  VAL 189          2HG2      VAL 189   4.596   7.901  13.526
  675   HG23  VAL 189          3HG2      VAL 189   3.656   7.364  14.938
  676    H    MET 190           H        MET 190   6.691   6.435  14.632
  677    HA   MET 190           HA       MET 190   5.494   4.469  16.448
  678    HB2  MET 190          1HB       MET 190   7.305   4.182  14.016
  679    HB3  MET 190          2HB       MET 190   6.510   2.841  14.847
  680    HG2  MET 190          1HG       MET 190   5.097   5.150  13.460
  681    HG3  MET 190          2HG       MET 190   5.290   3.526  12.814
  682    HE1  MET 190          1HE       MET 190   1.420   4.231  13.836
  683    HE2  MET 190          2HE       MET 190   2.585   5.559  13.640
  684    HE3  MET 190          3HE       MET 190   2.567   4.214  12.478
  685    H    SER 191           H        SER 191   8.496   6.057  16.275
  686    HA   SER 191           HA       SER 191  10.436   6.019  17.294
  687    HB2  SER 191          1HB       SER 191   9.392   5.644  19.418
  688    HB3  SER 191          2HB       SER 191   9.408   3.886  19.152
  689    HG   SER 191           HG       SER 191  11.214   4.539  20.377
  690    HA   PRO 192           HA       PRO 192  12.624   2.750  15.047
  691    HB2  PRO 192          1HB       PRO 192  15.025   4.040  16.321
  692    HB3  PRO 192          2HB       PRO 192  14.757   3.595  14.608
  693    HG2  PRO 192          1HG       PRO 192  14.593   6.184  15.388
  694    HG3  PRO 192          2HG       PRO 192  13.372   5.515  14.252
  695    HD2  PRO 192          1HD       PRO 192  13.133   5.861  17.262
  696    HD3  PRO 192          2HD       PRO 192  11.995   6.348  15.968
  697    H    THR 193           H        THR 193  12.762   3.409  18.482
  698    HA   THR 193           HA       THR 193  14.360   1.060  19.132
  699    HB   THR 193           HB       THR 193  14.637   1.753  21.241
  700    HG1  THR 193          1HG       THR 193  13.281   3.173  22.318
  701   HG21  THR 193          1HG2      THR 193  15.197   4.101  21.276
  702   HG22  THR 193          2HG2      THR 193  14.123   4.447  19.905
  703   HG23  THR 193          3HG2      THR 193  15.588   3.463  19.671
  704    H    GLY 194           H        GLY 194  13.796  -0.532  20.758
  705    HA2  GLY 194          1HA       GLY 194  11.130  -1.098  21.549
  706    HA3  GLY 194          2HA       GLY 194  11.479  -2.034  20.094
  707    H    SER 195           H        SER 195  10.852  -3.351  22.365
  708    HA   SER 195           HA       SER 195  13.219  -4.981  22.913
  709    HB2  SER 195          1HB       SER 195  13.086  -4.794  25.344
  710    HB3  SER 195          2HB       SER 195  13.447  -3.224  24.619
  711    HG   SER 195           HG       SER 195  11.841  -3.063  26.242
  712    H    ALA 196           H        ALA 196  12.672  -6.913  24.215
  713    HA   ALA 196           HA       ALA 196  11.546  -8.847  24.415
  714    HB1  ALA 196          1HB       ALA 196   9.283  -7.024  25.298
  715    HB2  ALA 196          2HB       ALA 196   9.517  -8.726  25.745
  716    HB3  ALA 196          3HB       ALA 196  10.680  -7.504  26.289
  717    H    ARG 197           H        ARG 197  11.493  -7.894  21.721
  718    HA   ARG 197           HA       ARG 197   8.975  -8.269  20.418
  719    HB2  ARG 197          1HB       ARG 197  10.929  -7.093  19.469
  720    HB3  ARG 197          2HB       ARG 197  11.816  -8.617  19.363
  721    HG2  ARG 197          1HG       ARG 197  10.158  -9.481  17.732
  722    HG3  ARG 197          2HG       ARG 197   9.237  -7.975  17.856
  723    HD2  ARG 197          1HD       ARG 197  12.126  -8.215  16.905
  724    HD3  ARG 197          2HD       ARG 197  10.734  -8.117  15.839
  725    HE   ARG 197           HE       ARG 197  11.980  -5.931  17.349
  726   HH11  ARG 197          1HH1      ARG 197   9.090  -6.823  15.481
  727   HH12  ARG 197          2HH1      ARG 197   8.760  -5.115  15.190
  728   HH21  ARG 197          1HH2      ARG 197  11.323  -3.802  16.855
  729   HH22  ARG 197          2HH2      ARG 197   9.856  -3.608  15.895
  730    H    GLY 198           H        GLY 198   7.982 -10.017  19.496
  731    HA2  GLY 198          1HA       GLY 198   8.193 -12.485  20.816
  732    HA3  GLY 198          2HA       GLY 198   7.234 -12.176  19.370
  733    H    ARG 199           H        ARG 199  10.120 -11.562  18.130
  734    HA   ARG 199           HA       ARG 199  10.955 -14.398  17.605
  735    HB2  ARG 199          1HB       ARG 199  11.129 -11.993  15.754
  736    HB3  ARG 199          2HB       ARG 199  11.716 -13.604  15.376
  737    HG2  ARG 199          1HG       ARG 199   8.786 -12.912  15.842
  738    HG3  ARG 199          2HG       ARG 199   9.584 -13.010  14.281
  739    HD2  ARG 199          1HD       ARG 199   8.424 -15.041  14.523
  740    HD3  ARG 199          2HD       ARG 199  10.139 -15.421  14.749
  741    HE   ARG 199           HE       ARG 199   8.829 -14.867  17.275
  742   HH11  ARG 199          1HH1      ARG 199   9.102 -17.495  14.972
  743   HH12  ARG 199          2HH1      ARG 199   8.893 -18.698  16.217
  744   HH21  ARG 199          1HH2      ARG 199   8.627 -16.359  18.755
  745   HH22  ARG 199          2HH2      ARG 199   8.597 -18.063  18.347
  746    H    SER 200           H        SER 200  11.913 -12.127  19.566
  747    HA   SER 200           HA       SER 200  14.701 -11.673  18.947
  748    HB2  SER 200          1HB       SER 200  13.326 -10.262  20.468
  749    HB3  SER 200          2HB       SER 200  13.261 -11.606  21.626
  750    HG   SER 200           HG       SER 200  14.992 -10.124  22.083
  751    H5'    G 201           H5'        G 201   6.816 -12.314  14.780
  752   H5''    G 201           H5"        G 201   6.612 -10.597  15.147
  753    H4'    G 201           H4'        G 201   8.429 -10.898  13.555
  754    H3'    G 201           H3'        G 201   6.355  -9.085  13.153
  755    H2'    G 201           H2'        G 201   5.225 -10.462  11.613
  756   HO2'    G 201           HO2        G 201   7.038  -8.977   9.987
  757    H1'    G 201           H1'        G 201   7.990 -11.050  10.497
  758    H8     G 201          8H          G 201   8.114 -12.909   8.762
  759    H1     G 201          1H          G 201   1.941 -14.583   9.552
  760    H21    G 201          1H2         G 201   1.073 -13.375  11.252
  761    H22    G 201          2H2         G 201   2.095 -12.233  12.106
  762   HO5'    G 201           HO5        G 201   5.019 -12.115  13.308
  763    H5'    U 202           H5'        U 202   6.110  -7.029  13.089
  764   H5''    U 202           H5"        U 202   6.594  -6.808  11.397
  765    H4'    U 202           H4'        U 202   6.927  -4.337  11.995
  766    H3'    U 202           H3'        U 202   6.557  -5.090  14.618
  767    H2'    U 202           H2'        U 202   4.437  -6.056  14.293
  768   HO2'    U 202           HO2        U 202   4.172  -3.377  15.135
  769    H1'    U 202           H1'        U 202   3.556  -3.696  12.627
  770    H3     U 202          3H          U 202  -0.521  -5.711  12.452
  771    H5     U 202          5H          U 202   2.115  -8.894  11.753
  772    H6     U 202          6H          U 202   3.991  -7.356  12.007
  773    H5'    A 203           H5'        A 203   8.017  -2.655  11.634
  774   H5''    A 203           H5"        A 203   9.477  -2.205  12.529
  775    H4'    A 203           H4'        A 203   9.470  -1.029  10.481
  776    H3'    A 203           H3'        A 203   9.622   0.294  12.960
  777    H2'    A 203           H2'        A 203   7.500   1.219  12.983
  778   HO2'    A 203           HO2        A 203   9.299   2.874  11.949
  779    H1'    A 203           H1'        A 203   7.436   1.600  10.004
  780    H8     A 203          8H          A 203   5.344  -0.304  12.735
  781    H61    A 203          1H6         A 203   0.763   3.169  10.109
  782    H62    A 203          2H6         A 203   1.005   2.001  11.422
  783    H2     A 203          2H          A 203   4.377   4.037   8.097
  784    H5'    G 204           H5'        G 204  10.441   1.701   8.829
  785   H5''    G 204           H5"        G 204   9.680   0.183   8.369
  786    H4'    G 204           H4'        G 204  11.651  -0.224   6.811
  787    H3'    G 204           H3'        G 204  12.929   1.777   8.147
  788    H2'    G 204           H2'        G 204  11.228   3.364   7.616
  789   HO2'    G 204           HO2        G 204  13.337   3.797   5.760
  790    H1'    G 204           H1'        G 204  11.451   2.343   4.783
  791    H8     G 204          8H          G 204   9.881   3.586   3.221
  792    H1     G 204          1H          G 204   6.182   5.765   8.027
  793    H21    G 204          1H2         G 204   6.770   4.828   9.858
  794    H22    G 204          2H2         G 204   8.185   3.816   9.995
  795    H5'    U 205           H5'        U 205  16.202   2.518   3.726
  796   H5''    U 205           H5"        U 205  15.341   4.021   3.439
  797    H4'    U 205           H4'        U 205  14.045   1.257   3.415
  798    H3'    U 205           H3'        U 205  15.750   2.173   1.481
  799   HO3'    U 205           HO3        U 205  14.227   1.092  -0.031
  800    H2'    U 205           H2'        U 205  14.664   4.300   1.234
  801   HO2'    U 205           HO2        U 205  14.793   3.430  -0.902
  802    H1'    U 205           H1'        U 205  12.093   2.723   1.154
  803    H3     U 205          3H          U 205  12.068   7.773   2.951
  804    H5     U 205          5H          U 205   9.124   6.076   0.514
  805    H6     U 205          6H          U 205  10.466   4.042   0.368
  Start of MODEL    3
    1    H1   GLY 105          1H        GLY 105   1.600  21.732   0.903
    2    H2   GLY 105          2H        GLY 105   0.554  22.444   1.945
    3    H3   GLY 105          3H        GLY 105  -0.005  21.717   0.586
    4    HA2  GLY 105          1HA       GLY 105   1.296  20.352   2.856
    5    HA3  GLY 105          2HA       GLY 105  -0.441  20.323   2.496
    6    H    SER 106           H        SER 106  -0.160  17.973   2.485
    7    HA   SER 106           HA       SER 106   0.304  16.934  -0.216
    8    HB2  SER 106          1HB       SER 106   1.842  15.158   0.497
    9    HB3  SER 106          2HB       SER 106   2.560  16.761   0.679
   10    HG   SER 106           HG       SER 106   2.263  16.657   2.879
   11    H    HIS 107           H        HIS 107  -0.375  14.694  -0.466
   12    HA   HIS 107           HA       HIS 107  -2.875  14.135   0.952
   13    HB2  HIS 107          1HB       HIS 107  -3.158  12.416  -0.722
   14    HB3  HIS 107          2HB       HIS 107  -2.640  13.902  -1.491
   15    HD2  HIS 107          2HD       HIS 107  -0.946  13.465  -3.368
   16    HE1  HIS 107          1HE       HIS 107   0.860   9.866  -1.960
   17    HE2  HIS 107          2HE       HIS 107   0.804  11.557  -3.863
   18    H    MET 108           H        MET 108  -3.317  11.697   1.381
   19    HA   MET 108           HA       MET 108  -1.033  10.345   2.727
   20    HB2  MET 108          1HB       MET 108  -2.426   9.719   4.625
   21    HB3  MET 108          2HB       MET 108  -2.201  11.460   4.497
   22    HG2  MET 108          1HG       MET 108  -4.450  11.773   3.651
   23    HG3  MET 108          2HG       MET 108  -4.683  10.035   3.473
   24    HE1  MET 108          1HE       MET 108  -3.101  12.039   6.590
   25    HE2  MET 108          2HE       MET 108  -4.411  13.055   5.943
   26    HE3  MET 108          3HE       MET 108  -4.582  12.285   7.535
   27    H    LYS 109           H        LYS 109  -1.794   9.772   0.152
   28    HA   LYS 109           HA       LYS 109  -3.655   7.570  -0.007
   29    HB2  LYS 109          1HB       LYS 109  -1.537   8.422  -2.011
   30    HB3  LYS 109          2HB       LYS 109  -2.882   7.319  -2.307
   31    HG2  LYS 109          1HG       LYS 109  -4.481   9.178  -1.787
   32    HG3  LYS 109          2HG       LYS 109  -3.106  10.287  -1.733
   33    HD2  LYS 109          1HD       LYS 109  -2.486   9.460  -4.062
   34    HD3  LYS 109          2HD       LYS 109  -4.013   8.555  -4.057
   35    HE2  LYS 109          1HE       LYS 109  -5.264  10.689  -3.767
   36    HE3  LYS 109          2HE       LYS 109  -3.738  11.582  -3.763
   37    HZ1  LYS 109          1HZ       LYS 109  -4.709   9.932  -6.051
   38    HZ2  LYS 109          2HZ       LYS 109  -3.347  10.835  -6.034
   39    HZ3  LYS 109          3HZ       LYS 109  -4.804  11.568  -5.971
   40    H    LYS 110           H        LYS 110  -1.625   6.925   2.007
   41    HA   LYS 110           HA       LYS 110  -0.323   4.528   0.772
   42    HB2  LYS 110          1HB       LYS 110   1.228   6.482   0.780
   43    HB3  LYS 110          2HB       LYS 110   1.085   6.552   2.537
   44    HG2  LYS 110          1HG       LYS 110   2.042   4.197   2.632
   45    HG3  LYS 110          2HG       LYS 110   2.263   4.275   0.875
   46    HD2  LYS 110          1HD       LYS 110   3.707   6.295   1.170
   47    HD3  LYS 110          2HD       LYS 110   3.478   6.186   2.928
   48    HE2  LYS 110          1HE       LYS 110   4.488   3.875   2.848
   49    HE3  LYS 110          2HE       LYS 110   4.844   4.132   1.132
   50    HZ1  LYS 110          1HZ       LYS 110   6.210   6.063   1.814
   51    HZ2  LYS 110          2HZ       LYS 110   6.756   4.701   2.546
   52    HZ3  LYS 110          3HZ       LYS 110   5.875   5.760   3.397
   53    H    ILE 111           H        ILE 111  -0.236   2.739   1.938
   54    HA   ILE 111           HA       ILE 111  -1.006   2.826   4.824
   55    HB   ILE 111           HB       ILE 111  -2.157   0.725   4.634
   56   HG12  ILE 111          1HG1      ILE 111  -1.670   0.821   1.642
   57   HG13  ILE 111          2HG1      ILE 111  -0.898  -0.297   2.761
   58   HG21  ILE 111          1HG2      ILE 111  -3.355   2.893   4.274
   59   HG22  ILE 111          2HG2      ILE 111  -3.267   2.597   2.518
   60   HG23  ILE 111          3HG2      ILE 111  -4.164   1.487   3.581
   61   HD11  ILE 111          1HD1      ILE 111  -3.857  -0.244   2.102
   62   HD12  ILE 111          2HD1      ILE 111  -2.663  -1.471   1.651
   63   HD13  ILE 111          3HD1      ILE 111  -3.107  -1.263   3.356
   64    H    PHE 112           H        PHE 112  -0.184   1.404   6.157
   65    HA   PHE 112           HA       PHE 112   2.312  -0.054   5.521
   66    HB2  PHE 112          1HB       PHE 112   2.479   1.315   7.468
   67    HB3  PHE 112          2HB       PHE 112   0.928   0.792   8.068
   68    HD1  PHE 112          1HD       PHE 112   0.622  -1.586   8.950
   69    HD2  PHE 112          2HD       PHE 112   4.482   0.120   8.058
   70    HE1  PHE 112          1HE       PHE 112   1.709  -3.280  10.386
   71    HE2  PHE 112          2HE       PHE 112   5.552  -1.559   9.514
   72    HZ   PHE 112           HZ       PHE 112   4.186  -3.270  10.681
   73    H    VAL 113           H        VAL 113   2.372  -2.277   5.518
   74    HA   VAL 113           HA       VAL 113  -0.131  -3.779   6.165
   75    HB   VAL 113           HB       VAL 113   1.721  -4.422   3.855
   76   HG11  VAL 113          1HG1      VAL 113  -0.992  -5.568   4.648
   77   HG12  VAL 113          2HG1      VAL 113  -0.001  -6.052   3.251
   78   HG13  VAL 113          3HG1      VAL 113   0.569  -6.380   4.885
   79   HG21  VAL 113          1HG2      VAL 113  -1.050  -3.161   3.794
   80   HG22  VAL 113          2HG2      VAL 113   0.474  -2.392   3.293
   81   HG23  VAL 113          3HG2      VAL 113  -0.149  -3.766   2.385
   82    H    GLY 114           H        GLY 114   0.254  -5.020   7.881
   83    HA2  GLY 114          1HA       GLY 114   3.033  -6.061   8.376
   84    HA3  GLY 114          2HA       GLY 114   1.935  -5.516   9.629
   85    H    GLY 115           H        GLY 115   3.302  -8.047   9.410
   86    HA2  GLY 115          1HA       GLY 115   2.751 -10.192  10.148
   87    HA3  GLY 115          2HA       GLY 115   1.043  -9.902   9.816
   88    H    LEU 116           H        LEU 116   3.226  -9.153   7.228
   89    HA   LEU 116           HA       LEU 116   1.998 -10.964   5.368
   90    HB2  LEU 116          1HB       LEU 116   4.472  -9.208   5.362
   91    HB3  LEU 116          2HB       LEU 116   4.158 -10.284   4.011
   92    HG   LEU 116           HG       LEU 116   2.008  -8.344   4.924
   93   HD11  LEU 116          1HD1      LEU 116   2.850  -6.783   3.182
   94   HD12  LEU 116          2HD1      LEU 116   4.271  -7.831   2.956
   95   HD13  LEU 116          3HD1      LEU 116   4.012  -6.990   4.499
   96   HD21  LEU 116          1HD2      LEU 116   1.463 -10.192   3.267
   97   HD22  LEU 116          2HD2      LEU 116   2.720  -9.543   2.205
   98   HD23  LEU 116          3HD2      LEU 116   1.293  -8.561   2.590
   99    H    SER 117           H        SER 117   2.670 -12.876   4.456
  100    HA   SER 117           HA       SER 117   4.364 -14.635   5.994
  101    HB2  SER 117          1HB       SER 117   2.561 -15.536   4.600
  102    HB3  SER 117          2HB       SER 117   3.371 -14.936   3.148
  103    HG   SER 117           HG       SER 117   3.784 -17.195   3.714
  104    H    VAL 118           H        VAL 118   6.450 -15.206   5.762
  105    HA   VAL 118           HA       VAL 118   8.334 -13.605   4.262
  106    HB   VAL 118           HB       VAL 118   9.983 -15.304   4.946
  107   HG11  VAL 118          1HG1      VAL 118   9.844 -14.931   7.347
  108   HG12  VAL 118          2HG1      VAL 118   9.356 -13.464   6.484
  109   HG13  VAL 118          3HG1      VAL 118   8.126 -14.505   7.233
  110   HG21  VAL 118          1HG2      VAL 118   7.637 -16.769   6.244
  111   HG22  VAL 118          2HG2      VAL 118   8.554 -17.339   4.829
  112   HG23  VAL 118          3HG2      VAL 118   9.358 -17.172   6.396
  113    H    ASN 119           H        ASN 119   6.239 -16.142   3.242
  114    HA   ASN 119           HA       ASN 119   7.862 -16.878   0.880
  115    HB2  ASN 119          1HB       ASN 119   6.193 -18.342   2.339
  116    HB3  ASN 119          2HB       ASN 119   4.951 -17.591   1.339
  117   HD21  ASN 119          1HD2      ASN 119   6.384 -17.577  -1.201
  118   HD22  ASN 119          2HD2      ASN 119   6.609 -19.272  -1.635
  119    H    THR 120           H        THR 120   5.474 -14.457   1.762
  120    HA   THR 120           HA       THR 120   4.398 -13.991  -0.913
  121    HB   THR 120           HB       THR 120   4.269 -12.377   1.664
  122    HG1  THR 120          1HG       THR 120   2.275 -13.308   1.832
  123   HG21  THR 120          1HG2      THR 120   2.280 -11.283   0.664
  124   HG22  THR 120          2HG2      THR 120   2.695 -12.011  -0.896
  125   HG23  THR 120          3HG2      THR 120   3.790 -10.832  -0.138
  126    H    THR 121           H        THR 121   4.941 -12.501  -2.376
  127    HA   THR 121           HA       THR 121   7.205 -10.668  -1.787
  128    HB   THR 121           HB       THR 121   7.791 -12.532  -3.344
  129    HG1  THR 121          1HG       THR 121   9.017 -11.107  -4.535
  130   HG21  THR 121          1HG2      THR 121   5.748 -12.476  -4.786
  131   HG22  THR 121          2HG2      THR 121   7.242 -12.254  -5.705
  132   HG23  THR 121          3HG2      THR 121   6.207 -10.856  -5.356
  133    H    VAL 122           H        VAL 122   7.358  -8.762  -3.199
  134    HA   VAL 122           HA       VAL 122   5.248  -7.062  -2.522
  135    HB   VAL 122           HB       VAL 122   7.648  -6.489  -2.935
  136   HG11  VAL 122          1HG1      VAL 122   7.904  -7.493  -5.214
  137   HG12  VAL 122          2HG1      VAL 122   6.856  -6.208  -5.866
  138   HG13  VAL 122          3HG1      VAL 122   8.407  -5.801  -5.118
  139   HG21  VAL 122          1HG2      VAL 122   7.196  -4.223  -3.678
  140   HG22  VAL 122          2HG2      VAL 122   5.611  -4.698  -4.304
  141   HG23  VAL 122          3HG2      VAL 122   5.932  -4.772  -2.554
  142    H    GLU 123           H        GLU 123   5.714  -8.664  -5.646
  143    HA   GLU 123           HA       GLU 123   3.635  -7.240  -7.039
  144    HB2  GLU 123          1HB       GLU 123   4.802 -10.016  -7.514
  145    HB3  GLU 123          2HB       GLU 123   3.790  -9.145  -8.659
  146    HG2  GLU 123          1HG       GLU 123   6.545  -8.260  -7.686
  147    HG3  GLU 123          2HG       GLU 123   6.199  -9.060  -9.210
  148    H    ASP 124           H        ASP 124   3.529 -10.034  -4.859
  149    HA   ASP 124           HA       ASP 124   0.811 -10.876  -5.529
  150    HB2  ASP 124          1HB       ASP 124   2.217 -11.170  -2.856
  151    HB3  ASP 124          2HB       ASP 124   0.880 -12.123  -3.466
  152    H    VAL 125           H        VAL 125   2.335  -8.813  -2.992
  153    HA   VAL 125           HA       VAL 125  -0.082  -8.056  -1.690
  154    HB   VAL 125           HB       VAL 125   2.529  -6.501  -1.834
  155   HG11  VAL 125          1HG1      VAL 125   0.267  -6.406   0.205
  156   HG12  VAL 125          2HG1      VAL 125   1.834  -5.582   0.359
  157   HG13  VAL 125          3HG1      VAL 125   0.728  -5.112  -0.930
  158   HG21  VAL 125          1HG2      VAL 125   2.911  -7.666   0.410
  159   HG22  VAL 125          2HG2      VAL 125   1.544  -8.710   0.018
  160   HG23  VAL 125          3HG2      VAL 125   3.000  -8.721  -1.000
  161    H    LYS 126           H        LYS 126   1.667  -6.444  -4.366
  162    HA   LYS 126           HA       LYS 126  -0.216  -4.315  -4.738
  163    HB2  LYS 126          1HB       LYS 126   2.019  -4.271  -5.653
  164    HB3  LYS 126          2HB       LYS 126   1.706  -5.687  -6.661
  165    HG2  LYS 126          1HG       LYS 126   0.227  -4.475  -8.094
  166    HG3  LYS 126          2HG       LYS 126   0.110  -3.117  -6.961
  167    HD2  LYS 126          1HD       LYS 126   2.548  -2.668  -7.262
  168    HD3  LYS 126          2HD       LYS 126   2.635  -3.960  -8.460
  169    HE2  LYS 126          1HE       LYS 126   0.936  -1.426  -8.679
  170    HE3  LYS 126          2HE       LYS 126   2.517  -1.666  -9.429
  171    HZ1  LYS 126          1HZ       LYS 126   0.023  -3.148 -10.061
  172    HZ2  LYS 126          2HZ       LYS 126   1.501  -3.583 -10.646
  173    HZ3  LYS 126          3HZ       LYS 126   0.840  -2.141 -11.041
  174    H    HIS 127           H        HIS 127  -0.134  -7.576  -6.291
  175    HA   HIS 127           HA       HIS 127  -2.507  -7.283  -7.851
  176    HB2  HIS 127          1HB       HIS 127  -0.952  -9.039  -8.305
  177    HB3  HIS 127          2HB       HIS 127  -1.072  -9.675  -6.667
  178    HD2  HIS 127          2HD       HIS 127  -2.904 -11.402  -6.128
  179    HE1  HIS 127          1HE       HIS 127  -4.938 -11.430  -9.880
  180    HE2  HIS 127          2HE       HIS 127  -4.742 -12.586  -7.618
  181    H    TYR 128           H        TYR 128  -2.174  -8.419  -4.452
  182    HA   TYR 128           HA       TYR 128  -4.991  -8.846  -4.134
  183    HB2  TYR 128          1HB       TYR 128  -2.655  -8.850  -2.295
  184    HB3  TYR 128          2HB       TYR 128  -4.257  -8.686  -1.629
  185    HD1  TYR 128          1HD       TYR 128  -5.909 -10.463  -1.714
  186    HD2  TYR 128          2HD       TYR 128  -1.985 -11.024  -3.405
  187    HE1  TYR 128          1HE       TYR 128  -6.208 -12.924  -1.605
  188    HE2  TYR 128          2HE       TYR 128  -2.287 -13.485  -3.300
  189    HH   TYR 128           HH       TYR 128  -5.048 -14.946  -1.609
  190    H    PHE 129           H        PHE 129  -3.038  -5.947  -3.426
  191    HA   PHE 129           HA       PHE 129  -5.408  -4.626  -2.392
  192    HB2  PHE 129          1HB       PHE 129  -2.570  -3.753  -2.601
  193    HB3  PHE 129          2HB       PHE 129  -3.849  -2.613  -2.246
  194    HD1  PHE 129          1HD       PHE 129  -1.571  -4.856  -0.767
  195    HD2  PHE 129          2HD       PHE 129  -5.585  -3.362  -0.324
  196    HE1  PHE 129          1HE       PHE 129  -1.555  -5.523   1.618
  197    HE2  PHE 129          2HE       PHE 129  -5.574  -4.072   2.061
  198    HZ   PHE 129           HZ       PHE 129  -3.559  -5.133   3.038
  199    H    GLU 130           H        GLU 130  -4.044  -4.623  -5.590
  200    HA   GLU 130           HA       GLU 130  -5.285  -2.304  -6.641
  201    HB2  GLU 130          1HB       GLU 130  -4.641  -5.035  -7.785
  202    HB3  GLU 130          2HB       GLU 130  -5.480  -3.828  -8.768
  203    HG2  GLU 130          1HG       GLU 130  -3.685  -2.235  -8.529
  204    HG3  GLU 130          2HG       GLU 130  -2.818  -3.296  -7.425
  205    H    GLN 131           H        GLN 131  -6.793  -5.311  -5.708
  206    HA   GLN 131           HA       GLN 131  -9.037  -5.310  -7.402
  207    HB2  GLN 131          1HB       GLN 131  -8.908  -6.494  -4.588
  208    HB3  GLN 131          2HB       GLN 131  -9.882  -7.040  -5.971
  209    HG2  GLN 131          1HG       GLN 131  -7.610  -7.312  -7.193
  210    HG3  GLN 131          2HG       GLN 131  -6.861  -7.168  -5.618
  211   HE21  GLN 131          1HE2      GLN 131  -5.990  -9.288  -6.379
  212   HE22  GLN 131          2HE2      GLN 131  -6.926 -10.723  -5.939
  213    H    PHE 132           H        PHE 132  -8.525  -3.591  -4.434
  214    HA   PHE 132           HA       PHE 132 -11.277  -2.754  -4.024
  215    HB2  PHE 132          1HB       PHE 132  -8.667  -1.703  -2.884
  216    HB3  PHE 132          2HB       PHE 132 -10.272  -1.207  -2.359
  217    HD1  PHE 132          1HD       PHE 132  -7.653  -3.563  -1.850
  218    HD2  PHE 132          2HD       PHE 132 -11.939  -3.135  -1.632
  219    HE1  PHE 132          1HE       PHE 132  -7.773  -5.532  -0.357
  220    HE2  PHE 132          2HE       PHE 132 -12.059  -5.141  -0.172
  221    HZ   PHE 132           HZ       PHE 132  -9.976  -6.335   0.482
  222    H    GLY 133           H        GLY 133  -8.853  -1.543  -6.154
  223    HA2  GLY 133          1HA       GLY 133 -10.455   0.438  -7.392
  224    HA3  GLY 133          2HA       GLY 133  -9.460   1.249  -6.181
  225    H    LYS 134           H        LYS 134  -7.263   1.426  -6.489
  226    HA   LYS 134           HA       LYS 134  -5.786  -0.176  -8.385
  227    HB2  LYS 134          1HB       LYS 134  -6.625   1.416 -10.018
  228    HB3  LYS 134          2HB       LYS 134  -6.134   2.781  -9.016
  229    HG2  LYS 134          1HG       LYS 134  -3.761   2.117  -9.269
  230    HG3  LYS 134          2HG       LYS 134  -4.254   0.727 -10.262
  231    HD2  LYS 134          1HD       LYS 134  -5.229   2.407 -11.899
  232    HD3  LYS 134          2HD       LYS 134  -4.518   3.694 -10.915
  233    HE2  LYS 134          1HE       LYS 134  -3.058   1.468 -12.403
  234    HE3  LYS 134          2HE       LYS 134  -3.049   3.192 -12.784
  235    HZ1  LYS 134          1HZ       LYS 134  -1.935   3.536 -10.566
  236    HZ2  LYS 134          2HZ       LYS 134  -1.037   2.658 -11.623
  237    HZ3  LYS 134          3HZ       LYS 134  -1.819   1.923 -10.387
  238    H    VAL 135           H        VAL 135  -3.728  -0.375  -7.838
  239    HA   VAL 135           HA       VAL 135  -2.523   1.256  -5.641
  240    HB   VAL 135           HB       VAL 135  -1.764  -1.391  -6.914
  241   HG11  VAL 135          1HG1      VAL 135  -0.217   0.150  -4.808
  242   HG12  VAL 135          2HG1      VAL 135   0.056  -1.542  -5.230
  243   HG13  VAL 135          3HG1      VAL 135   0.347  -0.292  -6.439
  244   HG21  VAL 135          1HG2      VAL 135  -2.526  -0.652  -4.053
  245   HG22  VAL 135          2HG2      VAL 135  -3.600  -1.434  -5.217
  246   HG23  VAL 135          3HG2      VAL 135  -2.153  -2.285  -4.657
  247    H    ASP 136           H        ASP 136  -0.883   2.593  -6.054
  248    HA   ASP 136           HA       ASP 136   0.121   2.947  -8.824
  249    HB2  ASP 136          1HB       ASP 136  -0.057   4.814  -6.480
  250    HB3  ASP 136          2HB       ASP 136   1.112   5.090  -7.761
  251    H    ASP 137           H        ASP 137   1.288   1.986  -5.645
  252    HA   ASP 137           HA       ASP 137   3.691   0.879  -6.868
  253    HB2  ASP 137          1HB       ASP 137   4.229   3.373  -6.462
  254    HB3  ASP 137          2HB       ASP 137   4.022   3.056  -4.743
  255    H    ALA 138           H        ALA 138   4.787  -0.570  -5.380
  256    HA   ALA 138           HA       ALA 138   3.855  -0.759  -2.602
  257    HB1  ALA 138          1HB       ALA 138   3.772  -3.147  -4.495
  258    HB2  ALA 138          2HB       ALA 138   3.483  -3.195  -2.743
  259    HB3  ALA 138          3HB       ALA 138   2.361  -2.317  -3.799
  260    H    MET 139           H        MET 139   5.338  -1.798  -1.198
  261    HA   MET 139           HA       MET 139   7.950  -2.750  -2.191
  262    HB2  MET 139          1HB       MET 139   9.201  -1.105  -0.809
  263    HB3  MET 139          2HB       MET 139   8.415  -0.417  -2.229
  264    HG2  MET 139          1HG       MET 139   6.577   0.436  -0.800
  265    HG3  MET 139          2HG       MET 139   7.378  -0.228   0.626
  266    HE1  MET 139          1HE       MET 139  10.217   0.355   0.738
  267    HE2  MET 139          2HE       MET 139  10.378   2.048   1.246
  268    HE3  MET 139          3HE       MET 139   9.158   1.010   2.008
  269    H    LEU 140           H        LEU 140   8.877  -4.229  -0.817
  270    HA   LEU 140           HA       LEU 140   7.720  -4.520   1.931
  271    HB2  LEU 140          1HB       LEU 140   8.995  -6.719   0.288
  272    HB3  LEU 140          2HB       LEU 140   8.268  -6.860   1.888
  273    HG   LEU 140           HG       LEU 140   6.831  -6.332  -0.741
  274   HD11  LEU 140          1HD1      LEU 140   7.501  -8.677  -0.265
  275   HD12  LEU 140          2HD1      LEU 140   5.737  -8.471  -0.239
  276   HD13  LEU 140          3HD1      LEU 140   6.636  -8.598   1.284
  277   HD21  LEU 140          1HD2      LEU 140   4.736  -6.497   0.635
  278   HD22  LEU 140          2HD2      LEU 140   5.636  -5.019   0.884
  279   HD23  LEU 140          3HD2      LEU 140   5.742  -6.316   2.095
  280    H    MET 141           H        MET 141   9.086  -4.821   3.678
  281    HA   MET 141           HA       MET 141  11.617  -3.423   3.243
  282    HB2  MET 141          1HB       MET 141  10.309  -4.239   5.856
  283    HB3  MET 141          2HB       MET 141  11.681  -3.147   5.642
  284    HG2  MET 141          1HG       MET 141   8.784  -2.717   4.990
  285    HG3  MET 141          2HG       MET 141   9.883  -1.708   5.919
  286    HE1  MET 141          1HE       MET 141  11.800  -0.308   4.918
  287    HE2  MET 141          2HE       MET 141  12.413  -1.401   3.666
  288    HE3  MET 141          3HE       MET 141  11.875   0.234   3.228
  289    H    PHE 142           H        PHE 142  12.604  -5.128   2.044
  290    HA   PHE 142           HA       PHE 142  13.659  -7.455   3.282
  291    HB2  PHE 142          1HB       PHE 142  14.335  -6.033   0.772
  292    HB3  PHE 142          2HB       PHE 142  15.403  -7.273   1.400
  293    HD1  PHE 142          1HD       PHE 142  11.861  -6.679   0.321
  294    HD2  PHE 142          2HD       PHE 142  14.934  -9.584   1.162
  295    HE1  PHE 142          1HE       PHE 142  10.434  -8.472  -0.644
  296    HE2  PHE 142          2HE       PHE 142  13.514 -11.368   0.176
  297    HZ   PHE 142           HZ       PHE 142  11.255 -10.817  -0.709
  298    H    ASP 143           H        ASP 143  15.378  -8.086   4.332
  299    HA   ASP 143           HA       ASP 143  17.312  -6.000   5.226
  300    HB2  ASP 143          1HB       ASP 143  15.938  -6.472   7.048
  301    HB3  ASP 143          2HB       ASP 143  15.992  -8.208   6.755
  302    H    LYS 144           H        LYS 144  19.295  -6.182   4.577
  303    HA   LYS 144           HA       LYS 144  20.347  -8.285   2.995
  304    HB2  LYS 144          1HB       LYS 144  21.108  -5.946   2.987
  305    HB3  LYS 144          2HB       LYS 144  21.751  -6.125   4.626
  306    HG2  LYS 144          1HG       LYS 144  23.452  -7.700   3.846
  307    HG3  LYS 144          2HG       LYS 144  22.704  -7.768   2.243
  308    HD2  LYS 144          1HD       LYS 144  24.685  -6.383   2.156
  309    HD3  LYS 144          2HD       LYS 144  23.254  -5.381   1.873
  310    HE2  LYS 144          1HE       LYS 144  23.327  -4.607   4.237
  311    HE3  LYS 144          2HE       LYS 144  24.728  -5.645   4.538
  312    HZ1  LYS 144          1HZ       LYS 144  24.670  -3.378   2.615
  313    HZ2  LYS 144          2HZ       LYS 144  25.966  -4.333   2.897
  314    HZ3  LYS 144          3HZ       LYS 144  25.399  -3.358   4.074
  315    H    THR 145           H        THR 145  20.278  -7.995   6.471
  316    HA   THR 145           HA       THR 145  22.249  -9.978   7.087
  317    HB   THR 145           HB       THR 145  19.982  -9.501   8.960
  318    HG1  THR 145          1HG       THR 145  20.321  -7.472   8.323
  319   HG21  THR 145          1HG2      THR 145  21.843 -10.933   9.706
  320   HG22  THR 145          2HG2      THR 145  21.823  -9.422  10.621
  321   HG23  THR 145          3HG2      THR 145  23.010  -9.649   9.318
  322    H    THR 146           H        THR 146  18.976 -10.362   6.040
  323    HA   THR 146           HA       THR 146  19.125 -13.293   6.549
  324    HB   THR 146           HB       THR 146  16.967 -13.467   7.296
  325    HG1  THR 146          1HG       THR 146  15.497 -11.729   7.183
  326   HG21  THR 146          1HG2      THR 146  17.743 -10.765   8.478
  327   HG22  THR 146          2HG2      THR 146  18.401 -12.327   9.021
  328   HG23  THR 146          3HG2      THR 146  16.670 -11.991   9.181
  329    H    ASN 147           H        ASN 147  18.513 -10.931   4.187
  330    HA   ASN 147           HA       ASN 147  17.817 -10.921   2.073
  331    HB2  ASN 147          1HB       ASN 147  19.654 -12.642   1.868
  332    HB3  ASN 147          2HB       ASN 147  18.414 -13.894   1.950
  333   HD21  ASN 147          1HD2      ASN 147  19.015 -14.627  -0.176
  334   HD22  ASN 147          2HD2      ASN 147  18.584 -13.684  -1.596
  335    H    ARG 148           H        ARG 148  15.902 -11.302   4.170
  336    HA   ARG 148           HA       ARG 148  13.529 -11.941   2.496
  337    HB2  ARG 148          1HB       ARG 148  13.914 -12.786   5.402
  338    HB3  ARG 148          2HB       ARG 148  12.398 -12.897   4.518
  339    HG2  ARG 148          1HG       ARG 148  14.944 -14.422   3.805
  340    HG3  ARG 148          2HG       ARG 148  13.580 -15.060   4.717
  341    HD2  ARG 148          1HD       ARG 148  12.076 -14.710   2.802
  342    HD3  ARG 148          2HD       ARG 148  13.395 -14.038   1.846
  343    HE   ARG 148           HE       ARG 148  12.948 -16.865   2.566
  344   HH11  ARG 148          1HH1      ARG 148  14.012 -18.418   1.408
  345   HH12  ARG 148          2HH1      ARG 148  15.328 -17.980   0.361
  346   HH21  ARG 148          1HH2      ARG 148  15.232 -14.623   1.081
  347   HH22  ARG 148          2HH2      ARG 148  15.972 -15.899   0.148
  348    H    HIS 149           H        HIS 149  11.548 -10.875   3.365
  349    HA   HIS 149           HA       HIS 149  12.194  -8.190   4.393
  350    HB2  HIS 149          1HB       HIS 149   9.901  -7.603   3.986
  351    HB3  HIS 149          2HB       HIS 149  10.622  -8.322   2.555
  352    HD2  HIS 149          2HD       HIS 149   9.322 -10.284   1.460
  353    HE1  HIS 149          1HE       HIS 149   6.442 -10.968   4.522
  354    HE2  HIS 149          2HE       HIS 149   7.143 -11.583   2.145
  355    H    ARG 150           H        ARG 150  11.277  -7.228   6.153
  356    HA   ARG 150           HA       ARG 150  11.414  -8.779   8.573
  357    HB2  ARG 150          1HB       ARG 150  10.724  -5.890   7.966
  358    HB3  ARG 150          2HB       ARG 150  10.876  -6.517   9.615
  359    HG2  ARG 150          1HG       ARG 150  13.217  -7.075   9.276
  360    HG3  ARG 150          2HG       ARG 150  13.123  -6.630   7.569
  361    HD2  ARG 150          1HD       ARG 150  14.160  -4.815   8.772
  362    HD3  ARG 150          2HD       ARG 150  12.577  -4.304   8.180
  363    HE   ARG 150           HE       ARG 150  12.623  -5.323  10.950
  364   HH11  ARG 150          1HH1      ARG 150  12.997  -2.364   9.069
  365   HH12  ARG 150          2HH1      ARG 150  12.338  -1.396  10.384
  366   HH21  ARG 150          1HH2      ARG 150  11.883  -3.906  12.572
  367   HH22  ARG 150          2HH2      ARG 150  11.850  -2.182  12.207
  368    H    GLY 151           H        GLY 151   8.967  -9.302   6.730
  369    HA2  GLY 151          1HA       GLY 151   6.860 -10.154   7.173
  370    HA3  GLY 151          2HA       GLY 151   7.019  -9.686   8.866
  371    H    PHE 152           H        PHE 152   7.583  -7.065   6.657
  372    HA   PHE 152           HA       PHE 152   4.780  -6.283   6.483
  373    HB2  PHE 152          1HB       PHE 152   4.903  -4.289   7.771
  374    HB3  PHE 152          2HB       PHE 152   5.517  -5.551   8.800
  375    HD1  PHE 152          1HD       PHE 152   6.209  -2.409   7.095
  376    HD2  PHE 152          2HD       PHE 152   8.024  -5.663   9.263
  377    HE1  PHE 152          1HE       PHE 152   8.227  -1.028   7.478
  378    HE2  PHE 152          2HE       PHE 152  10.058  -4.279   9.619
  379    HZ   PHE 152           HZ       PHE 152  10.178  -1.981   8.690
  380    H    GLY 153           H        GLY 153   4.566  -4.176   5.373
  381    HA2  GLY 153          1HA       GLY 153   6.778  -2.936   3.962
  382    HA3  GLY 153          2HA       GLY 153   5.780  -3.938   2.906
  383    H    PHE 154           H        PHE 154   5.582  -1.781   1.904
  384    HA   PHE 154           HA       PHE 154   3.223  -0.306   2.936
  385    HB2  PHE 154          1HB       PHE 154   5.700   0.858   1.647
  386    HB3  PHE 154          2HB       PHE 154   4.204   1.741   1.905
  387    HD1  PHE 154          1HD       PHE 154   7.171   0.296   3.525
  388    HD2  PHE 154          2HD       PHE 154   3.391   2.270   4.184
  389    HE1  PHE 154          1HE       PHE 154   7.789   0.691   5.880
  390    HE2  PHE 154          2HE       PHE 154   4.036   2.709   6.530
  391    HZ   PHE 154           HZ       PHE 154   6.208   1.885   7.407
  392    H    VAL 155           H        VAL 155   1.754   0.579   1.552
  393    HA   VAL 155           HA       VAL 155   2.008   0.016  -1.352
  394    HB   VAL 155           HB       VAL 155  -0.562  -0.569   0.127
  395   HG11  VAL 155          1HG1      VAL 155  -1.210  -1.643  -1.997
  396   HG12  VAL 155          2HG1      VAL 155  -0.867   0.069  -2.234
  397   HG13  VAL 155          3HG1      VAL 155   0.335  -1.149  -2.723
  398   HG21  VAL 155          1HG2      VAL 155   1.062  -2.289   0.782
  399   HG22  VAL 155          2HG2      VAL 155  -0.145  -2.946  -0.318
  400   HG23  VAL 155          3HG2      VAL 155   1.482  -2.559  -0.925
  401    H    THR 156           H        THR 156   1.450   1.618  -2.618
  402    HA   THR 156           HA       THR 156   0.087   4.001  -1.488
  403    HB   THR 156           HB       THR 156   1.896   4.120  -3.878
  404    HG1  THR 156          1HG       THR 156   3.140   3.399  -2.192
  405   HG21  THR 156          1HG2      THR 156   0.429   6.067  -3.578
  406   HG22  THR 156          2HG2      THR 156   2.103   6.490  -3.207
  407   HG23  THR 156          3HG2      THR 156   0.952   6.221  -1.881
  408    H    PHE 157           H        PHE 157  -1.625   4.942  -2.511
  409    HA   PHE 157           HA       PHE 157  -2.922   3.276  -4.572
  410    HB2  PHE 157          1HB       PHE 157  -3.970   4.735  -2.184
  411    HB3  PHE 157          2HB       PHE 157  -5.028   4.296  -3.508
  412    HD1  PHE 157          1HD       PHE 157  -2.614   2.803  -1.045
  413    HD2  PHE 157          2HD       PHE 157  -5.928   2.131  -3.718
  414    HE1  PHE 157          1HE       PHE 157  -2.890   0.508  -0.148
  415    HE2  PHE 157          2HE       PHE 157  -6.228  -0.147  -2.775
  416    HZ   PHE 157           HZ       PHE 157  -4.718  -0.946  -0.965
  417    H    GLU 158           H        GLU 158  -4.426   4.087  -6.028
  418    HA   GLU 158           HA       GLU 158  -3.653   6.523  -7.391
  419    HB2  GLU 158          1HB       GLU 158  -4.560   4.592  -8.520
  420    HB3  GLU 158          2HB       GLU 158  -6.091   4.724  -7.673
  421    HG2  GLU 158          1HG       GLU 158  -5.004   6.985  -9.411
  422    HG3  GLU 158          2HG       GLU 158  -5.822   5.604 -10.125
  423    H    SER 159           H        SER 159  -6.149   5.827  -4.953
  424    HA   SER 159           HA       SER 159  -6.474   8.731  -4.508
  425    HB2  SER 159          1HB       SER 159  -8.280   8.215  -6.048
  426    HB3  SER 159          2HB       SER 159  -8.820   6.874  -5.012
  427    HG   SER 159           HG       SER 159  -9.906   9.000  -4.763
  428    H    GLU 160           H        GLU 160  -6.972   9.312  -2.435
  429    HA   GLU 160           HA       GLU 160  -6.522   7.374  -0.327
  430    HB2  GLU 160          1HB       GLU 160  -6.993   9.233   1.213
  431    HB3  GLU 160          2HB       GLU 160  -5.712   9.546   0.044
  432    HG2  GLU 160          1HG       GLU 160  -7.468  10.829  -1.330
  433    HG3  GLU 160          2HG       GLU 160  -8.538  10.672   0.064
  434    H    ASP 161           H        ASP 161  -9.321   8.393  -2.081
  435    HA   ASP 161           HA       ASP 161 -11.297   7.585  -0.142
  436    HB2  ASP 161          1HB       ASP 161 -11.430   7.819  -3.162
  437    HB3  ASP 161          2HB       ASP 161 -12.789   7.323  -2.167
  438    H    ILE 162           H        ILE 162  -9.199   5.745  -2.233
  439    HA   ILE 162           HA       ILE 162 -10.636   3.205  -1.757
  440    HB   ILE 162           HB       ILE 162  -7.783   3.548  -2.736
  441   HG12  ILE 162          1HG1      ILE 162  -9.051   4.733  -4.351
  442   HG13  ILE 162          2HG1      ILE 162  -8.618   3.161  -5.005
  443   HG21  ILE 162          1HG2      ILE 162  -8.252   1.277  -3.741
  444   HG22  ILE 162          2HG2      ILE 162  -8.224   1.319  -1.981
  445   HG23  ILE 162          3HG2      ILE 162  -9.779   1.250  -2.834
  446   HD11  ILE 162          1HD1      ILE 162 -10.949   2.347  -4.526
  447   HD12  ILE 162          2HD1      ILE 162 -11.368   3.976  -3.956
  448   HD13  ILE 162          3HD1      ILE 162 -10.904   3.722  -5.646
  449    H    VAL 163           H        VAL 163  -7.706   4.902  -0.570
  450    HA   VAL 163           HA       VAL 163  -6.739   2.933   1.172
  451    HB   VAL 163           HB       VAL 163  -6.665   5.974   1.451
  452   HG11  VAL 163          1HG1      VAL 163  -6.224   5.207   3.676
  453   HG12  VAL 163          2HG1      VAL 163  -5.201   3.892   3.083
  454   HG13  VAL 163          3HG1      VAL 163  -4.664   5.584   2.944
  455   HG21  VAL 163          1HG2      VAL 163  -4.682   3.905   0.442
  456   HG22  VAL 163          2HG2      VAL 163  -5.570   5.103  -0.532
  457   HG23  VAL 163          3HG2      VAL 163  -4.349   5.633   0.636
  458    H    GLU 164           H        GLU 164  -9.162   5.502   1.936
  459    HA   GLU 164           HA       GLU 164  -9.497   4.667   4.656
  460    HB2  GLU 164          1HB       GLU 164 -11.433   6.025   4.756
  461    HB3  GLU 164          2HB       GLU 164 -10.204   6.856   3.797
  462    HG2  GLU 164          1HG       GLU 164 -11.388   6.206   1.727
  463    HG3  GLU 164          2HG       GLU 164 -12.628   5.383   2.680
  464    H    LYS 165           H        LYS 165 -11.116   3.463   1.717
  465    HA   LYS 165           HA       LYS 165 -13.040   1.760   3.073
  466    HB2  LYS 165          1HB       LYS 165 -13.274   2.580   0.740
  467    HB3  LYS 165          2HB       LYS 165 -11.879   1.625   0.250
  468    HG2  LYS 165          1HG       LYS 165 -13.067  -0.468   0.859
  469    HG3  LYS 165          2HG       LYS 165 -14.473   0.492   1.367
  470    HD2  LYS 165          1HD       LYS 165 -14.706   1.361  -0.957
  471    HD3  LYS 165          2HD       LYS 165 -13.260   0.468  -1.438
  472    HE2  LYS 165          1HE       LYS 165 -15.167  -0.772  -2.190
  473    HE3  LYS 165          2HE       LYS 165 -14.392  -1.679  -0.890
  474    HZ1  LYS 165          1HZ       LYS 165 -16.127  -0.863   0.622
  475    HZ2  LYS 165          2HZ       LYS 165 -16.818  -1.613  -0.649
  476    HZ3  LYS 165          3HZ       LYS 165 -16.819   0.015  -0.573
  477    H    VAL 166           H        VAL 166  -9.892   1.147   1.567
  478    HA   VAL 166           HA       VAL 166  -9.602  -1.627   2.218
  479    HB   VAL 166           HB       VAL 166  -7.487   0.531   1.882
  480   HG11  VAL 166          1HG1      VAL 166  -7.231  -2.493   1.782
  481   HG12  VAL 166          2HG1      VAL 166  -5.964  -1.340   1.314
  482   HG13  VAL 166          3HG1      VAL 166  -6.492  -1.426   2.997
  483   HG21  VAL 166          1HG2      VAL 166  -8.445  -1.545  -0.117
  484   HG22  VAL 166          2HG2      VAL 166  -9.012   0.120  -0.129
  485   HG23  VAL 166          3HG2      VAL 166  -7.308  -0.211  -0.406
  486    H    CYS 167           H        CYS 167  -8.518   1.287   4.020
  487    HA   CYS 167           HA       CYS 167  -7.371  -0.166   6.191
  488    HB2  CYS 167          1HB       CYS 167  -6.849   2.182   5.478
  489    HB3  CYS 167          2HB       CYS 167  -8.406   2.705   6.146
  490    HG   CYS 167           HG       CYS 167  -7.950   1.984   8.603
  491    H    GLU 168           H        GLU 168 -10.751   1.090   5.754
  492    HA   GLU 168           HA       GLU 168 -11.679   0.555   8.362
  493    HB2  GLU 168          1HB       GLU 168 -12.774   2.015   6.791
  494    HB3  GLU 168          2HB       GLU 168 -13.032   0.690   5.635
  495    HG2  GLU 168          1HG       GLU 168 -14.530  -0.422   7.155
  496    HG3  GLU 168          2HG       GLU 168 -14.145   0.747   8.433
  497    H    ILE 169           H        ILE 169 -11.214  -1.651   5.603
  498    HA   ILE 169           HA       ILE 169 -12.629  -3.913   6.726
  499    HB   ILE 169           HB       ILE 169 -10.365  -3.720   4.717
  500   HG12  ILE 169          1HG1      ILE 169 -13.305  -4.418   4.234
  501   HG13  ILE 169          2HG1      ILE 169 -12.750  -2.753   4.213
  502   HG21  ILE 169          1HG2      ILE 169 -10.945  -6.058   4.057
  503   HG22  ILE 169          2HG2      ILE 169 -10.253  -5.945   5.660
  504   HG23  ILE 169          3HG2      ILE 169 -12.008  -6.167   5.477
  505   HD11  ILE 169          1HD1      ILE 169 -11.144  -3.285   2.395
  506   HD12  ILE 169          2HD1      ILE 169 -11.808  -4.935   2.329
  507   HD13  ILE 169          3HD1      ILE 169 -12.840  -3.546   1.953
  508    H    HIS 170           H        HIS 170  -9.407  -2.623   7.138
  509    HA   HIS 170           HA       HIS 170  -7.805  -2.803   8.672
  510    HB2  HIS 170          1HB       HIS 170  -9.732  -2.496  10.178
  511    HB3  HIS 170          2HB       HIS 170  -9.830  -4.240  10.397
  512    HD2  HIS 170          2HD       HIS 170  -6.256  -2.893  10.369
  513    HE1  HIS 170          1HE       HIS 170  -7.301  -3.363  14.469
  514    HE2  HIS 170          2HE       HIS 170  -5.379  -2.948  12.838
  515    H    PHE 171           H        PHE 171  -9.377  -6.019   8.679
  516    HA   PHE 171           HA       PHE 171  -6.691  -7.220   8.355
  517    HB2  PHE 171          1HB       PHE 171  -9.007  -8.319   9.868
  518    HB3  PHE 171          2HB       PHE 171  -7.761  -9.358   9.197
  519    HD1  PHE 171          1HD       PHE 171  -5.485  -9.387  10.042
  520    HD2  PHE 171          2HD       PHE 171  -8.397  -6.652  11.661
  521    HE1  PHE 171          1HE       PHE 171  -3.994  -8.945  11.976
  522    HE2  PHE 171          2HE       PHE 171  -6.894  -6.195  13.583
  523    HZ   PHE 171           HZ       PHE 171  -4.689  -7.341  13.744
  524    H    HIS 172           H        HIS 172  -6.085  -8.278   6.691
  525    HA   HIS 172           HA       HIS 172  -8.072  -8.938   4.538
  526    HB2  HIS 172          1HB       HIS 172  -5.375  -7.547   4.335
  527    HB3  HIS 172          2HB       HIS 172  -6.260  -8.182   2.959
  528    HD2  HIS 172          2HD       HIS 172  -6.720  -5.444   5.718
  529    HE1  HIS 172          1HE       HIS 172  -8.891  -4.200   2.292
  530    HE2  HIS 172          2HE       HIS 172  -8.085  -3.509   4.581
  531    H    GLU 173           H        GLU 173  -7.275 -10.517   2.951
  532    HA   GLU 173           HA       GLU 173  -5.273 -12.438   4.066
  533    HB2  GLU 173          1HB       GLU 173  -7.356 -13.495   4.071
  534    HB3  GLU 173          2HB       GLU 173  -7.788 -12.933   2.468
  535    HG2  GLU 173          1HG       GLU 173  -5.331 -14.684   2.847
  536    HG3  GLU 173          2HG       GLU 173  -6.923 -15.411   2.946
  537    H    ILE 174           H        ILE 174  -3.515 -12.921   2.929
  538    HA   ILE 174           HA       ILE 174  -3.308 -12.343   0.024
  539    HB   ILE 174           HB       ILE 174  -1.284 -11.366   2.082
  540   HG12  ILE 174          1HG1      ILE 174  -3.192  -9.837   0.269
  541   HG13  ILE 174          2HG1      ILE 174  -3.190  -9.870   2.033
  542   HG21  ILE 174          1HG2      ILE 174  -1.210 -11.146  -0.959
  543   HG22  ILE 174          2HG2      ILE 174   0.005 -10.527   0.172
  544   HG23  ILE 174          3HG2      ILE 174  -0.213 -12.256   0.002
  545   HD11  ILE 174          1HD1      ILE 174  -1.142  -8.533   0.250
  546   HD12  ILE 174          2HD1      ILE 174  -2.291  -7.793   1.372
  547   HD13  ILE 174          3HD1      ILE 174  -0.943  -8.754   2.009
  548    H    ASN 175           H        ASN 175  -2.508 -14.145  -0.941
  549    HA   ASN 175           HA       ASN 175  -1.787 -16.269  -1.184
  550    HB2  ASN 175          1HB       ASN 175   0.477 -15.273   0.577
  551    HB3  ASN 175          2HB       ASN 175   0.514 -16.782  -0.319
  552   HD21  ASN 175          1HD2      ASN 175   2.228 -14.430  -0.502
  553   HD22  ASN 175          2HD2      ASN 175   2.277 -14.087  -2.230
  554    H    ASN 176           H        ASN 176  -3.784 -16.010   0.746
  555    HA   ASN 176           HA       ASN 176  -4.903 -16.956   2.397
  556    HB2  ASN 176          1HB       ASN 176  -3.151 -19.357   1.862
  557    HB3  ASN 176          2HB       ASN 176  -4.564 -19.355   2.907
  558   HD21  ASN 176          1HD2      ASN 176  -5.490 -17.261   0.377
  559   HD22  ASN 176          2HD2      ASN 176  -6.227 -18.523  -0.595
  560    H    LYS 177           H        LYS 177  -2.027 -15.733   3.083
  561    HA   LYS 177           HA       LYS 177  -2.051 -16.350   5.996
  562    HB2  LYS 177          1HB       LYS 177   0.108 -16.043   4.625
  563    HB3  LYS 177          2HB       LYS 177  -0.356 -14.366   4.416
  564    HG2  LYS 177          1HG       LYS 177   1.200 -14.352   6.179
  565    HG3  LYS 177          2HG       LYS 177  -0.355 -14.106   6.943
  566    HD2  LYS 177          1HD       LYS 177   0.970 -15.615   8.274
  567    HD3  LYS 177          2HD       LYS 177  -0.379 -16.539   7.599
  568    HE2  LYS 177          1HE       LYS 177   1.128 -17.457   5.849
  569    HE3  LYS 177          2HE       LYS 177   2.456 -16.457   6.464
  570    HZ1  LYS 177          1HZ       LYS 177   1.120 -18.607   8.003
  571    HZ2  LYS 177          2HZ       LYS 177   2.319 -17.667   8.569
  572    HZ3  LYS 177          3HZ       LYS 177   2.626 -18.689   7.332
  573    H    MET 178           H        MET 178  -2.780 -14.782   7.523
  574    HA   MET 178           HA       MET 178  -4.483 -12.626   6.423
  575    HB2  MET 178          1HB       MET 178  -5.612 -13.999   7.973
  576    HB3  MET 178          2HB       MET 178  -4.324 -13.858   9.180
  577    HG2  MET 178          1HG       MET 178  -4.821 -11.630   9.668
  578    HG3  MET 178          2HG       MET 178  -5.705 -11.370   8.164
  579    HE1  MET 178          1HE       MET 178  -9.221 -12.666   8.718
  580    HE2  MET 178          2HE       MET 178  -8.145 -11.611   7.778
  581    HE3  MET 178          3HE       MET 178  -7.896 -13.371   7.766
  582    H    VAL 179           H        VAL 179  -4.069 -10.532   6.631
  583    HA   VAL 179           HA       VAL 179  -1.670  -9.615   8.123
  584    HB   VAL 179           HB       VAL 179  -0.980  -8.180   6.342
  585   HG11  VAL 179          1HG1      VAL 179  -0.193  -9.761   4.731
  586   HG12  VAL 179          2HG1      VAL 179  -0.184 -10.519   6.336
  587   HG13  VAL 179          3HG1      VAL 179  -1.449 -10.939   5.155
  588   HG21  VAL 179          1HG2      VAL 179  -3.120  -7.592   5.298
  589   HG22  VAL 179          2HG2      VAL 179  -1.967  -8.185   4.106
  590   HG23  VAL 179          3HG2      VAL 179  -3.277  -9.248   4.661
  591    H    GLU 180           H        GLU 180  -1.591  -7.348   8.542
  592    HA   GLU 180           HA       GLU 180  -4.309  -6.128   8.953
  593    HB2  GLU 180          1HB       GLU 180  -3.001  -6.768  11.017
  594    HB3  GLU 180          2HB       GLU 180  -1.774  -5.592  10.526
  595    HG2  GLU 180          1HG       GLU 180  -3.591  -3.822  10.507
  596    HG3  GLU 180          2HG       GLU 180  -4.701  -5.030  11.158
  597    H    CYS 181           H        CYS 181  -4.725  -4.174   8.058
  598    HA   CYS 181           HA       CYS 181  -2.499  -2.630   6.813
  599    HB2  CYS 181          1HB       CYS 181  -4.209  -1.412   5.558
  600    HB3  CYS 181          2HB       CYS 181  -4.221  -3.141   5.201
  601    HG   CYS 181           HG       CYS 181  -6.178  -3.774   6.805
  602    H    LYS 182           H        LYS 182  -2.112  -0.532   7.322
  603    HA   LYS 182           HA       LYS 182  -3.784   0.929   9.312
  604    HB2  LYS 182          1HB       LYS 182  -0.758   0.819   9.548
  605    HB3  LYS 182          2HB       LYS 182  -1.891   1.554  10.670
  606    HG2  LYS 182          1HG       LYS 182  -2.620  -0.695  11.414
  607    HG3  LYS 182          2HG       LYS 182  -1.539  -1.445  10.217
  608    HD2  LYS 182          1HD       LYS 182   0.391  -0.205  11.280
  609    HD3  LYS 182          2HD       LYS 182  -0.690   0.281  12.586
  610    HE2  LYS 182          1HE       LYS 182  -0.164  -2.615  11.783
  611    HE3  LYS 182          2HE       LYS 182   0.829  -1.748  12.953
  612    HZ1  LYS 182          1HZ       LYS 182  -2.082  -2.305  13.268
  613    HZ2  LYS 182          2HZ       LYS 182  -1.163  -1.450  14.336
  614    HZ3  LYS 182          3HZ       LYS 182  -0.879  -3.038  14.051
  615    H    LYS 183           H        LYS 183  -3.521   3.297   9.049
  616    HA   LYS 183           HA       LYS 183  -2.518   4.190   6.448
  617    HB2  LYS 183          1HB       LYS 183  -3.413   5.709   8.920
  618    HB3  LYS 183          2HB       LYS 183  -2.743   6.507   7.490
  619    HG2  LYS 183          1HG       LYS 183  -4.491   5.491   6.062
  620    HG3  LYS 183          2HG       LYS 183  -5.210   4.715   7.485
  621    HD2  LYS 183          1HD       LYS 183  -5.616   6.939   8.502
  622    HD3  LYS 183          2HD       LYS 183  -4.867   7.724   7.095
  623    HE2  LYS 183          1HE       LYS 183  -6.599   6.732   5.618
  624    HE3  LYS 183          2HE       LYS 183  -7.350   5.951   7.018
  625    HZ1  LYS 183          1HZ       LYS 183  -8.462   8.047   6.469
  626    HZ2  LYS 183          2HZ       LYS 183  -7.077   8.892   6.651
  627    HZ3  LYS 183          3HZ       LYS 183  -7.773   8.170   7.942
  628    H    ALA 184           H        ALA 184  -0.587   5.069   5.857
  629    HA   ALA 184           HA       ALA 184   1.634   4.163   7.465
  630    HB1  ALA 184          1HB       ALA 184   1.598   3.853   5.059
  631    HB2  ALA 184          2HB       ALA 184   1.601   5.616   4.807
  632    HB3  ALA 184          3HB       ALA 184   3.004   4.812   5.552
  633    H    GLN 185           H        GLN 185   2.150   5.277   9.229
  634    HA   GLN 185           HA       GLN 185   2.637   8.210   9.176
  635    HB2  GLN 185          1HB       GLN 185   2.861   6.145  11.404
  636    HB3  GLN 185          2HB       GLN 185   3.146   7.883  11.581
  637    HG2  GLN 185          1HG       GLN 185   0.805   8.361  10.931
  638    HG3  GLN 185          2HG       GLN 185   0.489   6.632  10.743
  639   HE21  GLN 185          1HE2      GLN 185   0.908   5.243  12.777
  640   HE22  GLN 185          2HE2      GLN 185   0.563   6.009  14.325
  641    HA   PRO 186           HA       PRO 186   7.017   7.494   8.443
  642    HB2  PRO 186          1HB       PRO 186   8.203   9.700   9.531
  643    HB3  PRO 186          2HB       PRO 186   7.208   9.761   8.044
  644    HG2  PRO 186          1HG       PRO 186   6.362  10.413  10.879
  645    HG3  PRO 186          2HG       PRO 186   6.071  11.365   9.392
  646    HD2  PRO 186          1HD       PRO 186   4.193   9.672  10.443
  647    HD3  PRO 186          2HD       PRO 186   4.359   9.916   8.680
  648    H    LYS 187           H        LYS 187   8.879   6.680   9.516
  649    HA   LYS 187           HA       LYS 187   8.417   5.376  11.987
  650    HB2  LYS 187          1HB       LYS 187  10.812   4.718  11.886
  651    HB3  LYS 187          2HB       LYS 187   9.916   4.383  10.413
  652    HG2  LYS 187          1HG       LYS 187  10.930   6.241   9.249
  653    HG3  LYS 187          2HG       LYS 187  11.676   6.848  10.741
  654    HD2  LYS 187          1HD       LYS 187  13.121   4.904  10.893
  655    HD3  LYS 187          2HD       LYS 187  12.302   4.121   9.531
  656    HE2  LYS 187          1HE       LYS 187  13.062   5.853   7.991
  657    HE3  LYS 187          2HE       LYS 187  13.760   6.786   9.324
  658    HZ1  LYS 187          1HZ       LYS 187  15.318   4.937   9.696
  659    HZ2  LYS 187          2HZ       LYS 187  15.460   5.507   8.172
  660    HZ3  LYS 187          3HZ       LYS 187  14.702   4.093   8.438
  661    H    GLU 188           H        GLU 188   9.372   8.557  11.600
  662    HA   GLU 188           HA       GLU 188  10.810   9.091  14.008
  663    HB2  GLU 188          1HB       GLU 188  10.652  10.655  12.119
  664    HB3  GLU 188          2HB       GLU 188   8.911  10.768  12.326
  665    HG2  GLU 188          1HG       GLU 188   9.922  12.766  13.142
  666    HG3  GLU 188          2HG       GLU 188   9.192  11.915  14.487
  667    H    VAL 189           H        VAL 189   7.342   8.523  13.497
  668    HA   VAL 189           HA       VAL 189   6.609   9.586  16.099
  669    HB   VAL 189           HB       VAL 189   4.412   9.232  15.673
  670   HG11  VAL 189          1HG1      VAL 189   3.952  10.115  13.485
  671   HG12  VAL 189          2HG1      VAL 189   5.450  10.853  14.076
  672   HG13  VAL 189          3HG1      VAL 189   5.510   9.558  12.858
  673   HG21  VAL 189          1HG2      VAL 189   3.466   7.771  13.930
  674   HG22  VAL 189          2HG2      VAL 189   5.088   7.145  13.567
  675   HG23  VAL 189          3HG2      VAL 189   4.336   6.855  15.152
  676    H    MET 190           H        MET 190   8.236   6.815  15.529
  677    HA   MET 190           HA       MET 190   6.990   5.318  17.783
  678    HB2  MET 190          1HB       MET 190   8.225   4.191  15.248
  679    HB3  MET 190          2HB       MET 190   7.662   3.249  16.632
  680    HG2  MET 190          1HG       MET 190   5.937   4.985  14.822
  681    HG3  MET 190          2HG       MET 190   6.042   3.233  14.796
  682    HE1  MET 190          1HE       MET 190   2.412   3.699  15.998
  683    HE2  MET 190          2HE       MET 190   3.310   4.646  14.792
  684    HE3  MET 190          3HE       MET 190   3.504   2.880  14.860
  685    H    SER 191           H        SER 191   8.280   5.467  19.408
  686    HA   SER 191           HA       SER 191  10.884   6.328  19.541
  687    HB2  SER 191          1HB       SER 191   9.478   4.459  21.477
  688    HB3  SER 191          2HB       SER 191  10.959   5.373  21.829
  689    HG   SER 191           HG       SER 191   9.069   6.479  22.534
  690    HA   PRO 192           HA       PRO 192  13.505   3.049  18.168
  691    HB2  PRO 192          1HB       PRO 192  15.464   3.925  20.293
  692    HB3  PRO 192          2HB       PRO 192  15.744   3.641  18.547
  693    HG2  PRO 192          1HG       PRO 192  15.497   6.163  19.475
  694    HG3  PRO 192          2HG       PRO 192  14.643   5.689  17.968
  695    HD2  PRO 192          1HD       PRO 192  13.520   5.872  20.781
  696    HD3  PRO 192          2HD       PRO 192  12.863   6.508  19.243
  697    H    THR 193           H        THR 193  12.887   3.143  21.650
  698    HA   THR 193           HA       THR 193  14.096   0.600  22.205
  699    HB   THR 193           HB       THR 193  13.842   2.484  23.837
  700    HG1  THR 193          1HG       THR 193  13.814   0.995  25.495
  701   HG21  THR 193          1HG2      THR 193  11.915   2.483  25.305
  702   HG22  THR 193          2HG2      THR 193  11.145   1.162  24.401
  703   HG23  THR 193          3HG2      THR 193  11.341   2.765  23.653
  704    H    GLY 194           H        GLY 194  13.293  -1.374  22.787
  705    HA2  GLY 194          1HA       GLY 194  11.937  -3.231  22.679
  706    HA3  GLY 194          2HA       GLY 194  10.536  -2.170  22.614
  707    H    SER 195           H        SER 195  10.149  -4.320  21.273
  708    HA   SER 195           HA       SER 195   9.909  -3.482  18.497
  709    HB2  SER 195          1HB       SER 195  10.975  -5.469  17.517
  710    HB3  SER 195          2HB       SER 195  12.141  -4.458  18.376
  711    HG   SER 195           HG       SER 195  12.424  -6.675  18.859
  712    H    ALA 196           H        ALA 196   8.346  -4.655  17.321
  713    HA   ALA 196           HA       ALA 196   6.407  -6.204  18.870
  714    HB1  ALA 196          1HB       ALA 196   5.693  -4.635  17.099
  715    HB2  ALA 196          2HB       ALA 196   6.572  -5.604  15.894
  716    HB3  ALA 196          3HB       ALA 196   5.179  -6.295  16.747
  717    H    ARG 197           H        ARG 197   5.851  -8.369  18.510
  718    HA   ARG 197           HA       ARG 197   7.322 -10.130  16.755
  719    HB2  ARG 197          1HB       ARG 197   8.281 -11.602  18.435
  720    HB3  ARG 197          2HB       ARG 197   9.026 -10.024  18.493
  721    HG2  ARG 197          1HG       ARG 197   6.865 -10.915  20.458
  722    HG3  ARG 197          2HG       ARG 197   8.589 -11.187  20.693
  723    HD2  ARG 197          1HD       ARG 197   8.978  -8.713  20.562
  724    HD3  ARG 197          2HD       ARG 197   7.219  -8.478  20.529
  725    HE   ARG 197           HE       ARG 197   7.803 -10.126  22.745
  726   HH11  ARG 197          1HH1      ARG 197   8.400  -6.782  21.818
  727   HH12  ARG 197          2HH1      ARG 197   8.433  -6.255  23.484
  728   HH21  ARG 197          1HH2      ARG 197   7.883  -9.368  24.825
  729   HH22  ARG 197          2HH2      ARG 197   8.164  -7.680  25.129
  730    H    GLY 198           H        GLY 198   6.499 -12.241  16.671
  731    HA2  GLY 198          1HA       GLY 198   4.378 -13.398  18.136
  732    HA3  GLY 198          2HA       GLY 198   3.668 -12.396  16.860
  733    H    ARG 199           H        ARG 199   2.851 -14.582  16.226
  734    HA   ARG 199           HA       ARG 199   4.483 -15.649  14.035
  735    HB2  ARG 199          1HB       ARG 199   5.228 -17.083  15.851
  736    HB3  ARG 199          2HB       ARG 199   3.575 -17.348  16.391
  737    HG2  ARG 199          1HG       ARG 199   4.386 -19.331  15.283
  738    HG3  ARG 199          2HG       ARG 199   3.070 -18.631  14.359
  739    HD2  ARG 199          1HD       ARG 199   5.359 -17.447  13.224
  740    HD3  ARG 199          2HD       ARG 199   5.909 -19.065  13.619
  741    HE   ARG 199           HE       ARG 199   3.761 -18.272  11.702
  742   HH11  ARG 199          1HH1      ARG 199   5.454 -21.039  13.075
  743   HH12  ARG 199          2HH1      ARG 199   4.820 -22.094  11.840
  744   HH21  ARG 199          1HH2      ARG 199   2.991 -19.555  10.351
  745   HH22  ARG 199          2HH2      ARG 199   3.422 -21.267  10.268
  746    H    SER 200           H        SER 200   3.307 -16.081  12.317
  747    HA   SER 200           HA       SER 200   0.376 -16.651  12.495
  748    HB2  SER 200          1HB       SER 200   1.752 -14.612  10.714
  749    HB3  SER 200          2HB       SER 200   0.088 -15.197  10.481
  750    HG   SER 200           HG       SER 200  -0.019 -13.349  11.748
  751    H5'    G 201           H5'        G 201   2.456 -12.195  12.364
  752   H5''    G 201           H5"        G 201   2.726 -13.168  13.811
  753    H4'    G 201           H4'        G 201   5.176 -12.785  13.599
  754    H3'    G 201           H3'        G 201   4.425 -10.783  11.638
  755    H2'    G 201           H2'        G 201   4.413 -12.267   9.876
  756   HO2'    G 201           HO2        G 201   7.106 -11.655  10.414
  757    H1'    G 201           H1'        G 201   6.440 -13.979  11.357
  758    H8     G 201          8H          G 201   3.791 -13.897   8.558
  759    H1     G 201          1H          G 201   6.746 -19.563   9.345
  760    H21    G 201          1H2         G 201   8.177 -19.397  11.082
  761    H22    G 201          2H2         G 201   8.260 -17.901  11.996
  762   HO5'    G 201           HO5        G 201   4.013 -10.941  14.312
  763    H5'    U 202           H5'        U 202   6.214  -8.542  10.849
  764   H5''    U 202           H5"        U 202   7.359  -7.808  11.978
  765    H4'    U 202           H4'        U 202   6.185  -6.067  10.828
  766    H3'    U 202           H3'        U 202   6.423  -6.133  13.567
  767    H2'    U 202           H2'        U 202   4.237  -6.981  13.929
  768   HO2'    U 202           HO2        U 202   4.373  -4.277  14.387
  769    H1'    U 202           H1'        U 202   3.241  -5.067  11.808
  770    H3     U 202          3H          U 202  -1.050  -6.232  12.727
  771    H5     U 202          5H          U 202   0.965  -9.899  12.945
  772    H6     U 202          6H          U 202   3.074  -8.725  12.562
  773    H5'    A 203           H5'        A 203   7.401  -2.657  10.848
  774   H5''    A 203           H5"        A 203   8.724  -2.578  12.013
  775    H4'    A 203           H4'        A 203   8.932  -0.814  10.389
  776    H3'    A 203           H3'        A 203   9.230  -0.354  13.071
  777    H2'    A 203           H2'        A 203   7.008   0.329  13.500
  778   HO2'    A 203           HO2        A 203   8.706   2.475  12.954
  779    H1'    A 203           H1'        A 203   7.016   1.985  10.988
  780    H8     A 203          8H          A 203   4.798  -0.060  13.417
  781    H61    A 203          1H6         A 203   0.347   3.358  10.509
  782    H62    A 203          2H6         A 203   0.548   2.328  11.944
  783    H2     A 203          2H          A 203   3.951   3.856   8.388
  784    H5'    G 204           H5'        G 204  10.404   2.104   9.050
  785   H5''    G 204           H5"        G 204   9.397   0.704   8.647
  786    H4'    G 204           H4'        G 204  11.481  -0.171   7.363
  787    H3'    G 204           H3'        G 204  12.804   1.942   8.455
  788    H2'    G 204           H2'        G 204  11.274   3.545   7.536
  789   HO2'    G 204           HO2        G 204  13.571   3.440   5.888
  790    H1'    G 204           H1'        G 204  11.534   2.139   4.883
  791    H8     G 204          8H          G 204  10.133   3.496   3.189
  792    H1     G 204          1H          G 204   5.894   5.279   7.716
  793    H21    G 204          1H2         G 204   6.438   4.211   9.594
  794    H22    G 204          2H2         G 204   8.015   3.446   9.731
  795    H5'    U 205           H5'        U 205  14.152   1.157   3.923
  796   H5''    U 205           H5"        U 205  15.913   1.016   4.011
  797    H4'    U 205           H4'        U 205  16.205   3.216   2.994
  798    H3'    U 205           H3'        U 205  13.709   3.970   3.825
  799   HO3'    U 205           HO3        U 205  13.922   5.662   2.337
  800    H2'    U 205           H2'        U 205  12.606   2.276   2.526
  801   HO2'    U 205           HO2        U 205  12.581   4.658   0.923
  802    H1'    U 205           H1'        U 205  14.347   3.170   0.209
  803    H3     U 205          3H          U 205  11.877   0.618  -2.636
  804    H5     U 205          5H          U 205  12.634  -1.988   0.547
  805    H6     U 205          6H          U 205  13.745  -0.159   1.735
  Start of MODEL    4
    1    H1   GLY 105          1H        GLY 105  -5.329  20.695   3.490
    2    H2   GLY 105          2H        GLY 105  -4.481  19.490   4.208
    3    H3   GLY 105          3H        GLY 105  -6.117  19.475   4.252
    4    HA2  GLY 105          1HA       GLY 105  -6.243  19.187   1.862
    5    HA3  GLY 105          2HA       GLY 105  -4.470  19.189   1.824
    6    H    SER 106           H        SER 106  -4.869  17.086   0.739
    7    HA   SER 106           HA       SER 106  -5.983  14.815   2.032
    8    HB2  SER 106          1HB       SER 106  -3.895  15.047  -0.170
    9    HB3  SER 106          2HB       SER 106  -4.700  13.540   0.291
   10    HG   SER 106           HG       SER 106  -6.667  14.401  -0.265
   11    H    HIS 107           H        HIS 107  -5.063  12.959   2.920
   12    HA   HIS 107           HA       HIS 107  -2.516  13.296   4.426
   13    HB2  HIS 107          1HB       HIS 107  -4.511  12.340   5.553
   14    HB3  HIS 107          2HB       HIS 107  -4.527  11.015   4.389
   15    HD2  HIS 107          2HD       HIS 107  -1.839  12.526   6.844
   16    HE1  HIS 107          1HE       HIS 107  -1.355   8.289   6.813
   17    HE2  HIS 107          2HE       HIS 107  -0.496  10.458   7.813
   18    H    MET 108           H        MET 108  -1.030  11.275   4.370
   19    HA   MET 108           HA       MET 108   0.023  10.898   1.712
   20    HB2  MET 108          1HB       MET 108   0.524   9.365   4.297
   21    HB3  MET 108          2HB       MET 108   1.447   9.169   2.799
   22    HG2  MET 108          1HG       MET 108   2.058  11.584   2.883
   23    HG3  MET 108          2HG       MET 108   1.247  11.726   4.443
   24    HE1  MET 108          1HE       MET 108   2.024   9.123   6.055
   25    HE2  MET 108          2HE       MET 108   3.523   9.652   6.844
   26    HE3  MET 108          3HE       MET 108   2.148  10.771   6.712
   27    H    LYS 109           H        LYS 109  -0.607   9.526   0.164
   28    HA   LYS 109           HA       LYS 109  -2.850   7.740   0.563
   29    HB2  LYS 109          1HB       LYS 109  -1.205   8.482  -1.876
   30    HB3  LYS 109          2HB       LYS 109  -2.486   7.265  -1.932
   31    HG2  LYS 109          1HG       LYS 109  -4.089   8.892  -0.981
   32    HG3  LYS 109          2HG       LYS 109  -2.892  10.177  -1.170
   33    HD2  LYS 109          1HD       LYS 109  -3.982   8.387  -3.391
   34    HD3  LYS 109          2HD       LYS 109  -4.538  10.042  -3.038
   35    HE2  LYS 109          1HE       LYS 109  -2.152  10.815  -3.440
   36    HE3  LYS 109          2HE       LYS 109  -1.789   9.175  -4.010
   37    HZ1  LYS 109          1HZ       LYS 109  -3.741  11.063  -5.218
   38    HZ2  LYS 109          2HZ       LYS 109  -3.614   9.506  -5.684
   39    HZ3  LYS 109          3HZ       LYS 109  -2.355  10.538  -5.895
   40    H    LYS 110           H        LYS 110  -0.843   6.776   2.189
   41    HA   LYS 110           HA       LYS 110  -0.037   4.212   0.870
   42    HB2  LYS 110          1HB       LYS 110   1.786   5.919   0.880
   43    HB3  LYS 110          2HB       LYS 110   1.734   5.916   2.643
   44    HG2  LYS 110          1HG       LYS 110   2.376   3.499   2.638
   45    HG3  LYS 110          2HG       LYS 110   2.335   3.501   0.870
   46    HD2  LYS 110          1HD       LYS 110   4.637   3.685   1.528
   47    HD3  LYS 110          2HD       LYS 110   4.148   5.242   0.857
   48    HE2  LYS 110          1HE       LYS 110   3.809   6.118   3.172
   49    HE3  LYS 110          2HE       LYS 110   4.282   4.545   3.831
   50    HZ1  LYS 110          1HZ       LYS 110   6.491   4.863   2.911
   51    HZ2  LYS 110          2HZ       LYS 110   6.103   6.129   3.844
   52    HZ3  LYS 110          3HZ       LYS 110   6.062   6.290   2.210
   53    H    ILE 111           H        ILE 111  -0.212   2.397   1.973
   54    HA   ILE 111           HA       ILE 111  -0.905   2.507   4.883
   55    HB   ILE 111           HB       ILE 111  -2.150   0.501   4.714
   56   HG12  ILE 111          1HG1      ILE 111  -1.295   0.305   1.825
   57   HG13  ILE 111          2HG1      ILE 111  -0.869  -0.786   3.135
   58   HG21  ILE 111          1HG2      ILE 111  -4.059   1.235   3.474
   59   HG22  ILE 111          2HG2      ILE 111  -3.242   2.647   4.139
   60   HG23  ILE 111          3HG2      ILE 111  -3.062   2.253   2.408
   61   HD11  ILE 111          1HD1      ILE 111  -3.241  -1.474   3.361
   62   HD12  ILE 111          2HD1      ILE 111  -3.644  -0.462   1.953
   63   HD13  ILE 111          3HD1      ILE 111  -2.546  -1.839   1.770
   64    H    PHE 112           H        PHE 112  -0.121   0.970   6.189
   65    HA   PHE 112           HA       PHE 112   2.471  -0.384   5.616
   66    HB2  PHE 112          1HB       PHE 112   1.817   0.972   7.767
   67    HB3  PHE 112          2HB       PHE 112   0.683  -0.325   8.104
   68    HD1  PHE 112          1HD       PHE 112   4.183   0.703   8.015
   69    HD2  PHE 112          2HD       PHE 112   1.518  -2.591   8.773
   70    HE1  PHE 112          1HE       PHE 112   6.008  -0.487   9.168
   71    HE2  PHE 112          2HE       PHE 112   3.351  -3.783   9.970
   72    HZ   PHE 112           HZ       PHE 112   5.587  -2.723  10.197
   73    H    VAL 113           H        VAL 113   2.420  -2.654   5.435
   74    HA   VAL 113           HA       VAL 113  -0.115  -4.151   5.941
   75    HB   VAL 113           HB       VAL 113   1.818  -4.782   3.692
   76   HG11  VAL 113          1HG1      VAL 113   0.111  -6.402   3.022
   77   HG12  VAL 113          2HG1      VAL 113   0.612  -6.735   4.679
   78   HG13  VAL 113          3HG1      VAL 113  -0.932  -5.913   4.379
   79   HG21  VAL 113          1HG2      VAL 113  -0.940  -3.502   3.546
   80   HG22  VAL 113          2HG2      VAL 113   0.606  -2.750   3.088
   81   HG23  VAL 113          3HG2      VAL 113  -0.008  -4.119   2.164
   82    H    GLY 114           H        GLY 114   0.261  -5.196   7.766
   83    HA2  GLY 114          1HA       GLY 114   3.008  -6.183   8.416
   84    HA3  GLY 114          2HA       GLY 114   1.741  -5.764   9.560
   85    H    GLY 115           H        GLY 115   3.368  -8.204   9.324
   86    HA2  GLY 115          1HA       GLY 115   2.967 -10.386   9.978
   87    HA3  GLY 115          2HA       GLY 115   1.233 -10.166   9.730
   88    H    LEU 116           H        LEU 116   3.452  -9.424   7.117
   89    HA   LEU 116           HA       LEU 116   2.187 -11.292   5.285
   90    HB2  LEU 116          1HB       LEU 116   4.574  -9.419   5.179
   91    HB3  LEU 116          2HB       LEU 116   4.261 -10.531   3.853
   92    HG   LEU 116           HG       LEU 116   2.077  -8.651   4.813
   93   HD11  LEU 116          1HD1      LEU 116   4.242  -8.117   2.743
   94   HD12  LEU 116          2HD1      LEU 116   4.018  -7.244   4.274
   95   HD13  LEU 116          3HD1      LEU 116   2.801  -7.107   3.000
   96   HD21  LEU 116          1HD2      LEU 116   1.277  -8.939   2.517
   97   HD22  LEU 116          2HD2      LEU 116   1.518 -10.548   3.223
   98   HD23  LEU 116          3HD2      LEU 116   2.711  -9.890   2.092
   99    H    SER 117           H        SER 117   2.825 -13.265   4.597
  100    HA   SER 117           HA       SER 117   4.817 -14.811   6.042
  101    HB2  SER 117          1HB       SER 117   2.876 -15.931   5.154
  102    HB3  SER 117          2HB       SER 117   3.240 -15.377   3.508
  103    HG   SER 117           HG       SER 117   3.922 -17.594   4.126
  104    H    VAL 118           H        VAL 118   6.878 -15.407   5.435
  105    HA   VAL 118           HA       VAL 118   8.345 -13.862   3.535
  106    HB   VAL 118           HB       VAL 118   9.191 -15.031   5.614
  107   HG11  VAL 118          1HG1      VAL 118   9.554 -17.389   3.712
  108   HG12  VAL 118          2HG1      VAL 118  10.122 -17.256   5.388
  109   HG13  VAL 118          3HG1      VAL 118   8.386 -17.328   5.054
  110   HG21  VAL 118          1HG2      VAL 118  10.857 -15.311   3.091
  111   HG22  VAL 118          2HG2      VAL 118  10.642 -13.825   4.045
  112   HG23  VAL 118          3HG2      VAL 118  11.443 -15.233   4.762
  113    H    ASN 119           H        ASN 119   6.300 -16.559   2.975
  114    HA   ASN 119           HA       ASN 119   7.478 -17.393   0.427
  115    HB2  ASN 119          1HB       ASN 119   6.039 -18.848   1.882
  116    HB3  ASN 119          2HB       ASN 119   4.680 -17.758   1.595
  117   HD21  ASN 119          1HD2      ASN 119   3.280 -18.788   0.206
  118   HD22  ASN 119          2HD2      ASN 119   3.792 -19.683  -1.217
  119    H    THR 120           H        THR 120   5.251 -14.872   1.492
  120    HA   THR 120           HA       THR 120   4.133 -14.252  -1.105
  121    HB   THR 120           HB       THR 120   4.169 -12.619   1.450
  122    HG1  THR 120          1HG       THR 120   2.293 -13.638   1.910
  123   HG21  THR 120          1HG2      THR 120   2.339 -12.445  -0.962
  124   HG22  THR 120          2HG2      THR 120   3.473 -11.204  -0.394
  125   HG23  THR 120          3HG2      THR 120   2.067 -11.635   0.588
  126    H    THR 121           H        THR 121   4.668 -12.793  -2.573
  127    HA   THR 121           HA       THR 121   7.037 -11.061  -2.073
  128    HB   THR 121           HB       THR 121   7.430 -12.896  -3.722
  129    HG1  THR 121          1HG       THR 121   8.636 -11.488  -4.948
  130   HG21  THR 121          1HG2      THR 121   5.298 -12.706  -5.020
  131   HG22  THR 121          2HG2      THR 121   6.737 -12.519  -6.030
  132   HG23  THR 121          3HG2      THR 121   5.793 -11.089  -5.570
  133    H    VAL 122           H        VAL 122   7.184  -9.092  -3.370
  134    HA   VAL 122           HA       VAL 122   5.128  -7.360  -2.575
  135    HB   VAL 122           HB       VAL 122   7.530  -6.817  -3.038
  136   HG11  VAL 122          1HG1      VAL 122   8.234  -6.079  -5.224
  137   HG12  VAL 122          2HG1      VAL 122   7.698  -7.760  -5.350
  138   HG13  VAL 122          3HG1      VAL 122   6.653  -6.441  -5.932
  139   HG21  VAL 122          1HG2      VAL 122   5.471  -4.956  -4.277
  140   HG22  VAL 122          2HG2      VAL 122   5.877  -5.072  -2.549
  141   HG23  VAL 122          3HG2      VAL 122   7.091  -4.518  -3.723
  142    H    GLU 123           H        GLU 123   5.468  -8.935  -5.721
  143    HA   GLU 123           HA       GLU 123   3.405  -7.424  -7.044
  144    HB2  GLU 123          1HB       GLU 123   4.465 -10.227  -7.604
  145    HB3  GLU 123          2HB       GLU 123   3.471  -9.287  -8.708
  146    HG2  GLU 123          1HG       GLU 123   6.276  -8.540  -7.764
  147    HG3  GLU 123          2HG       GLU 123   5.871  -9.287  -9.300
  148    H    ASP 124           H        ASP 124   3.251 -10.277  -4.924
  149    HA   ASP 124           HA       ASP 124   0.503 -11.033  -5.548
  150    HB2  ASP 124          1HB       ASP 124   1.976 -11.354  -2.904
  151    HB3  ASP 124          2HB       ASP 124   0.566 -12.245  -3.441
  152    H    VAL 125           H        VAL 125   2.114  -8.953  -3.146
  153    HA   VAL 125           HA       VAL 125  -0.248  -8.103  -1.767
  154    HB   VAL 125           HB       VAL 125   2.445  -6.696  -1.909
  155   HG11  VAL 125          1HG1      VAL 125   0.690  -5.288  -0.931
  156   HG12  VAL 125          2HG1      VAL 125   0.234  -6.600   0.183
  157   HG13  VAL 125          3HG1      VAL 125   1.823  -5.815   0.314
  158   HG21  VAL 125          1HG2      VAL 125   2.865  -7.924   0.263
  159   HG22  VAL 125          2HG2      VAL 125   1.433  -8.908  -0.073
  160   HG23  VAL 125          3HG2      VAL 125   2.837  -8.966  -1.157
  161    H    LYS 126           H        LYS 126   1.613  -6.527  -4.398
  162    HA   LYS 126           HA       LYS 126  -0.139  -4.301  -4.777
  163    HB2  LYS 126          1HB       LYS 126   2.058  -4.366  -5.772
  164    HB3  LYS 126          2HB       LYS 126   1.662  -5.814  -6.707
  165    HG2  LYS 126          1HG       LYS 126   0.076  -4.586  -8.079
  166    HG3  LYS 126          2HG       LYS 126   0.241  -3.143  -7.062
  167    HD2  LYS 126          1HD       LYS 126   2.618  -2.937  -7.715
  168    HD3  LYS 126          2HD       LYS 126   2.480  -4.412  -8.698
  169    HE2  LYS 126          1HE       LYS 126   0.710  -3.312 -10.066
  170    HE3  LYS 126          2HE       LYS 126   0.894  -1.835  -9.115
  171    HZ1  LYS 126          1HZ       LYS 126   3.203  -1.701  -9.902
  172    HZ2  LYS 126          2HZ       LYS 126   2.183  -1.743 -11.176
  173    HZ3  LYS 126          3HZ       LYS 126   3.030  -3.078 -10.769
  174    H    HIS 127           H        HIS 127  -0.223  -7.496  -6.493
  175    HA   HIS 127           HA       HIS 127  -2.544  -7.013  -7.998
  176    HB2  HIS 127          1HB       HIS 127  -0.922  -8.895  -8.244
  177    HB3  HIS 127          2HB       HIS 127  -1.596  -9.650  -6.800
  178    HD2  HIS 127          2HD       HIS 127  -1.979  -9.426 -10.473
  179    HE1  HIS 127          1HE       HIS 127  -5.518 -11.423  -9.160
  180    HE2  HIS 127          2HE       HIS 127  -4.115 -10.819 -11.198
  181    H    TYR 128           H        TYR 128  -2.353  -8.361  -4.654
  182    HA   TYR 128           HA       TYR 128  -5.184  -8.671  -4.433
  183    HB2  TYR 128          1HB       TYR 128  -3.844 -10.002  -3.045
  184    HB3  TYR 128          2HB       TYR 128  -3.012  -8.605  -2.368
  185    HD1  TYR 128          1HD       TYR 128  -6.203 -10.479  -2.411
  186    HD2  TYR 128          2HD       TYR 128  -4.002  -7.240  -0.592
  187    HE1  TYR 128          1HE       TYR 128  -7.915 -10.324  -0.604
  188    HE2  TYR 128          2HE       TYR 128  -5.718  -7.077   1.190
  189    HH   TYR 128           HH       TYR 128  -7.803  -7.795   1.896
  190    H    PHE 129           H        PHE 129  -3.128  -5.943  -3.321
  191    HA   PHE 129           HA       PHE 129  -5.449  -4.548  -2.362
  192    HB2  PHE 129          1HB       PHE 129  -2.588  -3.726  -2.561
  193    HB3  PHE 129          2HB       PHE 129  -3.851  -2.595  -2.118
  194    HD1  PHE 129          1HD       PHE 129  -5.531  -3.373  -0.196
  195    HD2  PHE 129          2HD       PHE 129  -1.603  -5.012  -0.824
  196    HE1  PHE 129          1HE       PHE 129  -5.510  -4.250   2.134
  197    HE2  PHE 129          2HE       PHE 129  -1.589  -5.872   1.501
  198    HZ   PHE 129           HZ       PHE 129  -3.543  -5.486   2.985
  199    H    GLU 130           H        GLU 130  -4.086  -4.560  -5.543
  200    HA   GLU 130           HA       GLU 130  -5.343  -2.225  -6.587
  201    HB2  GLU 130          1HB       GLU 130  -4.587  -4.914  -7.763
  202    HB3  GLU 130          2HB       GLU 130  -5.477  -3.730  -8.728
  203    HG2  GLU 130          1HG       GLU 130  -3.747  -2.049  -8.392
  204    HG3  GLU 130          2HG       GLU 130  -2.817  -3.165  -7.396
  205    H    GLN 131           H        GLN 131  -6.817  -5.307  -5.694
  206    HA   GLN 131           HA       GLN 131  -9.105  -5.169  -7.366
  207    HB2  GLN 131          1HB       GLN 131  -8.891  -6.524  -4.634
  208    HB3  GLN 131          2HB       GLN 131 -10.018  -6.901  -5.954
  209    HG2  GLN 131          1HG       GLN 131  -7.886  -7.226  -7.394
  210    HG3  GLN 131          2HG       GLN 131  -7.005  -7.284  -5.888
  211   HE21  GLN 131          1HE2      GLN 131  -6.386  -9.447  -6.852
  212   HE22  GLN 131          2HE2      GLN 131  -7.442 -10.797  -6.448
  213    H    PHE 132           H        PHE 132  -8.471  -3.659  -4.312
  214    HA   PHE 132           HA       PHE 132 -11.175  -2.762  -3.778
  215    HB2  PHE 132          1HB       PHE 132  -8.517  -1.756  -2.714
  216    HB3  PHE 132          2HB       PHE 132 -10.099  -1.278  -2.109
  217    HD1  PHE 132          1HD       PHE 132 -11.744  -3.307  -1.457
  218    HD2  PHE 132          2HD       PHE 132  -7.447  -3.565  -1.690
  219    HE1  PHE 132          1HE       PHE 132 -11.786  -5.361  -0.062
  220    HE2  PHE 132          2HE       PHE 132  -7.487  -5.571  -0.244
  221    HZ   PHE 132           HZ       PHE 132  -9.657  -6.489   0.564
  222    H    GLY 133           H        GLY 133  -8.686  -1.411  -5.806
  223    HA2  GLY 133          1HA       GLY 133 -10.397   0.544  -7.011
  224    HA3  GLY 133          2HA       GLY 133  -9.356   1.333  -5.829
  225    H    LYS 134           H        LYS 134  -7.181   1.557  -6.240
  226    HA   LYS 134           HA       LYS 134  -5.772   0.015  -8.240
  227    HB2  LYS 134          1HB       LYS 134  -6.737   1.615  -9.775
  228    HB3  LYS 134          2HB       LYS 134  -6.214   2.975  -8.783
  229    HG2  LYS 134          1HG       LYS 134  -3.864   2.500  -9.272
  230    HG3  LYS 134          2HG       LYS 134  -4.306   0.990 -10.097
  231    HD2  LYS 134          1HD       LYS 134  -5.516   2.280 -11.826
  232    HD3  LYS 134          2HD       LYS 134  -5.101   3.795 -10.994
  233    HE2  LYS 134          1HE       LYS 134  -2.684   3.296 -11.289
  234    HE3  LYS 134          2HE       LYS 134  -3.092   1.781 -12.105
  235    HZ1  LYS 134          1HZ       LYS 134  -4.189   3.090 -13.847
  236    HZ2  LYS 134          2HZ       LYS 134  -2.630   3.547 -13.704
  237    HZ3  LYS 134          3HZ       LYS 134  -3.813   4.492 -13.096
  238    H    VAL 135           H        VAL 135  -3.723  -0.227  -7.713
  239    HA   VAL 135           HA       VAL 135  -2.503   1.264  -5.442
  240    HB   VAL 135           HB       VAL 135  -1.756  -1.254  -6.962
  241   HG11  VAL 135          1HG1      VAL 135   0.375  -0.236  -6.478
  242   HG12  VAL 135          2HG1      VAL 135  -0.124   0.111  -4.806
  243   HG13  VAL 135          3HG1      VAL 135   0.106  -1.556  -5.340
  244   HG21  VAL 135          1HG2      VAL 135  -2.439  -0.741  -4.031
  245   HG22  VAL 135          2HG2      VAL 135  -3.544  -1.426  -5.225
  246   HG23  VAL 135          3HG2      VAL 135  -2.091  -2.325  -4.765
  247    H    ASP 136           H        ASP 136  -0.898   2.663  -5.721
  248    HA   ASP 136           HA       ASP 136  -0.009   3.482  -8.416
  249    HB2  ASP 136          1HB       ASP 136  -0.606   5.279  -7.003
  250    HB3  ASP 136          2HB       ASP 136   0.324   4.635  -5.654
  251    H    ASP 137           H        ASP 137   1.415   2.091  -5.442
  252    HA   ASP 137           HA       ASP 137   3.503   0.722  -6.931
  253    HB2  ASP 137          1HB       ASP 137   4.357   3.143  -6.649
  254    HB3  ASP 137          2HB       ASP 137   4.335   2.862  -4.909
  255    H    ALA 138           H        ALA 138   4.792  -0.665  -5.427
  256    HA   ALA 138           HA       ALA 138   3.869  -0.908  -2.640
  257    HB1  ALA 138          1HB       ALA 138   3.758  -3.250  -4.592
  258    HB2  ALA 138          2HB       ALA 138   3.459  -3.333  -2.844
  259    HB3  ALA 138          3HB       ALA 138   2.353  -2.419  -3.887
  260    H    MET 139           H        MET 139   5.382  -1.872  -1.249
  261    HA   MET 139           HA       MET 139   7.863  -3.045  -2.306
  262    HB2  MET 139          1HB       MET 139   9.358  -1.490  -1.143
  263    HB3  MET 139          2HB       MET 139   8.483  -0.739  -2.473
  264    HG2  MET 139          1HG       MET 139   6.936   0.341  -0.884
  265    HG3  MET 139          2HG       MET 139   7.755  -0.447   0.465
  266    HE1  MET 139          1HE       MET 139   8.212   1.670   1.819
  267    HE2  MET 139          2HE       MET 139   8.872   3.173   1.136
  268    HE3  MET 139          3HE       MET 139   7.273   2.589   0.617
  269    H    LEU 140           H        LEU 140   8.668  -4.579  -0.981
  270    HA   LEU 140           HA       LEU 140   7.702  -4.712   1.846
  271    HB2  LEU 140          1HB       LEU 140   9.108  -6.904   0.303
  272    HB3  LEU 140          2HB       LEU 140   8.361  -7.007   1.897
  273    HG   LEU 140           HG       LEU 140   6.942  -6.677  -0.778
  274   HD11  LEU 140          1HD1      LEU 140   7.717  -8.959  -0.210
  275   HD12  LEU 140          2HD1      LEU 140   5.948  -8.843  -0.207
  276   HD13  LEU 140          3HD1      LEU 140   6.836  -8.868   1.330
  277   HD21  LEU 140          1HD2      LEU 140   5.665  -5.347   0.775
  278   HD22  LEU 140          2HD2      LEU 140   5.805  -6.593   2.037
  279   HD23  LEU 140          3HD2      LEU 140   4.831  -6.880   0.574
  280    H    MET 141           H        MET 141   9.205  -4.857   3.558
  281    HA   MET 141           HA       MET 141  11.729  -3.420   2.981
  282    HB2  MET 141          1HB       MET 141  10.635  -4.388   5.638
  283    HB3  MET 141          2HB       MET 141  11.946  -3.245   5.384
  284    HG2  MET 141          1HG       MET 141   8.997  -2.806   4.750
  285    HG3  MET 141          2HG       MET 141   9.905  -2.175   6.107
  286    HE1  MET 141          1HE       MET 141   8.767  -1.682   2.518
  287    HE2  MET 141          2HE       MET 141   9.741  -0.319   1.921
  288    HE3  MET 141          3HE       MET 141  10.455  -1.931   1.996
  289    H    PHE 142           H        PHE 142  13.678  -4.403   2.740
  290    HA   PHE 142           HA       PHE 142  13.823  -7.297   3.278
  291    HB2  PHE 142          1HB       PHE 142  15.109  -5.647   1.162
  292    HB3  PHE 142          2HB       PHE 142  15.735  -7.223   1.607
  293    HD1  PHE 142          1HD       PHE 142  14.485  -9.289   1.220
  294    HD2  PHE 142          2HD       PHE 142  12.900  -5.464   0.045
  295    HE1  PHE 142          1HE       PHE 142  12.767 -10.432  -0.162
  296    HE2  PHE 142          2HE       PHE 142  11.177  -6.602  -1.337
  297    HZ   PHE 142           HZ       PHE 142  11.103  -9.090  -1.439
  298    H    ASP 143           H        ASP 143  15.318  -8.466   4.225
  299    HA   ASP 143           HA       ASP 143  17.370  -7.035   5.829
  300    HB2  ASP 143          1HB       ASP 143  16.019  -8.277   7.253
  301    HB3  ASP 143          2HB       ASP 143  16.019  -9.679   6.186
  302    H    LYS 144           H        LYS 144  19.252  -6.788   4.907
  303    HA   LYS 144           HA       LYS 144  20.233  -8.296   2.686
  304    HB2  LYS 144          1HB       LYS 144  21.634  -6.405   4.621
  305    HB3  LYS 144          2HB       LYS 144  22.384  -7.069   3.163
  306    HG2  LYS 144          1HG       LYS 144  20.617  -6.058   1.758
  307    HG3  LYS 144          2HG       LYS 144  19.875  -5.337   3.200
  308    HD2  LYS 144          1HD       LYS 144  21.976  -4.098   3.665
  309    HD3  LYS 144          2HD       LYS 144  22.710  -4.773   2.208
  310    HE2  LYS 144          1HE       LYS 144  20.207  -3.022   2.279
  311    HE3  LYS 144          2HE       LYS 144  21.839  -2.434   1.954
  312    HZ1  LYS 144          1HZ       LYS 144  20.372  -4.389   0.262
  313    HZ2  LYS 144          2HZ       LYS 144  21.903  -3.880  -0.013
  314    HZ3  LYS 144          3HZ       LYS 144  20.661  -2.829  -0.111
  315    H    THR 145           H        THR 145  20.351  -9.167   6.015
  316    HA   THR 145           HA       THR 145  22.704 -10.785   5.932
  317    HB   THR 145           HB       THR 145  20.467 -11.509   7.775
  318    HG1  THR 145          1HG       THR 145  20.428  -9.366   7.961
  319   HG21  THR 145          1HG2      THR 145  22.335 -11.775   9.368
  320   HG22  THR 145          2HG2      THR 145  23.487 -11.254   8.118
  321   HG23  THR 145          3HG2      THR 145  22.577 -12.770   7.927
  322    H    THR 146           H        THR 146  19.397 -11.566   5.025
  323    HA   THR 146           HA       THR 146  20.395 -14.070   3.820
  324    HB   THR 146           HB       THR 146  18.980 -15.550   4.720
  325    HG1  THR 146          1HG       THR 146  17.036 -15.097   5.562
  326   HG21  THR 146          1HG2      THR 146  19.107 -13.600   7.065
  327   HG22  THR 146          2HG2      THR 146  20.392 -14.755   6.617
  328   HG23  THR 146          3HG2      THR 146  18.810 -15.347   7.139
  329    H    ASN 147           H        ASN 147  18.823 -11.327   3.107
  330    HA   ASN 147           HA       ASN 147  17.622 -10.532   1.450
  331    HB2  ASN 147          1HB       ASN 147  19.218 -11.819   0.035
  332    HB3  ASN 147          2HB       ASN 147  18.043 -13.131  -0.059
  333   HD21  ASN 147          1HD2      ASN 147  18.222  -9.555  -0.631
  334   HD22  ASN 147          2HD2      ASN 147  17.243  -9.636  -2.085
  335    H    ARG 148           H        ARG 148  16.395 -12.451   3.574
  336    HA   ARG 148           HA       ARG 148  13.682 -12.919   2.567
  337    HB2  ARG 148          1HB       ARG 148  13.128 -13.328   4.908
  338    HB3  ARG 148          2HB       ARG 148  14.631 -14.158   4.504
  339    HG2  ARG 148          1HG       ARG 148  15.887 -12.196   5.538
  340    HG3  ARG 148          2HG       ARG 148  14.335 -11.544   6.071
  341    HD2  ARG 148          1HD       ARG 148  13.941 -13.375   7.545
  342    HD3  ARG 148          2HD       ARG 148  15.241 -14.339   6.813
  343    HE   ARG 148           HE       ARG 148  16.336 -11.876   7.794
  344   HH11  ARG 148          1HH1      ARG 148  15.284 -14.961   9.104
  345   HH12  ARG 148          2HH1      ARG 148  16.451 -14.866  10.398
  346   HH21  ARG 148          1HH2      ARG 148  17.676 -11.805   9.312
  347   HH22  ARG 148          2HH2      ARG 148  17.811 -13.060  10.551
  348    H    HIS 149           H        HIS 149  11.787 -11.699   3.244
  349    HA   HIS 149           HA       HIS 149  12.327  -8.807   3.682
  350    HB2  HIS 149          1HB       HIS 149  10.162  -8.298   3.072
  351    HB3  HIS 149          2HB       HIS 149  10.717  -9.472   1.896
  352    HD2  HIS 149          2HD       HIS 149   8.980 -11.320   1.379
  353    HE1  HIS 149          1HE       HIS 149   6.479 -10.895   4.795
  354    HE2  HIS 149          2HE       HIS 149   6.766 -12.101   2.575
  355    H    ARG 150           H        ARG 150  11.269  -7.668   5.378
  356    HA   ARG 150           HA       ARG 150  11.823  -8.871   7.894
  357    HB2  ARG 150          1HB       ARG 150  12.246  -6.498   6.874
  358    HB3  ARG 150          2HB       ARG 150  10.600  -6.126   7.404
  359    HG2  ARG 150          1HG       ARG 150  11.252  -6.605   9.723
  360    HG3  ARG 150          2HG       ARG 150  12.843  -7.171   9.178
  361    HD2  ARG 150          1HD       ARG 150  13.527  -4.967   8.537
  362    HD3  ARG 150          2HD       ARG 150  11.868  -4.354   8.616
  363    HE   ARG 150           HE       ARG 150  12.957  -5.396  11.151
  364   HH11  ARG 150          1HH1      ARG 150  12.645  -2.407   9.270
  365   HH12  ARG 150          2HH1      ARG 150  12.301  -1.494  10.728
  366   HH21  ARG 150          1HH2      ARG 150  12.656  -4.026  12.933
  367   HH22  ARG 150          2HH2      ARG 150  12.388  -2.312  12.625
  368    H    GLY 151           H        GLY 151   9.093  -9.527   6.347
  369    HA2  GLY 151          1HA       GLY 151   7.135 -10.492   7.157
  370    HA3  GLY 151          2HA       GLY 151   7.472  -9.886   8.779
  371    H    PHE 152           H        PHE 152   7.739  -7.340   6.512
  372    HA   PHE 152           HA       PHE 152   4.911  -6.698   6.318
  373    HB2  PHE 152          1HB       PHE 152   4.939  -4.662   7.594
  374    HB3  PHE 152          2HB       PHE 152   5.439  -5.965   8.639
  375    HD1  PHE 152          1HD       PHE 152   7.845  -6.127   9.393
  376    HD2  PHE 152          2HD       PHE 152   6.380  -2.813   7.050
  377    HE1  PHE 152          1HE       PHE 152   9.796  -4.762  10.088
  378    HE2  PHE 152          2HE       PHE 152   8.336  -1.460   7.740
  379    HZ   PHE 152           HZ       PHE 152  10.056  -2.436   9.239
  380    H    GLY 153           H        GLY 153   4.600  -4.560   5.258
  381    HA2  GLY 153          1HA       GLY 153   6.810  -3.259   3.868
  382    HA3  GLY 153          2HA       GLY 153   5.784  -4.225   2.803
  383    H    PHE 154           H        PHE 154   5.587  -2.040   1.858
  384    HA   PHE 154           HA       PHE 154   3.240  -0.602   2.954
  385    HB2  PHE 154          1HB       PHE 154   5.704   0.613   1.689
  386    HB3  PHE 154          2HB       PHE 154   4.207   1.479   1.990
  387    HD1  PHE 154          1HD       PHE 154   3.588   2.251   4.218
  388    HD2  PHE 154          2HD       PHE 154   7.057  -0.234   3.615
  389    HE1  PHE 154          1HE       PHE 154   4.377   2.788   6.510
  390    HE2  PHE 154          2HE       PHE 154   7.786   0.216   5.920
  391    HZ   PHE 154           HZ       PHE 154   6.479   1.773   7.373
  392    H    VAL 155           H        VAL 155   1.772   0.333   1.564
  393    HA   VAL 155           HA       VAL 155   2.082  -0.131  -1.355
  394    HB   VAL 155           HB       VAL 155  -0.504  -0.814   0.057
  395   HG11  VAL 155          1HG1      VAL 155  -1.108  -1.787  -2.124
  396   HG12  VAL 155          2HG1      VAL 155  -0.784  -0.059  -2.268
  397   HG13  VAL 155          3HG1      VAL 155   0.438  -1.235  -2.804
  398   HG21  VAL 155          1HG2      VAL 155  -0.061  -3.149  -0.481
  399   HG22  VAL 155          2HG2      VAL 155   1.565  -2.731  -1.075
  400   HG23  VAL 155          3HG2      VAL 155   1.149  -2.538   0.642
  401    H    THR 156           H        THR 156   1.763   1.616  -2.458
  402    HA   THR 156           HA       THR 156   0.311   3.905  -1.328
  403    HB   THR 156           HB       THR 156   1.915   4.109  -3.835
  404    HG1  THR 156          1HG       THR 156   3.699   4.584  -2.594
  405   HG21  THR 156          1HG2      THR 156   2.319   6.406  -2.993
  406   HG22  THR 156          2HG2      THR 156   1.322   6.061  -1.564
  407   HG23  THR 156          3HG2      THR 156   0.595   6.092  -3.187
  408    H    PHE 157           H        PHE 157  -1.320   5.095  -2.482
  409    HA   PHE 157           HA       PHE 157  -2.801   3.408  -4.412
  410    HB2  PHE 157          1HB       PHE 157  -3.713   4.874  -1.969
  411    HB3  PHE 157          2HB       PHE 157  -4.830   4.423  -3.241
  412    HD1  PHE 157          1HD       PHE 157  -5.646   2.203  -3.492
  413    HD2  PHE 157          2HD       PHE 157  -2.385   3.006  -0.792
  414    HE1  PHE 157          1HE       PHE 157  -5.882  -0.074  -2.530
  415    HE2  PHE 157          2HE       PHE 157  -2.576   0.712   0.108
  416    HZ   PHE 157           HZ       PHE 157  -4.337  -0.825  -0.725
  417    H    GLU 158           H        GLU 158  -4.311   4.235  -5.816
  418    HA   GLU 158           HA       GLU 158  -3.554   6.670  -7.174
  419    HB2  GLU 158          1HB       GLU 158  -4.523   4.762  -8.290
  420    HB3  GLU 158          2HB       GLU 158  -6.030   4.913  -7.402
  421    HG2  GLU 158          1HG       GLU 158  -4.943   7.173  -9.141
  422    HG3  GLU 158          2HG       GLU 158  -5.798   5.815  -9.854
  423    H    SER 159           H        SER 159  -6.089   5.967  -4.750
  424    HA   SER 159           HA       SER 159  -6.381   8.885  -4.263
  425    HB2  SER 159          1HB       SER 159  -8.222   8.345  -5.729
  426    HB3  SER 159          2HB       SER 159  -8.685   6.965  -4.707
  427    HG   SER 159           HG       SER 159  -9.846   9.040  -4.391
  428    H    GLU 160           H        GLU 160  -6.833   9.476  -2.177
  429    HA   GLU 160           HA       GLU 160  -6.270   7.611  -0.028
  430    HB2  GLU 160          1HB       GLU 160  -6.854   9.459   1.463
  431    HB3  GLU 160          2HB       GLU 160  -5.631   9.899   0.266
  432    HG2  GLU 160          1HG       GLU 160  -7.283  11.096  -1.066
  433    HG3  GLU 160          2HG       GLU 160  -8.577  10.616   0.042
  434    H    ASP 161           H        ASP 161  -9.204   8.442  -1.743
  435    HA   ASP 161           HA       ASP 161 -11.045   7.498   0.268
  436    HB2  ASP 161          1HB       ASP 161 -11.278   7.704  -2.742
  437    HB3  ASP 161          2HB       ASP 161 -12.554   7.057  -1.725
  438    H    ILE 162           H        ILE 162  -9.042   5.761  -2.060
  439    HA   ILE 162           HA       ILE 162 -10.246   3.164  -1.430
  440    HB   ILE 162           HB       ILE 162  -7.494   3.626  -2.609
  441   HG12  ILE 162          1HG1      ILE 162  -8.925   4.786  -4.110
  442   HG13  ILE 162          2HG1      ILE 162  -8.484   3.238  -4.814
  443   HG21  ILE 162          1HG2      ILE 162  -7.840   1.365  -1.846
  444   HG22  ILE 162          2HG2      ILE 162  -9.429   1.264  -2.624
  445   HG23  ILE 162          3HG2      ILE 162  -7.948   1.351  -3.603
  446   HD11  ILE 162          1HD1      ILE 162 -10.748   2.335  -4.184
  447   HD12  ILE 162          2HD1      ILE 162 -11.181   3.944  -3.565
  448   HD13  ILE 162          3HD1      ILE 162 -10.825   3.722  -5.286
  449    H    VAL 163           H        VAL 163  -7.402   5.061  -0.302
  450    HA   VAL 163           HA       VAL 163  -6.319   3.074   1.406
  451    HB   VAL 163           HB       VAL 163  -6.372   6.112   1.774
  452   HG11  VAL 163          1HG1      VAL 163  -5.851   5.180   3.948
  453   HG12  VAL 163          2HG1      VAL 163  -4.696   4.053   3.217
  454   HG13  VAL 163          3HG1      VAL 163  -4.368   5.799   3.219
  455   HG21  VAL 163          1HG2      VAL 163  -5.268   5.371  -0.287
  456   HG22  VAL 163          2HG2      VAL 163  -4.093   5.992   0.875
  457   HG23  VAL 163          3HG2      VAL 163  -4.262   4.239   0.648
  458    H    GLU 164           H        GLU 164  -8.875   5.527   2.104
  459    HA   GLU 164           HA       GLU 164  -9.474   4.661   4.771
  460    HB2  GLU 164          1HB       GLU 164 -11.265   5.908   2.651
  461    HB3  GLU 164          2HB       GLU 164 -11.746   5.674   4.324
  462    HG2  GLU 164          1HG       GLU 164  -9.415   7.408   3.412
  463    HG3  GLU 164          2HG       GLU 164 -11.032   7.989   3.784
  464    H    LYS 165           H        LYS 165 -10.967   3.607   1.675
  465    HA   LYS 165           HA       LYS 165 -12.847   1.746   2.692
  466    HB2  LYS 165          1HB       LYS 165 -12.763   2.628   0.397
  467    HB3  LYS 165          2HB       LYS 165 -11.254   1.782   0.096
  468    HG2  LYS 165          1HG       LYS 165 -12.396  -0.405   0.320
  469    HG3  LYS 165          2HG       LYS 165 -13.936   0.447   0.592
  470    HD2  LYS 165          1HD       LYS 165 -13.703   1.551  -1.626
  471    HD3  LYS 165          2HD       LYS 165 -12.155   0.721  -1.882
  472    HE2  LYS 165          1HE       LYS 165 -13.323  -1.473  -1.752
  473    HE3  LYS 165          2HE       LYS 165 -14.866  -0.636  -1.532
  474    HZ1  LYS 165          1HZ       LYS 165 -13.108  -0.355  -3.922
  475    HZ2  LYS 165          2HZ       LYS 165 -14.558   0.380  -3.723
  476    HZ3  LYS 165          3HZ       LYS 165 -14.486  -1.244  -3.869
  477    H    VAL 166           H        VAL 166  -9.523   1.162   1.653
  478    HA   VAL 166           HA       VAL 166  -9.381  -1.654   2.278
  479    HB   VAL 166           HB       VAL 166  -7.196   0.436   2.016
  480   HG11  VAL 166          1HG1      VAL 166  -5.729  -1.487   1.459
  481   HG12  VAL 166          2HG1      VAL 166  -6.283  -1.537   3.135
  482   HG13  VAL 166          3HG1      VAL 166  -7.043  -2.589   1.916
  483   HG21  VAL 166          1HG2      VAL 166  -8.700   0.049  -0.053
  484   HG22  VAL 166          2HG2      VAL 166  -6.976  -0.209  -0.263
  485   HG23  VAL 166          3HG2      VAL 166  -8.072  -1.594  -0.058
  486    H    CYS 167           H        CYS 167  -8.376   1.272   4.109
  487    HA   CYS 167           HA       CYS 167  -7.288  -0.152   6.337
  488    HB2  CYS 167          1HB       CYS 167  -6.764   2.193   5.729
  489    HB3  CYS 167          2HB       CYS 167  -8.402   2.683   6.204
  490    HG   CYS 167           HG       CYS 167  -8.226   1.995   8.706
  491    H    GLU 168           H        GLU 168 -10.651   1.056   5.775
  492    HA   GLU 168           HA       GLU 168 -11.706   0.546   8.320
  493    HB2  GLU 168          1HB       GLU 168 -12.718   1.930   6.611
  494    HB3  GLU 168          2HB       GLU 168 -12.911   0.542   5.520
  495    HG2  GLU 168          1HG       GLU 168 -14.478  -0.494   7.022
  496    HG3  GLU 168          2HG       GLU 168 -14.184   0.754   8.247
  497    H    ILE 169           H        ILE 169 -11.030  -1.726   5.691
  498    HA   ILE 169           HA       ILE 169 -12.539  -3.965   6.745
  499    HB   ILE 169           HB       ILE 169 -10.196  -3.765   4.832
  500   HG12  ILE 169          1HG1      ILE 169 -13.122  -4.444   4.245
  501   HG13  ILE 169          2HG1      ILE 169 -12.535  -2.789   4.226
  502   HG21  ILE 169          1HG2      ILE 169 -10.115  -5.997   5.767
  503   HG22  ILE 169          2HG2      ILE 169 -11.860  -6.226   5.508
  504   HG23  ILE 169          3HG2      ILE 169 -10.737  -6.106   4.137
  505   HD11  ILE 169          1HD1      ILE 169 -11.582  -5.008   2.394
  506   HD12  ILE 169          2HD1      ILE 169 -12.564  -3.597   1.972
  507   HD13  ILE 169          3HD1      ILE 169 -10.877  -3.375   2.469
  508    H    HIS 170           H        HIS 170  -9.295  -2.744   7.278
  509    HA   HIS 170           HA       HIS 170  -7.710  -3.019   8.821
  510    HB2  HIS 170          1HB       HIS 170  -9.610  -2.656  10.334
  511    HB3  HIS 170          2HB       HIS 170  -9.813  -4.394  10.499
  512    HD2  HIS 170          2HD       HIS 170  -6.174  -3.186  10.535
  513    HE1  HIS 170          1HE       HIS 170  -7.241  -3.920  14.591
  514    HE2  HIS 170          2HE       HIS 170  -5.303  -3.470  12.996
  515    H    PHE 171           H        PHE 171  -9.419  -6.156   8.730
  516    HA   PHE 171           HA       PHE 171  -6.785  -7.477   8.466
  517    HB2  PHE 171          1HB       PHE 171  -9.185  -8.491   9.893
  518    HB3  PHE 171          2HB       PHE 171  -7.974  -9.578   9.234
  519    HD1  PHE 171          1HD       PHE 171  -8.637  -7.071  11.841
  520    HD2  PHE 171          2HD       PHE 171  -5.614  -9.528   9.992
  521    HE1  PHE 171          1HE       PHE 171  -7.141  -6.706  13.790
  522    HE2  PHE 171          2HE       PHE 171  -4.125  -9.171  11.951
  523    HZ   PHE 171           HZ       PHE 171  -4.883  -7.752  13.846
  524    H    HIS 172           H        HIS 172  -6.143  -8.510   6.861
  525    HA   HIS 172           HA       HIS 172  -7.952  -9.010   4.519
  526    HB2  HIS 172          1HB       HIS 172  -5.258  -7.620   4.770
  527    HB3  HIS 172          2HB       HIS 172  -5.880  -8.197   3.241
  528    HD2  HIS 172          2HD       HIS 172  -6.593  -5.494   5.941
  529    HE1  HIS 172          1HE       HIS 172  -8.655  -4.299   2.432
  530    HE2  HIS 172          2HE       HIS 172  -7.965  -3.603   4.748
  531    H    GLU 173           H        GLU 173  -6.731 -10.449   2.829
  532    HA   GLU 173           HA       GLU 173  -4.930 -12.415   4.141
  533    HB2  GLU 173          1HB       GLU 173  -7.026 -13.403   4.520
  534    HB3  GLU 173          2HB       GLU 173  -7.594 -13.098   2.885
  535    HG2  GLU 173          1HG       GLU 173  -5.168 -14.870   3.417
  536    HG3  GLU 173          2HG       GLU 173  -6.796 -15.492   3.596
  537    H    ILE 174           H        ILE 174  -3.309 -13.136   2.984
  538    HA   ILE 174           HA       ILE 174  -3.321 -12.959   0.020
  539    HB   ILE 174           HB       ILE 174  -1.089 -11.789   1.727
  540   HG12  ILE 174          1HG1      ILE 174  -3.129 -10.302   0.022
  541   HG13  ILE 174          2HG1      ILE 174  -3.082 -10.309   1.786
  542   HG21  ILE 174          1HG2      ILE 174  -1.487 -11.819  -1.302
  543   HG22  ILE 174          2HG2      ILE 174  -0.127 -11.076  -0.439
  544   HG23  ILE 174          3HG2      ILE 174  -0.321 -12.817  -0.401
  545   HD11  ILE 174          1HD1      ILE 174  -0.859  -9.235   1.753
  546   HD12  ILE 174          2HD1      ILE 174  -1.007  -9.066  -0.013
  547   HD13  ILE 174          3HD1      ILE 174  -2.160  -8.256   1.051
  548    H    ASN 175           H        ASN 175  -2.520 -14.822  -0.811
  549    HA   ASN 175           HA       ASN 175  -1.800 -16.975  -0.880
  550    HB2  ASN 175          1HB       ASN 175   0.537 -15.818   0.676
  551    HB3  ASN 175          2HB       ASN 175   0.551 -17.360  -0.165
  552   HD21  ASN 175          1HD2      ASN 175   2.074 -14.785  -0.500
  553   HD22  ASN 175          2HD2      ASN 175   2.032 -14.540  -2.250
  554    H    ASN 176           H        ASN 176  -3.720 -16.631   1.092
  555    HA   ASN 176           HA       ASN 176  -4.755 -17.568   2.789
  556    HB2  ASN 176          1HB       ASN 176  -2.746 -19.830   2.574
  557    HB3  ASN 176          2HB       ASN 176  -4.216 -19.864   3.532
  558   HD21  ASN 176          1HD2      ASN 176  -6.272 -20.011   2.477
  559   HD22  ASN 176          2HD2      ASN 176  -6.356 -20.447   0.776
  560    H    LYS 177           H        LYS 177  -1.874 -16.121   3.328
  561    HA   LYS 177           HA       LYS 177  -1.901 -16.439   6.282
  562    HB2  LYS 177          1HB       LYS 177   0.283 -16.270   5.175
  563    HB3  LYS 177          2HB       LYS 177  -0.194 -14.777   4.386
  564    HG2  LYS 177          1HG       LYS 177   1.279 -14.264   6.210
  565    HG3  LYS 177          2HG       LYS 177  -0.307 -13.597   6.527
  566    HD2  LYS 177          1HD       LYS 177   0.629 -14.492   8.565
  567    HD3  LYS 177          2HD       LYS 177  -0.766 -15.474   8.119
  568    HE2  LYS 177          1HE       LYS 177   0.755 -17.192   7.147
  569    HE3  LYS 177          2HE       LYS 177   2.151 -16.180   7.545
  570    HZ1  LYS 177          1HZ       LYS 177   0.274 -17.350   9.536
  571    HZ2  LYS 177          2HZ       LYS 177   1.565 -16.414   9.901
  572    HZ3  LYS 177          3HZ       LYS 177   1.783 -17.887   9.233
  573    H    MET 178           H        MET 178  -2.960 -15.043   7.611
  574    HA   MET 178           HA       MET 178  -4.556 -12.865   6.453
  575    HB2  MET 178          1HB       MET 178  -5.710 -14.188   8.027
  576    HB3  MET 178          2HB       MET 178  -4.422 -14.060   9.230
  577    HG2  MET 178          1HG       MET 178  -4.962 -11.905   9.827
  578    HG3  MET 178          2HG       MET 178  -5.659 -11.501   8.262
  579    HE1  MET 178          1HE       MET 178  -8.026 -11.578   7.577
  580    HE2  MET 178          2HE       MET 178  -7.872 -13.346   7.479
  581    HE3  MET 178          3HE       MET 178  -9.265 -12.620   8.311
  582    H    VAL 179           H        VAL 179  -4.097 -10.776   6.590
  583    HA   VAL 179           HA       VAL 179  -1.667  -9.885   8.045
  584    HB   VAL 179           HB       VAL 179  -0.946  -8.513   6.221
  585   HG11  VAL 179          1HG1      VAL 179  -0.188 -10.860   6.303
  586   HG12  VAL 179          2HG1      VAL 179  -1.466 -11.307   5.143
  587   HG13  VAL 179          3HG1      VAL 179  -0.187 -10.172   4.670
  588   HG21  VAL 179          1HG2      VAL 179  -3.022  -7.889   5.142
  589   HG22  VAL 179          2HG2      VAL 179  -1.932  -8.623   3.967
  590   HG23  VAL 179          3HG2      VAL 179  -3.292  -9.569   4.606
  591    H    GLU 180           H        GLU 180  -1.533  -7.589   8.389
  592    HA   GLU 180           HA       GLU 180  -4.242  -6.371   8.888
  593    HB2  GLU 180          1HB       GLU 180  -3.094  -7.106  10.912
  594    HB3  GLU 180          2HB       GLU 180  -1.682  -6.127  10.488
  595    HG2  GLU 180          1HG       GLU 180  -2.974  -4.069  10.680
  596    HG3  GLU 180          2HG       GLU 180  -4.466  -4.991  10.914
  597    H    CYS 181           H        CYS 181  -4.690  -4.476   7.907
  598    HA   CYS 181           HA       CYS 181  -2.475  -2.901   6.717
  599    HB2  CYS 181          1HB       CYS 181  -4.201  -1.555   5.647
  600    HB3  CYS 181          2HB       CYS 181  -4.346  -3.265   5.225
  601    HG   CYS 181           HG       CYS 181  -6.725  -2.117   5.487
  602    H    LYS 182           H        LYS 182  -2.015  -0.815   7.286
  603    HA   LYS 182           HA       LYS 182  -3.537   0.563   9.435
  604    HB2  LYS 182          1HB       LYS 182  -0.545   0.742   9.593
  605    HB3  LYS 182          2HB       LYS 182  -1.736   0.989  10.847
  606    HG2  LYS 182          1HG       LYS 182  -1.971  -1.451  11.145
  607    HG3  LYS 182          2HG       LYS 182  -0.868  -1.742   9.781
  608    HD2  LYS 182          1HD       LYS 182   0.930  -0.499  10.975
  609    HD3  LYS 182          2HD       LYS 182  -0.143  -0.337  12.383
  610    HE2  LYS 182          1HE       LYS 182  -0.251  -2.800  12.591
  611    HE3  LYS 182          2HE       LYS 182   0.727  -2.982  11.132
  612    HZ1  LYS 182          1HZ       LYS 182   1.641  -1.735  13.665
  613    HZ2  LYS 182          2HZ       LYS 182   2.534  -1.796  12.303
  614    HZ3  LYS 182          3HZ       LYS 182   2.124  -3.186  13.085
  615    H    LYS 183           H        LYS 183  -3.279   2.924   9.236
  616    HA   LYS 183           HA       LYS 183  -2.386   3.895   6.609
  617    HB2  LYS 183          1HB       LYS 183  -3.215   5.324   9.159
  618    HB3  LYS 183          2HB       LYS 183  -2.679   6.177   7.701
  619    HG2  LYS 183          1HG       LYS 183  -4.478   5.269   6.375
  620    HG3  LYS 183          2HG       LYS 183  -4.953   4.153   7.661
  621    HD2  LYS 183          1HD       LYS 183  -5.552   6.085   9.117
  622    HD3  LYS 183          2HD       LYS 183  -5.163   7.190   7.775
  623    HE2  LYS 183          1HE       LYS 183  -6.864   6.094   6.361
  624    HE3  LYS 183          2HE       LYS 183  -7.207   4.922   7.639
  625    HZ1  LYS 183          1HZ       LYS 183  -7.676   7.845   7.846
  626    HZ2  LYS 183          2HZ       LYS 183  -8.024   6.747   9.022
  627    HZ3  LYS 183          3HZ       LYS 183  -8.822   6.729   7.581
  628    H    ALA 184           H        ALA 184  -0.401   4.658   5.996
  629    HA   ALA 184           HA       ALA 184   1.851   4.091   7.740
  630    HB1  ALA 184          1HB       ALA 184   3.210   4.911   5.887
  631    HB2  ALA 184          2HB       ALA 184   1.970   3.780   5.299
  632    HB3  ALA 184          3HB       ALA 184   1.761   5.535   5.069
  633    H    GLN 185           H        GLN 185   3.007   5.474   9.021
  634    HA   GLN 185           HA       GLN 185   2.553   8.401   8.813
  635    HB2  GLN 185          1HB       GLN 185   2.523   6.850  11.418
  636    HB3  GLN 185          2HB       GLN 185   2.390   8.592  11.262
  637    HG2  GLN 185          1HG       GLN 185   0.324   6.589  10.289
  638    HG3  GLN 185          2HG       GLN 185   0.254   7.520  11.771
  639   HE21  GLN 185          1HE2      GLN 185  -1.929   7.859  10.435
  640   HE22  GLN 185          2HE2      GLN 185  -1.943   9.376   9.551
  641    HA   PRO 186           HA       PRO 186   6.812   8.908   8.895
  642    HB2  PRO 186          1HB       PRO 186   6.663  10.968  11.080
  643    HB3  PRO 186          2HB       PRO 186   7.358  11.109   9.434
  644    HG2  PRO 186          1HG       PRO 186   4.963  12.226  10.043
  645    HG3  PRO 186          2HG       PRO 186   5.211  11.397   8.464
  646    HD2  PRO 186          1HD       PRO 186   3.898  10.338  10.974
  647    HD3  PRO 186          2HD       PRO 186   3.343  10.237   9.283
  648    H    LYS 187           H        LYS 187   8.895   8.533   9.956
  649    HA   LYS 187           HA       LYS 187   8.829   6.723  12.196
  650    HB2  LYS 187          1HB       LYS 187  11.072   8.083  10.677
  651    HB3  LYS 187          2HB       LYS 187  11.389   7.239  12.190
  652    HG2  LYS 187          1HG       LYS 187  10.203   5.198  11.212
  653    HG3  LYS 187          2HG       LYS 187  10.185   6.047   9.665
  654    HD2  LYS 187          1HD       LYS 187  12.046   4.423   9.852
  655    HD3  LYS 187          2HD       LYS 187  12.602   6.067   9.563
  656    HE2  LYS 187          1HE       LYS 187  14.026   4.885  11.187
  657    HE3  LYS 187          2HE       LYS 187  13.287   6.325  11.882
  658    HZ1  LYS 187          1HZ       LYS 187  12.369   3.526  12.312
  659    HZ2  LYS 187          2HZ       LYS 187  11.623   4.841  12.941
  660    HZ3  LYS 187          3HZ       LYS 187  13.144   4.451  13.406
  661    H    GLU 188           H        GLU 188   8.971  10.089  12.107
  662    HA   GLU 188           HA       GLU 188   9.847  10.665  14.786
  663    HB2  GLU 188          1HB       GLU 188   7.947  12.165  12.921
  664    HB3  GLU 188          2HB       GLU 188   8.526  12.768  14.465
  665    HG2  GLU 188          1HG       GLU 188   9.947  13.794  12.982
  666    HG3  GLU 188          2HG       GLU 188  10.909  12.470  13.622
  667    H    VAL 189           H        VAL 189   6.831   9.322  13.617
  668    HA   VAL 189           HA       VAL 189   5.783   9.315  16.388
  669    HB   VAL 189           HB       VAL 189   3.644   9.660  15.814
  670   HG11  VAL 189          1HG1      VAL 189   4.991  11.281  13.609
  671   HG12  VAL 189          2HG1      VAL 189   3.470  11.638  14.445
  672   HG13  VAL 189          3HG1      VAL 189   4.995  11.718  15.337
  673   HG21  VAL 189          1HG2      VAL 189   4.242   8.938  12.927
  674   HG22  VAL 189          2HG2      VAL 189   3.267   8.006  14.092
  675   HG23  VAL 189          3HG2      VAL 189   2.689   9.567  13.518
  676    H    MET 190           H        MET 190   7.009   7.315  14.044
  677    HA   MET 190           HA       MET 190   5.813   4.861  15.259
  678    HB2  MET 190          1HB       MET 190   6.539   5.415  12.361
  679    HB3  MET 190          2HB       MET 190   6.122   3.824  12.998
  680    HG2  MET 190          1HG       MET 190   4.286   6.240  13.067
  681    HG3  MET 190          2HG       MET 190   4.254   4.985  11.839
  682    HE1  MET 190          1HE       MET 190   0.943   4.373  13.884
  683    HE2  MET 190          2HE       MET 190   1.720   5.952  13.642
  684    HE3  MET 190          3HE       MET 190   1.640   4.784  12.302
  685    H    SER 191           H        SER 191   7.356   4.216  16.610
  686    HA   SER 191           HA       SER 191   9.897   3.284  15.443
  687    HB2  SER 191          1HB       SER 191  10.422   5.492  16.394
  688    HB3  SER 191          2HB       SER 191   9.791   4.967  17.967
  689    HG   SER 191           HG       SER 191  12.072   4.751  17.825
  690    HA   PRO 192           HA       PRO 192   8.457  -0.180  17.859
  691    HB2  PRO 192          1HB       PRO 192  10.424  -2.000  17.451
  692    HB3  PRO 192          2HB       PRO 192   9.405  -1.397  16.108
  693    HG2  PRO 192          1HG       PRO 192  12.161  -0.414  16.937
  694    HG3  PRO 192          2HG       PRO 192  11.613  -0.906  15.304
  695    HD2  PRO 192          1HD       PRO 192  11.637   1.707  16.122
  696    HD3  PRO 192          2HD       PRO 192  10.376   1.083  15.026
  697    H    THR 193           H        THR 193   9.009  -1.603  19.689
  698    HA   THR 193           HA       THR 193  10.553  -0.295  21.763
  699    HB   THR 193           HB       THR 193   9.728  -1.643  23.324
  700    HG1  THR 193          1HG       THR 193   8.977  -3.766  22.900
  701   HG21  THR 193          1HG2      THR 193   7.389  -2.106  22.983
  702   HG22  THR 193          2HG2      THR 193   7.580  -2.129  21.218
  703   HG23  THR 193          3HG2      THR 193   7.781  -0.608  22.124
  704    H    GLY 194           H        GLY 194  12.192  -1.365  23.115
  705    HA2  GLY 194          1HA       GLY 194  14.404  -2.359  21.498
  706    HA3  GLY 194          2HA       GLY 194  14.392  -2.070  23.237
  707    H    SER 195           H        SER 195  11.770  -4.089  22.650
  708    HA   SER 195           HA       SER 195  13.065  -6.296  23.987
  709    HB2  SER 195          1HB       SER 195  10.712  -5.621  24.357
  710    HB3  SER 195          2HB       SER 195  10.311  -6.162  22.714
  711    HG   SER 195           HG       SER 195   9.899  -7.769  24.324
  712    H    ALA 196           H        ALA 196  13.858  -8.176  23.237
  713    HA   ALA 196           HA       ALA 196  14.195  -8.633  20.358
  714    HB1  ALA 196          1HB       ALA 196  16.056  -8.981  21.941
  715    HB2  ALA 196          2HB       ALA 196  15.111 -10.229  22.789
  716    HB3  ALA 196          3HB       ALA 196  15.630 -10.488  21.109
  717    H    ARG 197           H        ARG 197  13.685 -10.686  19.331
  718    HA   ARG 197           HA       ARG 197  10.999 -11.663  19.785
  719    HB2  ARG 197          1HB       ARG 197  12.313 -11.609  17.565
  720    HB3  ARG 197          2HB       ARG 197  13.191 -13.022  18.164
  721    HG2  ARG 197          1HG       ARG 197  10.801 -14.081  18.479
  722    HG3  ARG 197          2HG       ARG 197  10.245 -12.745  17.468
  723    HD2  ARG 197          1HD       ARG 197  11.975 -13.488  15.748
  724    HD3  ARG 197          2HD       ARG 197  12.273 -14.913  16.749
  725    HE   ARG 197           HE       ARG 197  10.069 -14.460  14.934
  726   HH11  ARG 197          1HH1      ARG 197  10.637 -16.219  17.975
  727   HH12  ARG 197          2HH1      ARG 197   9.228 -17.194  17.690
  728   HH21  ARG 197          1HH2      ARG 197   8.361 -15.639  14.745
  729   HH22  ARG 197          2HH2      ARG 197   7.950 -16.887  15.909
  730    H    GLY 198           H        GLY 198  10.266 -13.520  20.774
  731    HA2  GLY 198          1HA       GLY 198  11.865 -14.934  22.726
  732    HA3  GLY 198          2HA       GLY 198  10.246 -15.370  22.183
  733    H    ARG 199           H        ARG 199  12.932 -16.827  22.598
  734    HA   ARG 199           HA       ARG 199  13.438 -18.114  19.994
  735    HB2  ARG 199          1HB       ARG 199  15.310 -17.638  21.460
  736    HB3  ARG 199          2HB       ARG 199  14.549 -18.485  22.803
  737    HG2  ARG 199          1HG       ARG 199  16.376 -19.792  21.870
  738    HG3  ARG 199          2HG       ARG 199  14.846 -20.640  21.703
  739    HD2  ARG 199          1HD       ARG 199  14.759 -19.795  19.278
  740    HD3  ARG 199          2HD       ARG 199  16.372 -19.140  19.531
  741    HE   ARG 199           HE       ARG 199  17.271 -21.278  19.410
  742   HH11  ARG 199          1HH1      ARG 199  17.274 -23.435  18.906
  743   HH12  ARG 199          2HH1      ARG 199  15.781 -24.326  18.862
  744   HH21  ARG 199          1HH2      ARG 199  13.779 -21.669  19.724
  745   HH22  ARG 199          2HH2      ARG 199  13.862 -23.358  19.293
  746    H    SER 200           H        SER 200  11.507 -18.789  22.803
  747    HA   SER 200           HA       SER 200  10.508 -21.364  21.695
  748    HB2  SER 200          1HB       SER 200  11.675 -20.978  24.481
  749    HB3  SER 200          2HB       SER 200  10.729 -22.387  23.977
  750    HG   SER 200           HG       SER 200  12.307 -22.942  22.501
  751    H5'    G 201           H5'        G 201  10.287 -12.973  12.796
  752   H5''    G 201           H5"        G 201   9.147 -12.501  14.063
  753    H4'    G 201           H4'        G 201   8.696 -11.271  12.012
  754    H3'    G 201           H3'        G 201   6.704 -12.741  13.411
  755    H2'    G 201           H2'        G 201   6.422 -14.375  11.791
  756   HO2'    G 201           HO2        G 201   4.817 -12.166  11.200
  757    H1'    G 201           H1'        G 201   6.981 -12.333   9.632
  758    H8     G 201          8H          G 201   6.698 -13.595   7.457
  759    H1     G 201          1H          G 201   8.658 -19.201   9.954
  760    H21    G 201          1H2         G 201   9.248 -18.870  12.098
  761    H22    G 201          2H2         G 201   9.111 -17.270  12.803
  762   HO5'    G 201           HO5        G 201   8.806 -14.799  12.394
  763    H5'    U 202           H5'        U 202   6.172  -8.511  10.864
  764   H5''    U 202           H5"        U 202   7.205  -7.719  12.065
  765    H4'    U 202           H4'        U 202   5.969  -6.025  10.887
  766    H3'    U 202           H3'        U 202   5.891  -6.334  13.698
  767    H2'    U 202           H2'        U 202   3.671  -6.686  14.007
  768   HO2'    U 202           HO2        U 202   3.961  -4.185  14.233
  769    H1'    U 202           H1'        U 202   2.821  -5.343  11.487
  770    H3     U 202          3H          U 202  -1.247  -6.953  12.694
  771    H5     U 202          5H          U 202   1.212 -10.339  12.943
  772    H6     U 202          6H          U 202   3.140  -8.929  12.420
  773    H5'    A 203           H5'        A 203   7.828  -3.097  11.539
  774   H5''    A 203           H5"        A 203   8.959  -2.928  12.886
  775    H4'    A 203           H4'        A 203   9.352  -1.263  11.153
  776    H3'    A 203           H3'        A 203   9.387  -0.632  13.810
  777    H2'    A 203           H2'        A 203   7.039  -0.079  13.920
  778   HO2'    A 203           HO2        A 203   8.613   2.234  13.516
  779    H1'    A 203           H1'        A 203   7.486   1.550  11.399
  780    H8     A 203          8H          A 203   4.859  -0.638  13.279
  781    H61    A 203          1H6         A 203   0.885   3.157  10.188
  782    H62    A 203          2H6         A 203   0.929   1.911  11.442
  783    H2     A 203          2H          A 203   4.860   4.031   8.843
  784    H5'    G 204           H5'        G 204  10.544   1.986   9.701
  785   H5''    G 204           H5"        G 204   9.348   0.682   9.737
  786    H4'    G 204           H4'        G 204  10.802  -0.545   8.023
  787    H3'    G 204           H3'        G 204  12.773   1.317   8.516
  788    H2'    G 204           H2'        G 204  11.252   3.159   7.926
  789   HO2'    G 204           HO2        G 204  13.048   2.478   5.840
  790    H1'    G 204           H1'        G 204  10.714   1.444   5.497
  791    H8     G 204          8H          G 204   9.515   2.800   3.767
  792    H1     G 204          1H          G 204   6.239   6.196   8.151
  793    H21    G 204          1H2         G 204   6.824   5.585  10.132
  794    H22    G 204          2H2         G 204   8.037   4.331  10.379
  795    H5'    U 205           H5'        U 205  15.268  -0.186   4.286
  796   H5''    U 205           H5"        U 205  13.669   0.551   4.426
  797    H4'    U 205           H4'        U 205  12.832  -1.493   3.058
  798    H3'    U 205           H3'        U 205  15.509  -2.269   3.009
  799   HO3'    U 205           HO3        U 205  14.648  -3.115   0.788
  800    H2'    U 205           H2'        U 205  16.226  -0.358   1.781
  801   HO2'    U 205           HO2        U 205  16.844  -2.124   0.444
  802    H1'    U 205           H1'        U 205  13.669  -0.706   0.187
  803    H3     U 205          3H          U 205  16.277   3.989   0.439
  804    H5     U 205          5H          U 205  13.675   2.852  -2.631
  805    H6     U 205          6H          U 205  13.251   0.758  -1.455
  Start of MODEL    5
    1    H1   GLY 105          1H        GLY 105  -6.840  14.716  -0.401
    2    H2   GLY 105          2H        GLY 105  -6.861  16.358  -0.434
    3    H3   GLY 105          3H        GLY 105  -8.265  15.521  -0.279
    4    HA2  GLY 105          1HA       GLY 105  -7.643  16.450   1.843
    5    HA3  GLY 105          2HA       GLY 105  -7.598  14.677   1.871
    6    H    SER 106           H        SER 106  -5.934  14.152   3.211
    7    HA   SER 106           HA       SER 106  -3.505  15.757   3.422
    8    HB2  SER 106          1HB       SER 106  -2.877  14.193   5.152
    9    HB3  SER 106          2HB       SER 106  -4.573  14.651   5.365
   10    HG   SER 106           HG       SER 106  -4.391  12.428   5.580
   11    H    HIS 107           H        HIS 107  -1.340  14.718   3.360
   12    HA   HIS 107           HA       HIS 107  -0.783  13.485   0.804
   13    HB2  HIS 107          1HB       HIS 107   1.016  13.939   3.213
   14    HB3  HIS 107          2HB       HIS 107   1.554  13.536   1.584
   15    HD2  HIS 107          2HD       HIS 107   1.264  16.458   3.707
   16    HE1  HIS 107          1HE       HIS 107   0.923  18.049  -0.237
   17    HE2  HIS 107          2HE       HIS 107   1.320  18.629   2.211
   18    H    MET 108           H        MET 108  -1.931  11.996   3.573
   19    HA   MET 108           HA       MET 108  -0.228   9.657   3.671
   20    HB2  MET 108          1HB       MET 108  -2.895  10.208   5.018
   21    HB3  MET 108          2HB       MET 108  -1.786   8.887   5.405
   22    HG2  MET 108          1HG       MET 108  -0.055  10.508   6.088
   23    HG3  MET 108          2HG       MET 108  -1.136  11.841   5.680
   24    HE1  MET 108          1HE       MET 108  -1.469   8.407   7.647
   25    HE2  MET 108          2HE       MET 108  -0.097   9.244   8.410
   26    HE3  MET 108          3HE       MET 108  -1.608   9.009   9.312
   27    H    LYS 109           H        LYS 109  -1.212   9.849   1.027
   28    HA   LYS 109           HA       LYS 109  -3.433   8.006   0.660
   29    HB2  LYS 109          1HB       LYS 109  -2.768  10.047  -0.815
   30    HB3  LYS 109          2HB       LYS 109  -1.590   8.947  -1.543
   31    HG2  LYS 109          1HG       LYS 109  -3.775   7.351  -1.702
   32    HG3  LYS 109          2HG       LYS 109  -4.617   8.859  -1.565
   33    HD2  LYS 109          1HD       LYS 109  -2.468   8.354  -3.655
   34    HD3  LYS 109          2HD       LYS 109  -4.179   7.991  -3.902
   35    HE2  LYS 109          1HE       LYS 109  -4.738  10.387  -3.490
   36    HE3  LYS 109          2HE       LYS 109  -3.013  10.746  -3.336
   37    HZ1  LYS 109          1HZ       LYS 109  -3.844  11.159  -5.604
   38    HZ2  LYS 109          2HZ       LYS 109  -4.288   9.591  -5.777
   39    HZ3  LYS 109          3HZ       LYS 109  -2.708   9.986  -5.625
   40    H    LYS 110           H        LYS 110  -1.566   6.731   2.162
   41    HA   LYS 110           HA       LYS 110  -0.554   4.453   0.581
   42    HB2  LYS 110          1HB       LYS 110   1.221   6.237   0.515
   43    HB3  LYS 110          2HB       LYS 110   1.247   6.241   2.275
   44    HG2  LYS 110          1HG       LYS 110   2.007   3.823   2.204
   45    HG3  LYS 110          2HG       LYS 110   2.008   3.928   0.444
   46    HD2  LYS 110          1HD       LYS 110   4.265   4.220   1.149
   47    HD3  LYS 110          2HD       LYS 110   3.698   5.807   0.616
   48    HE2  LYS 110          1HE       LYS 110   3.285   6.453   2.983
   49    HE3  LYS 110          2HE       LYS 110   3.769   4.838   3.515
   50    HZ1  LYS 110          1HZ       LYS 110   5.557   6.411   3.785
   51    HZ2  LYS 110          2HZ       LYS 110   5.570   6.788   2.185
   52    HZ3  LYS 110          3HZ       LYS 110   6.010   5.292   2.705
   53    H    ILE 111           H        ILE 111  -0.276   2.595   1.817
   54    HA   ILE 111           HA       ILE 111  -0.946   2.769   4.729
   55    HB   ILE 111           HB       ILE 111  -2.179   0.744   4.655
   56   HG12  ILE 111          1HG1      ILE 111  -1.388   0.509   1.748
   57   HG13  ILE 111          2HG1      ILE 111  -0.919  -0.553   3.064
   58   HG21  ILE 111          1HG2      ILE 111  -3.186   2.388   2.309
   59   HG22  ILE 111          2HG2      ILE 111  -4.130   1.387   3.437
   60   HG23  ILE 111          3HG2      ILE 111  -3.344   2.850   4.027
   61   HD11  ILE 111          1HD1      ILE 111  -3.715  -0.312   1.917
   62   HD12  ILE 111          2HD1      ILE 111  -2.590  -1.667   1.749
   63   HD13  ILE 111          3HD1      ILE 111  -3.272  -1.282   3.340
   64    H    PHE 112           H        PHE 112  -0.101   1.299   6.070
   65    HA   PHE 112           HA       PHE 112   2.430  -0.134   5.410
   66    HB2  PHE 112          1HB       PHE 112   2.140   1.296   7.514
   67    HB3  PHE 112          2HB       PHE 112   0.835   0.239   8.007
   68    HD1  PHE 112          1HD       PHE 112   1.320  -2.147   8.692
   69    HD2  PHE 112          2HD       PHE 112   4.450   0.631   7.694
   70    HE1  PHE 112          1HE       PHE 112   2.994  -3.612   9.797
   71    HE2  PHE 112          2HE       PHE 112   6.112  -0.842   8.774
   72    HZ   PHE 112           HZ       PHE 112   5.383  -2.977   9.829
   73    H    VAL 113           H        VAL 113   2.320  -2.398   5.256
   74    HA   VAL 113           HA       VAL 113  -0.155  -3.820   6.120
   75    HB   VAL 113           HB       VAL 113   1.438  -4.539   3.648
   76   HG11  VAL 113          1HG1      VAL 113  -0.438  -6.089   3.243
   77   HG12  VAL 113          2HG1      VAL 113   0.362  -6.462   4.771
   78   HG13  VAL 113          3HG1      VAL 113  -1.190  -5.593   4.775
   79   HG21  VAL 113          1HG2      VAL 113   0.243  -2.492   3.181
   80   HG22  VAL 113          2HG2      VAL 113  -0.593  -3.825   2.400
   81   HG23  VAL 113          3HG2      VAL 113  -1.254  -3.139   3.904
   82    H    GLY 114           H        GLY 114   0.367  -4.966   7.839
   83    HA2  GLY 114          1HA       GLY 114   3.158  -6.012   8.171
   84    HA3  GLY 114          2HA       GLY 114   2.074  -5.532   9.466
   85    H    GLY 115           H        GLY 115   3.574  -8.027   8.951
   86    HA2  GLY 115          1HA       GLY 115   3.148 -10.152   9.802
   87    HA3  GLY 115          2HA       GLY 115   1.410  -9.933   9.605
   88    H    LEU 116           H        LEU 116   3.414  -9.188   6.853
   89    HA   LEU 116           HA       LEU 116   2.201 -11.213   5.149
   90    HB2  LEU 116          1HB       LEU 116   4.561  -9.310   4.835
   91    HB3  LEU 116          2HB       LEU 116   4.029 -10.379   3.545
   92    HG   LEU 116           HG       LEU 116   2.089  -8.407   4.822
   93   HD11  LEU 116          1HD1      LEU 116   4.010  -7.094   4.041
   94   HD12  LEU 116          2HD1      LEU 116   2.622  -6.853   2.974
   95   HD13  LEU 116          3HD1      LEU 116   3.958  -7.917   2.472
   96   HD21  LEU 116          1HD2      LEU 116   2.249  -9.564   2.009
   97   HD22  LEU 116          2HD2      LEU 116   0.920  -8.621   2.711
   98   HD23  LEU 116          3HD2      LEU 116   1.247 -10.269   3.282
   99    H    SER 117           H        SER 117   2.979 -13.246   4.592
  100    HA   SER 117           HA       SER 117   5.014 -14.449   6.255
  101    HB2  SER 117          1HB       SER 117   4.650 -16.452   5.026
  102    HB3  SER 117          2HB       SER 117   3.074 -15.686   5.276
  103    HG   SER 117           HG       SER 117   3.292 -16.402   3.141
  104    H    VAL 118           H        VAL 118   7.114 -15.183   5.686
  105    HA   VAL 118           HA       VAL 118   8.603 -13.574   3.894
  106    HB   VAL 118           HB       VAL 118   9.394 -14.858   5.935
  107   HG11  VAL 118          1HG1      VAL 118  10.425 -17.025   5.586
  108   HG12  VAL 118          2HG1      VAL 118   8.706 -17.136   5.183
  109   HG13  VAL 118          3HG1      VAL 118   9.923 -17.057   3.887
  110   HG21  VAL 118          1HG2      VAL 118  10.859 -13.488   4.507
  111   HG22  VAL 118          2HG2      VAL 118  11.686 -14.908   5.166
  112   HG23  VAL 118          3HG2      VAL 118  11.168 -14.899   3.467
  113    H    ASN 119           H        ASN 119   6.708 -16.332   3.161
  114    HA   ASN 119           HA       ASN 119   7.910 -16.864   0.533
  115    HB2  ASN 119          1HB       ASN 119   5.326 -17.786   1.862
  116    HB3  ASN 119          2HB       ASN 119   5.902 -18.352   0.298
  117   HD21  ASN 119          1HD2      ASN 119   5.478 -19.760   2.980
  118   HD22  ASN 119          2HD2      ASN 119   7.005 -20.602   3.203
  119    H    THR 120           H        THR 120   5.376 -14.733   1.786
  120    HA   THR 120           HA       THR 120   4.121 -14.157  -0.778
  121    HB   THR 120           HB       THR 120   4.164 -12.593   1.839
  122    HG1  THR 120          1HG       THR 120   3.108 -14.486   2.088
  123   HG21  THR 120          1HG2      THR 120   2.535 -12.164  -0.685
  124   HG22  THR 120          2HG2      THR 120   3.543 -10.987   0.175
  125   HG23  THR 120          3HG2      THR 120   2.038 -11.572   0.904
  126    H    THR 121           H        THR 121   4.572 -12.619  -2.246
  127    HA   THR 121           HA       THR 121   6.947 -10.884  -1.797
  128    HB   THR 121           HB       THR 121   7.363 -12.816  -3.331
  129    HG1  THR 121          1HG       THR 121   8.640 -11.496  -4.577
  130   HG21  THR 121          1HG2      THR 121   5.824 -11.077  -5.324
  131   HG22  THR 121          2HG2      THR 121   5.284 -12.658  -4.714
  132   HG23  THR 121          3HG2      THR 121   6.761 -12.541  -5.679
  133    H    VAL 122           H        VAL 122   7.155  -9.044  -3.313
  134    HA   VAL 122           HA       VAL 122   5.135  -7.215  -2.604
  135    HB   VAL 122           HB       VAL 122   7.571  -6.777  -3.089
  136   HG11  VAL 122          1HG1      VAL 122   8.258  -6.086  -5.295
  137   HG12  VAL 122          2HG1      VAL 122   7.680  -7.755  -5.385
  138   HG13  VAL 122          3HG1      VAL 122   6.658  -6.421  -5.973
  139   HG21  VAL 122          1HG2      VAL 122   5.542  -4.879  -4.319
  140   HG22  VAL 122          2HG2      VAL 122   5.962  -4.990  -2.593
  141   HG23  VAL 122          3HG2      VAL 122   7.179  -4.475  -3.781
  142    H    GLU 123           H        GLU 123   5.467  -8.966  -5.651
  143    HA   GLU 123           HA       GLU 123   3.413  -7.498  -7.053
  144    HB2  GLU 123          1HB       GLU 123   4.490 -10.321  -7.477
  145    HB3  GLU 123          2HB       GLU 123   3.476  -9.454  -8.623
  146    HG2  GLU 123          1HG       GLU 123   6.275  -8.613  -7.739
  147    HG3  GLU 123          2HG       GLU 123   5.877  -9.459  -9.226
  148    H    ASP 124           H        ASP 124   3.273 -10.224  -4.784
  149    HA   ASP 124           HA       ASP 124   0.513 -10.995  -5.355
  150    HB2  ASP 124          1HB       ASP 124   1.968 -11.218  -2.693
  151    HB3  ASP 124          2HB       ASP 124   0.561 -12.118  -3.217
  152    H    VAL 125           H        VAL 125   2.152  -8.870  -2.962
  153    HA   VAL 125           HA       VAL 125  -0.187  -7.890  -1.651
  154    HB   VAL 125           HB       VAL 125   2.566  -6.649  -2.052
  155   HG11  VAL 125          1HG1      VAL 125   2.070  -5.239  -0.094
  156   HG12  VAL 125          2HG1      VAL 125   0.989  -4.863  -1.438
  157   HG13  VAL 125          3HG1      VAL 125   0.403  -5.846  -0.073
  158   HG21  VAL 125          1HG2      VAL 125   2.888  -7.433   0.304
  159   HG22  VAL 125          2HG2      VAL 125   1.306  -8.231   0.222
  160   HG23  VAL 125          3HG2      VAL 125   2.637  -8.767  -0.827
  161    H    LYS 126           H        LYS 126   1.622  -6.538  -4.459
  162    HA   LYS 126           HA       LYS 126  -0.096  -4.328  -4.937
  163    HB2  LYS 126          1HB       LYS 126   2.127  -4.582  -5.909
  164    HB3  LYS 126          2HB       LYS 126   1.591  -5.963  -6.874
  165    HG2  LYS 126          1HG       LYS 126   0.123  -4.559  -8.202
  166    HG3  LYS 126          2HG       LYS 126   0.410  -3.168  -7.137
  167    HD2  LYS 126          1HD       LYS 126   2.841  -3.249  -7.731
  168    HD3  LYS 126          2HD       LYS 126   2.508  -4.554  -8.870
  169    HE2  LYS 126          1HE       LYS 126   1.365  -1.722  -8.999
  170    HE3  LYS 126          2HE       LYS 126   2.736  -2.321  -9.936
  171    HZ1  LYS 126          1HZ       LYS 126   1.169  -3.994 -10.905
  172    HZ2  LYS 126          2HZ       LYS 126   0.788  -2.452 -11.288
  173    HZ3  LYS 126          3HZ       LYS 126  -0.084  -3.229 -10.157
  174    H    HIS 127           H        HIS 127  -0.315  -7.643  -6.396
  175    HA   HIS 127           HA       HIS 127  -2.692  -7.223  -7.858
  176    HB2  HIS 127          1HB       HIS 127  -1.112  -9.158  -8.009
  177    HB3  HIS 127          2HB       HIS 127  -1.748  -9.777  -6.486
  178    HD2  HIS 127          2HD       HIS 127  -2.208  -9.967 -10.108
  179    HE1  HIS 127          1HE       HIS 127  -5.849 -11.551  -8.536
  180    HE2  HIS 127          2HE       HIS 127  -4.434 -11.308 -10.640
  181    H    TYR 128           H        TYR 128  -2.401  -8.522  -4.486
  182    HA   TYR 128           HA       TYR 128  -5.182  -8.730  -4.086
  183    HB2  TYR 128          1HB       TYR 128  -2.822  -8.833  -2.284
  184    HB3  TYR 128          2HB       TYR 128  -4.405  -8.633  -1.591
  185    HD1  TYR 128          1HD       TYR 128  -5.913 -10.435  -1.330
  186    HD2  TYR 128          2HD       TYR 128  -2.432 -10.938  -3.820
  187    HE1  TYR 128          1HE       TYR 128  -6.268 -12.895  -1.346
  188    HE2  TYR 128          2HE       TYR 128  -2.770 -13.389  -3.815
  189    HH   TYR 128           HH       TYR 128  -4.140 -15.127  -3.161
  190    H    PHE 129           H        PHE 129  -3.190  -5.848  -3.609
  191    HA   PHE 129           HA       PHE 129  -5.532  -4.478  -2.517
  192    HB2  PHE 129          1HB       PHE 129  -2.710  -3.566  -2.842
  193    HB3  PHE 129          2HB       PHE 129  -4.024  -2.483  -2.390
  194    HD1  PHE 129          1HD       PHE 129  -5.656  -3.449  -0.436
  195    HD2  PHE 129          2HD       PHE 129  -1.564  -4.625  -1.093
  196    HE1  PHE 129          1HE       PHE 129  -5.591  -4.514   1.808
  197    HE2  PHE 129          2HE       PHE 129  -1.500  -5.651   1.162
  198    HZ   PHE 129           HZ       PHE 129  -3.520  -5.639   2.591
  199    H    GLU 130           H        GLU 130  -4.234  -4.699  -5.709
  200    HA   GLU 130           HA       GLU 130  -5.731  -2.514  -6.841
  201    HB2  GLU 130          1HB       GLU 130  -4.672  -5.132  -7.940
  202    HB3  GLU 130          2HB       GLU 130  -5.602  -4.012  -8.945
  203    HG2  GLU 130          1HG       GLU 130  -4.018  -2.231  -8.623
  204    HG3  GLU 130          2HG       GLU 130  -3.113  -3.161  -7.436
  205    H    GLN 131           H        GLN 131  -6.824  -5.582  -5.598
  206    HA   GLN 131           HA       GLN 131  -9.262  -5.862  -7.050
  207    HB2  GLN 131          1HB       GLN 131  -8.766  -6.660  -4.142
  208    HB3  GLN 131          2HB       GLN 131  -9.949  -7.334  -5.278
  209    HG2  GLN 131          1HG       GLN 131  -7.895  -7.882  -6.764
  210    HG3  GLN 131          2HG       GLN 131  -6.926  -7.583  -5.337
  211   HE21  GLN 131          1HE2      GLN 131  -6.362  -9.948  -6.071
  212   HE22  GLN 131          2HE2      GLN 131  -7.282 -11.177  -5.215
  213    H    PHE 132           H        PHE 132  -8.466  -3.963  -4.187
  214    HA   PHE 132           HA       PHE 132 -11.158  -3.006  -3.741
  215    HB2  PHE 132          1HB       PHE 132  -8.502  -2.064  -2.620
  216    HB3  PHE 132          2HB       PHE 132 -10.073  -1.437  -2.135
  217    HD1  PHE 132          1HD       PHE 132 -11.892  -3.178  -1.358
  218    HD2  PHE 132          2HD       PHE 132  -7.666  -4.004  -1.586
  219    HE1  PHE 132          1HE       PHE 132 -12.194  -5.159   0.107
  220    HE2  PHE 132          2HE       PHE 132  -7.957  -5.932  -0.080
  221    HZ   PHE 132           HZ       PHE 132 -10.224  -6.535   0.768
  222    H    GLY 133           H        GLY 133  -8.685  -1.794  -5.833
  223    HA2  GLY 133          1HA       GLY 133 -10.389   0.041  -7.189
  224    HA3  GLY 133          2HA       GLY 133  -9.433   0.949  -6.022
  225    H    LYS 134           H        LYS 134  -7.251   1.242  -6.362
  226    HA   LYS 134           HA       LYS 134  -5.732  -0.346  -8.255
  227    HB2  LYS 134          1HB       LYS 134  -6.567   1.113  -9.929
  228    HB3  LYS 134          2HB       LYS 134  -6.332   2.549  -8.929
  229    HG2  LYS 134          1HG       LYS 134  -3.914   2.345  -9.086
  230    HG3  LYS 134          2HG       LYS 134  -4.055   0.781  -9.911
  231    HD2  LYS 134          1HD       LYS 134  -4.852   1.808 -11.913
  232    HD3  LYS 134          2HD       LYS 134  -5.184   3.339 -11.091
  233    HE2  LYS 134          1HE       LYS 134  -3.134   3.449 -12.482
  234    HE3  LYS 134          2HE       LYS 134  -2.847   3.816 -10.781
  235    HZ1  LYS 134          1HZ       LYS 134  -1.157   2.321 -11.729
  236    HZ2  LYS 134          2HZ       LYS 134  -2.281   1.175 -12.024
  237    HZ3  LYS 134          3HZ       LYS 134  -1.920   1.605 -10.477
  238    H    VAL 135           H        VAL 135  -3.701  -0.514  -7.730
  239    HA   VAL 135           HA       VAL 135  -2.478   1.078  -5.536
  240    HB   VAL 135           HB       VAL 135  -1.620  -1.421  -7.044
  241   HG11  VAL 135          1HG1      VAL 135   0.237  -1.589  -5.379
  242   HG12  VAL 135          2HG1      VAL 135   0.438  -0.271  -6.531
  243   HG13  VAL 135          3HG1      VAL 135  -0.108   0.069  -4.871
  244   HG21  VAL 135          1HG2      VAL 135  -1.893  -2.497  -4.842
  245   HG22  VAL 135          2HG2      VAL 135  -2.393  -0.943  -4.131
  246   HG23  VAL 135          3HG2      VAL 135  -3.404  -1.735  -5.349
  247    H    ASP 136           H        ASP 136  -0.899   2.507  -5.886
  248    HA   ASP 136           HA       ASP 136  -0.113   3.288  -8.634
  249    HB2  ASP 136          1HB       ASP 136  -0.749   5.111  -7.259
  250    HB3  ASP 136          2HB       ASP 136   0.248   4.550  -5.918
  251    H    ASP 137           H        ASP 137   1.405   2.121  -5.605
  252    HA   ASP 137           HA       ASP 137   3.448   0.658  -7.066
  253    HB2  ASP 137          1HB       ASP 137   4.323   3.077  -6.959
  254    HB3  ASP 137          2HB       ASP 137   4.335   2.918  -5.204
  255    H    ALA 138           H        ALA 138   4.659  -0.743  -5.603
  256    HA   ALA 138           HA       ALA 138   3.801  -0.886  -2.773
  257    HB1  ALA 138          1HB       ALA 138   3.417  -3.315  -2.941
  258    HB2  ALA 138          2HB       ALA 138   2.303  -2.429  -4.000
  259    HB3  ALA 138          3HB       ALA 138   3.715  -3.260  -4.690
  260    H    MET 139           H        MET 139   5.370  -1.706  -1.366
  261    HA   MET 139           HA       MET 139   7.870  -2.877  -2.401
  262    HB2  MET 139          1HB       MET 139   9.306  -1.178  -1.334
  263    HB3  MET 139          2HB       MET 139   8.423  -0.590  -2.738
  264    HG2  MET 139          1HG       MET 139   6.801   0.553  -1.250
  265    HG3  MET 139          2HG       MET 139   7.673  -0.055   0.158
  266    HE1  MET 139          1HE       MET 139   7.075   2.877   0.199
  267    HE2  MET 139          2HE       MET 139   8.203   2.138   1.363
  268    HE3  MET 139          3HE       MET 139   8.653   3.633   0.517
  269    H    LEU 140           H        LEU 140   8.651  -4.370  -1.045
  270    HA   LEU 140           HA       LEU 140   7.694  -4.475   1.771
  271    HB2  LEU 140          1HB       LEU 140   9.388  -6.507   0.299
  272    HB3  LEU 140          2HB       LEU 140   8.608  -6.686   1.870
  273    HG   LEU 140           HG       LEU 140   7.231  -6.505  -0.840
  274   HD11  LEU 140          1HD1      LEU 140   8.273  -8.680  -0.302
  275   HD12  LEU 140          2HD1      LEU 140   6.503  -8.790  -0.312
  276   HD13  LEU 140          3HD1      LEU 140   7.373  -8.725   1.230
  277   HD21  LEU 140          1HD2      LEU 140   5.768  -5.384   0.724
  278   HD22  LEU 140          2HD2      LEU 140   6.012  -6.663   1.942
  279   HD23  LEU 140          3HD2      LEU 140   5.136  -7.001   0.429
  280    H    MET 141           H        MET 141   9.080  -4.413   3.552
  281    HA   MET 141           HA       MET 141  11.618  -2.938   3.050
  282    HB2  MET 141          1HB       MET 141  10.014  -3.371   5.588
  283    HB3  MET 141          2HB       MET 141  11.546  -2.492   5.499
  284    HG2  MET 141          1HG       MET 141   8.967  -1.734   4.073
  285    HG3  MET 141          2HG       MET 141   9.661  -0.958   5.484
  286    HE1  MET 141          1HE       MET 141  10.248   0.315   1.273
  287    HE2  MET 141          2HE       MET 141   9.946  -1.408   1.567
  288    HE3  MET 141          3HE       MET 141   8.820  -0.188   2.200
  289    H    PHE 142           H        PHE 142  13.620  -3.583   3.752
  290    HA   PHE 142           HA       PHE 142  13.835  -6.482   4.245
  291    HB2  PHE 142          1HB       PHE 142  15.402  -4.728   2.433
  292    HB3  PHE 142          2HB       PHE 142  16.090  -6.215   3.056
  293    HD1  PHE 142          1HD       PHE 142  13.099  -4.906   1.199
  294    HD2  PHE 142          2HD       PHE 142  15.594  -8.302   2.085
  295    HE1  PHE 142          1HE       PHE 142  11.872  -6.245  -0.490
  296    HE2  PHE 142          2HE       PHE 142  14.379  -9.641   0.384
  297    HZ   PHE 142           HZ       PHE 142  12.506  -8.619  -0.900
  298    H    ASP 143           H        ASP 143  15.220  -7.561   5.425
  299    HA   ASP 143           HA       ASP 143  16.514  -6.152   7.655
  300    HB2  ASP 143          1HB       ASP 143  15.386  -7.987   8.444
  301    HB3  ASP 143          2HB       ASP 143  15.821  -8.996   7.064
  302    H    LYS 144           H        LYS 144  18.520  -5.415   7.593
  303    HA   LYS 144           HA       LYS 144  20.383  -6.031   5.484
  304    HB2  LYS 144          1HB       LYS 144  21.933  -4.609   6.700
  305    HB3  LYS 144          2HB       LYS 144  20.336  -3.868   6.630
  306    HG2  LYS 144          1HG       LYS 144  19.897  -4.578   8.981
  307    HG3  LYS 144          2HG       LYS 144  21.502  -5.330   9.048
  308    HD2  LYS 144          1HD       LYS 144  22.557  -3.126   8.625
  309    HD3  LYS 144          2HD       LYS 144  20.949  -2.370   8.562
  310    HE2  LYS 144          1HE       LYS 144  20.512  -3.110  10.894
  311    HE3  LYS 144          2HE       LYS 144  22.108  -3.868  10.957
  312    HZ1  LYS 144          1HZ       LYS 144  23.096  -1.660  10.639
  313    HZ2  LYS 144          2HZ       LYS 144  22.140  -1.656  11.960
  314    HZ3  LYS 144          3HZ       LYS 144  21.620  -0.959  10.580
  315    H    THR 145           H        THR 145  19.759  -7.714   8.430
  316    HA   THR 145           HA       THR 145  22.379  -8.887   8.713
  317    HB   THR 145           HB       THR 145  20.044 -10.191  10.019
  318    HG1  THR 145          1HG       THR 145  19.476  -8.155  10.336
  319   HG21  THR 145          1HG2      THR 145  22.803  -9.345  10.998
  320   HG22  THR 145          2HG2      THR 145  22.337 -10.980  10.474
  321   HG23  THR 145          3HG2      THR 145  21.598 -10.272  11.919
  322    H    THR 146           H        THR 146  19.346 -10.161   7.439
  323    HA   THR 146           HA       THR 146  20.808 -12.462   6.247
  324    HB   THR 146           HB       THR 146  19.073 -13.919   6.730
  325    HG1  THR 146          1HG       THR 146  17.600 -11.678   7.641
  326   HG21  THR 146          1HG2      THR 146  18.846 -13.944   9.112
  327   HG22  THR 146          2HG2      THR 146  19.171 -12.205   9.244
  328   HG23  THR 146          3HG2      THR 146  20.463 -13.323   8.746
  329    H    ASN 147           H        ASN 147  19.306  -9.736   5.211
  330    HA   ASN 147           HA       ASN 147  18.580  -8.991   3.252
  331    HB2  ASN 147          1HB       ASN 147  20.020 -11.401   2.105
  332    HB3  ASN 147          2HB       ASN 147  19.504  -9.990   1.192
  333   HD21  ASN 147          1HD2      ASN 147  22.213 -11.282   2.483
  334   HD22  ASN 147          2HD2      ASN 147  23.077  -9.789   2.822
  335    H    ARG 148           H        ARG 148  16.784 -10.829   4.693
  336    HA   ARG 148           HA       ARG 148  14.808 -11.459   2.520
  337    HB2  ARG 148          1HB       ARG 148  14.912 -12.287   5.444
  338    HB3  ARG 148          2HB       ARG 148  13.594 -12.685   4.338
  339    HG2  ARG 148          1HG       ARG 148  15.037 -14.026   2.929
  340    HG3  ARG 148          2HG       ARG 148  16.482 -13.541   3.821
  341    HD2  ARG 148          1HD       ARG 148  14.176 -15.144   4.969
  342    HD3  ARG 148          2HD       ARG 148  15.734 -15.806   4.442
  343    HE   ARG 148           HE       ARG 148  16.497 -13.870   6.239
  344   HH11  ARG 148          1HH1      ARG 148  14.281 -16.587   6.660
  345   HH12  ARG 148          2HH1      ARG 148  14.447 -16.478   8.405
  346   HH21  ARG 148          1HH2      ARG 148  16.624 -13.867   8.369
  347   HH22  ARG 148          2HH2      ARG 148  15.747 -15.074   9.327
  348    H    HIS 149           H        HIS 149  12.515 -10.819   3.000
  349    HA   HIS 149           HA       HIS 149  12.466  -8.052   3.943
  350    HB2  HIS 149          1HB       HIS 149  10.299  -7.861   3.174
  351    HB3  HIS 149          2HB       HIS 149  11.171  -8.784   1.969
  352    HD2  HIS 149          2HD       HIS 149   9.854 -10.797   1.065
  353    HE1  HIS 149          1HE       HIS 149   6.858 -11.074   4.074
  354    HE2  HIS 149          2HE       HIS 149   7.584 -11.910   1.781
  355    H    ARG 150           H        ARG 150  11.203  -7.210   5.615
  356    HA   ARG 150           HA       ARG 150  11.464  -8.714   8.101
  357    HB2  ARG 150          1HB       ARG 150  10.620  -5.871   7.434
  358    HB3  ARG 150          2HB       ARG 150  10.683  -6.496   9.086
  359    HG2  ARG 150          1HG       ARG 150  13.080  -6.996   8.863
  360    HG3  ARG 150          2HG       ARG 150  13.058  -6.409   7.194
  361    HD2  ARG 150          1HD       ARG 150  13.958  -4.691   8.670
  362    HD3  ARG 150          2HD       ARG 150  12.430  -4.162   7.955
  363    HE   ARG 150           HE       ARG 150  11.971  -5.390  10.530
  364   HH11  ARG 150          1HH1      ARG 150  13.186  -2.321   9.244
  365   HH12  ARG 150          2HH1      ARG 150  12.348  -1.448  10.534
  366   HH21  ARG 150          1HH2      ARG 150  10.898  -4.085  11.980
  367   HH22  ARG 150          2HH2      ARG 150  11.256  -2.352  11.965
  368    H    GLY 151           H        GLY 151   9.124  -9.302   6.085
  369    HA2  GLY 151          1HA       GLY 151   7.020 -10.156   6.317
  370    HA3  GLY 151          2HA       GLY 151   7.121  -9.979   8.069
  371    H    PHE 152           H        PHE 152   7.626  -7.125   6.033
  372    HA   PHE 152           HA       PHE 152   4.808  -6.403   6.002
  373    HB2  PHE 152          1HB       PHE 152   4.919  -4.430   7.314
  374    HB3  PHE 152          2HB       PHE 152   5.564  -5.705   8.311
  375    HD1  PHE 152          1HD       PHE 152   7.957  -5.700   8.965
  376    HD2  PHE 152          2HD       PHE 152   6.289  -2.581   6.500
  377    HE1  PHE 152          1HE       PHE 152   9.843  -4.233   9.535
  378    HE2  PHE 152          2HE       PHE 152   8.190  -1.108   7.083
  379    HZ   PHE 152           HZ       PHE 152   9.987  -1.930   8.602
  380    H    GLY 153           H        GLY 153   4.473  -4.325   4.885
  381    HA2  GLY 153          1HA       GLY 153   6.698  -3.013   3.529
  382    HA3  GLY 153          2HA       GLY 153   5.663  -3.942   2.441
  383    H    PHE 154           H        PHE 154   5.834  -1.481   1.834
  384    HA   PHE 154           HA       PHE 154   3.370  -0.136   2.766
  385    HB2  PHE 154          1HB       PHE 154   5.854   1.017   1.532
  386    HB3  PHE 154          2HB       PHE 154   4.330   1.891   1.614
  387    HD1  PHE 154          1HD       PHE 154   3.339   2.595   3.758
  388    HD2  PHE 154          2HD       PHE 154   7.106   0.508   3.600
  389    HE1  PHE 154          1HE       PHE 154   3.799   3.247   6.105
  390    HE2  PHE 154          2HE       PHE 154   7.539   1.108   5.956
  391    HZ   PHE 154           HZ       PHE 154   5.908   2.501   7.213
  392    H    VAL 155           H        VAL 155   1.806   0.622   1.453
  393    HA   VAL 155           HA       VAL 155   2.009   0.060  -1.455
  394    HB   VAL 155           HB       VAL 155  -0.546  -0.560   0.013
  395   HG11  VAL 155          1HG1      VAL 155  -1.086  -1.750  -2.064
  396   HG12  VAL 155          2HG1      VAL 155  -0.756  -0.044  -2.383
  397   HG13  VAL 155          3HG1      VAL 155   0.477  -1.270  -2.760
  398   HG21  VAL 155          1HG2      VAL 155   1.083  -2.178   0.847
  399   HG22  VAL 155          2HG2      VAL 155  -0.040  -2.941  -0.270
  400   HG23  VAL 155          3HG2      VAL 155   1.605  -2.532  -0.817
  401    H    THR 156           H        THR 156   1.755   1.797  -2.564
  402    HA   THR 156           HA       THR 156   0.236   4.111  -1.514
  403    HB   THR 156           HB       THR 156   1.868   4.220  -4.027
  404    HG1  THR 156          1HG       THR 156   3.307   3.533  -2.516
  405   HG21  THR 156          1HG2      THR 156   2.125   6.588  -3.345
  406   HG22  THR 156          2HG2      THR 156   1.091   6.298  -1.932
  407   HG23  THR 156          3HG2      THR 156   0.428   6.163  -3.579
  408    H    PHE 157           H        PHE 157  -1.495   5.095  -2.632
  409    HA   PHE 157           HA       PHE 157  -2.822   3.256  -4.541
  410    HB2  PHE 157          1HB       PHE 157  -3.887   4.812  -2.236
  411    HB3  PHE 157          2HB       PHE 157  -4.944   4.277  -3.528
  412    HD1  PHE 157          1HD       PHE 157  -2.539   3.028  -0.951
  413    HD2  PHE 157          2HD       PHE 157  -5.692   2.018  -3.712
  414    HE1  PHE 157          1HE       PHE 157  -2.697   0.772   0.040
  415    HE2  PHE 157          2HE       PHE 157  -5.885  -0.228  -2.670
  416    HZ   PHE 157           HZ       PHE 157  -4.385  -0.851  -0.779
  417    H    GLU 158           H        GLU 158  -4.471   4.004  -5.936
  418    HA   GLU 158           HA       GLU 158  -3.744   6.364  -7.486
  419    HB2  GLU 158          1HB       GLU 158  -4.783   4.396  -8.502
  420    HB3  GLU 158          2HB       GLU 158  -6.199   4.573  -7.473
  421    HG2  GLU 158          1HG       GLU 158  -6.769   5.323  -9.653
  422    HG3  GLU 158          2HG       GLU 158  -6.760   6.719  -8.592
  423    H    SER 159           H        SER 159  -6.236   5.688  -5.016
  424    HA   SER 159           HA       SER 159  -6.768   8.601  -4.716
  425    HB2  SER 159          1HB       SER 159  -8.479   7.806  -6.227
  426    HB3  SER 159          2HB       SER 159  -8.874   6.461  -5.141
  427    HG   SER 159           HG       SER 159 -10.245   8.404  -5.005
  428    H    GLU 160           H        GLU 160  -7.417   9.286  -2.736
  429    HA   GLU 160           HA       GLU 160  -6.642   7.818  -0.374
  430    HB2  GLU 160          1HB       GLU 160  -8.477  10.223  -0.595
  431    HB3  GLU 160          2HB       GLU 160  -7.587   9.684   0.840
  432    HG2  GLU 160          1HG       GLU 160  -5.489  10.373  -0.096
  433    HG3  GLU 160          2HG       GLU 160  -6.209  10.660  -1.689
  434    H    ASP 161           H        ASP 161  -9.671   8.059  -2.178
  435    HA   ASP 161           HA       ASP 161 -11.432   7.095  -0.123
  436    HB2  ASP 161          1HB       ASP 161 -11.620   7.045  -3.145
  437    HB3  ASP 161          2HB       ASP 161 -12.864   6.382  -2.095
  438    H    ILE 162           H        ILE 162  -9.310   5.359  -2.359
  439    HA   ILE 162           HA       ILE 162 -10.339   2.735  -1.582
  440    HB   ILE 162           HB       ILE 162  -7.594   3.225  -2.744
  441   HG12  ILE 162          1HG1      ILE 162  -8.915   4.388  -4.297
  442   HG13  ILE 162          2HG1      ILE 162  -8.517   2.814  -4.967
  443   HG21  ILE 162          1HG2      ILE 162  -8.014   0.969  -1.957
  444   HG22  ILE 162          2HG2      ILE 162  -9.551   0.887  -2.837
  445   HG23  ILE 162          3HG2      ILE 162  -8.010   0.950  -3.718
  446   HD11  ILE 162          1HD1      ILE 162 -10.821   3.393  -5.535
  447   HD12  ILE 162          2HD1      ILE 162 -10.842   2.020  -4.416
  448   HD13  ILE 162          3HD1      ILE 162 -11.232   3.650  -3.834
  449    H    VAL 163           H        VAL 163  -7.571   4.813  -0.616
  450    HA   VAL 163           HA       VAL 163  -6.304   3.020   1.157
  451    HB   VAL 163           HB       VAL 163  -6.627   6.052   1.378
  452   HG11  VAL 163          1HG1      VAL 163  -4.599   6.044   2.778
  453   HG12  VAL 163          2HG1      VAL 163  -5.946   5.233   3.581
  454   HG13  VAL 163          3HG1      VAL 163  -4.656   4.273   2.831
  455   HG21  VAL 163          1HG2      VAL 163  -5.515   5.288  -0.679
  456   HG22  VAL 163          2HG2      VAL 163  -4.386   6.102   0.397
  457   HG23  VAL 163          3HG2      VAL 163  -4.370   4.333   0.293
  458    H    GLU 164           H        GLU 164  -9.012   5.305   1.856
  459    HA   GLU 164           HA       GLU 164  -9.351   4.325   4.564
  460    HB2  GLU 164          1HB       GLU 164 -11.163   5.993   2.781
  461    HB3  GLU 164          2HB       GLU 164 -11.515   5.557   4.469
  462    HG2  GLU 164          1HG       GLU 164  -9.194   6.488   5.051
  463    HG3  GLU 164          2HG       GLU 164  -9.170   7.209   3.445
  464    H    LYS 165           H        LYS 165 -10.996   3.371   1.504
  465    HA   LYS 165           HA       LYS 165 -12.880   1.545   2.627
  466    HB2  LYS 165          1HB       LYS 165 -12.779   2.281   0.259
  467    HB3  LYS 165          2HB       LYS 165 -11.316   1.322   0.028
  468    HG2  LYS 165          1HG       LYS 165 -12.638  -0.741   0.673
  469    HG3  LYS 165          2HG       LYS 165 -14.092   0.260   0.685
  470    HD2  LYS 165          1HD       LYS 165 -12.215  -0.253  -1.661
  471    HD3  LYS 165          2HD       LYS 165 -13.800  -0.981  -1.442
  472    HE2  LYS 165          1HE       LYS 165 -13.254   1.992  -1.894
  473    HE3  LYS 165          2HE       LYS 165 -13.766   0.844  -3.130
  474    HZ1  LYS 165          1HZ       LYS 165 -15.372   1.579  -0.738
  475    HZ2  LYS 165          2HZ       LYS 165 -15.826   0.490  -1.870
  476    HZ3  LYS 165          3HZ       LYS 165 -15.662   2.062  -2.267
  477    H    VAL 166           H        VAL 166  -9.536   0.983   1.626
  478    HA   VAL 166           HA       VAL 166  -9.323  -1.775   2.414
  479    HB   VAL 166           HB       VAL 166  -7.184   0.345   2.026
  480   HG11  VAL 166          1HG1      VAL 166  -6.256  -1.585   3.235
  481   HG12  VAL 166          2HG1      VAL 166  -6.984  -2.683   2.037
  482   HG13  VAL 166          3HG1      VAL 166  -5.688  -1.579   1.557
  483   HG21  VAL 166          1HG2      VAL 166  -8.717  -0.209  -0.016
  484   HG22  VAL 166          2HG2      VAL 166  -6.983  -0.345  -0.224
  485   HG23  VAL 166          3HG2      VAL 166  -7.974  -1.802   0.030
  486    H    CYS 167           H        CYS 167  -8.192   1.242   4.093
  487    HA   CYS 167           HA       CYS 167  -7.325  -0.176   6.416
  488    HB2  CYS 167          1HB       CYS 167  -7.898   2.737   5.859
  489    HB3  CYS 167          2HB       CYS 167  -7.476   2.184   7.490
  490    HG   CYS 167           HG       CYS 167  -5.264   1.050   6.976
  491    H    GLU 168           H        GLU 168 -10.602   1.089   5.758
  492    HA   GLU 168           HA       GLU 168 -11.573   0.624   8.439
  493    HB2  GLU 168          1HB       GLU 168 -12.913   0.857   5.732
  494    HB3  GLU 168          2HB       GLU 168 -13.842   0.512   7.180
  495    HG2  GLU 168          1HG       GLU 168 -12.029   2.949   6.888
  496    HG3  GLU 168          2HG       GLU 168 -13.748   2.939   6.506
  497    H    ILE 169           H        ILE 169 -11.011  -1.609   5.769
  498    HA   ILE 169           HA       ILE 169 -12.449  -3.848   6.976
  499    HB   ILE 169           HB       ILE 169 -10.298  -3.688   4.847
  500   HG12  ILE 169          1HG1      ILE 169 -13.254  -4.408   4.549
  501   HG13  ILE 169          2HG1      ILE 169 -12.701  -2.745   4.445
  502   HG21  ILE 169          1HG2      ILE 169 -11.874  -6.130   5.755
  503   HG22  ILE 169          2HG2      ILE 169 -10.884  -6.049   4.283
  504   HG23  ILE 169          3HG2      ILE 169 -10.115  -5.889   5.847
  505   HD11  ILE 169          1HD1      ILE 169 -11.197  -3.330   2.560
  506   HD12  ILE 169          2HD1      ILE 169 -11.860  -4.983   2.581
  507   HD13  ILE 169          3HD1      ILE 169 -12.914  -3.606   2.219
  508    H    HIS 170           H        HIS 170  -9.227  -2.509   7.219
  509    HA   HIS 170           HA       HIS 170  -7.539  -2.662   8.683
  510    HB2  HIS 170          1HB       HIS 170  -9.334  -2.256  10.278
  511    HB3  HIS 170          2HB       HIS 170  -9.579  -3.982  10.487
  512    HD2  HIS 170          2HD       HIS 170  -5.908  -2.842  10.458
  513    HE1  HIS 170          1HE       HIS 170  -6.968  -3.489  14.534
  514    HE2  HIS 170          2HE       HIS 170  -5.034  -3.073  12.937
  515    H    PHE 171           H        PHE 171  -9.109  -5.872   8.967
  516    HA   PHE 171           HA       PHE 171  -6.454  -7.084   8.497
  517    HB2  PHE 171          1HB       PHE 171  -8.673  -8.135  10.154
  518    HB3  PHE 171          2HB       PHE 171  -7.550  -9.231   9.369
  519    HD1  PHE 171          1HD       PHE 171  -7.827  -6.544  11.914
  520    HD2  PHE 171          2HD       PHE 171  -5.209  -9.378   9.986
  521    HE1  PHE 171          1HE       PHE 171  -6.138  -6.209  13.704
  522    HE2  PHE 171          2HE       PHE 171  -3.522  -9.038  11.779
  523    HZ   PHE 171           HZ       PHE 171  -3.985  -7.456  13.639
  524    H    HIS 172           H        HIS 172  -5.898  -8.062   6.782
  525    HA   HIS 172           HA       HIS 172  -7.974  -8.697   4.710
  526    HB2  HIS 172          1HB       HIS 172  -5.244  -7.384   4.501
  527    HB3  HIS 172          2HB       HIS 172  -6.096  -8.056   3.115
  528    HD2  HIS 172          2HD       HIS 172  -6.561  -5.233   5.774
  529    HE1  HIS 172          1HE       HIS 172  -8.971  -4.252   2.417
  530    HE2  HIS 172          2HE       HIS 172  -8.092  -3.431   4.642
  531    H    GLU 173           H        GLU 173  -7.658 -10.460   3.356
  532    HA   GLU 173           HA       GLU 173  -5.723 -12.523   4.295
  533    HB2  GLU 173          1HB       GLU 173  -8.110 -13.115   4.151
  534    HB3  GLU 173          2HB       GLU 173  -8.109 -12.724   2.426
  535    HG2  GLU 173          1HG       GLU 173  -6.432 -14.509   2.021
  536    HG3  GLU 173          2HG       GLU 173  -6.400 -14.873   3.748
  537    H    ILE 174           H        ILE 174  -3.859 -12.794   3.203
  538    HA   ILE 174           HA       ILE 174  -3.739 -12.391   0.253
  539    HB   ILE 174           HB       ILE 174  -1.653 -11.338   2.205
  540   HG12  ILE 174          1HG1      ILE 174  -3.660  -9.911   0.414
  541   HG13  ILE 174          2HG1      ILE 174  -3.555  -9.850   2.173
  542   HG21  ILE 174          1HG2      ILE 174  -0.631 -12.285   0.140
  543   HG22  ILE 174          2HG2      ILE 174  -1.699 -11.264  -0.849
  544   HG23  ILE 174          3HG2      ILE 174  -0.453 -10.548   0.194
  545   HD11  ILE 174          1HD1      ILE 174  -2.714  -7.810   1.385
  546   HD12  ILE 174          2HD1      ILE 174  -1.298  -8.731   1.920
  547   HD13  ILE 174          3HD1      ILE 174  -1.663  -8.572   0.183
  548    H    ASN 175           H        ASN 175  -2.805 -14.108  -0.747
  549    HA   ASN 175           HA       ASN 175  -2.184 -16.284  -0.967
  550    HB2  ASN 175          1HB       ASN 175   0.041 -15.328   0.868
  551    HB3  ASN 175          2HB       ASN 175   0.070 -16.859   0.006
  552   HD21  ASN 175          1HD2      ASN 175   1.824 -14.468  -0.192
  553   HD22  ASN 175          2HD2      ASN 175   1.901 -14.196  -1.934
  554    H    ASN 176           H        ASN 176  -4.252 -15.965   0.825
  555    HA   ASN 176           HA       ASN 176  -5.478 -16.867   2.440
  556    HB2  ASN 176          1HB       ASN 176  -3.892 -19.398   1.938
  557    HB3  ASN 176          2HB       ASN 176  -5.468 -19.286   2.721
  558   HD21  ASN 176          1HD2      ASN 176  -7.130 -17.847   1.249
  559   HD22  ASN 176          2HD2      ASN 176  -7.165 -18.455  -0.407
  560    H    LYS 177           H        LYS 177  -3.064 -15.473   3.370
  561    HA   LYS 177           HA       LYS 177  -3.217 -16.384   6.211
  562    HB2  LYS 177          1HB       LYS 177  -1.028 -16.870   5.025
  563    HB3  LYS 177          2HB       LYS 177  -0.762 -15.138   4.883
  564    HG2  LYS 177          1HG       LYS 177  -1.356 -16.357   7.594
  565    HG3  LYS 177          2HG       LYS 177   0.232 -16.616   6.878
  566    HD2  LYS 177          1HD       LYS 177   0.788 -14.308   6.885
  567    HD3  LYS 177          2HD       LYS 177  -0.878 -13.813   7.177
  568    HE2  LYS 177          1HE       LYS 177  -0.754 -15.127   9.389
  569    HE3  LYS 177          2HE       LYS 177   0.988 -15.258   9.103
  570    HZ1  LYS 177          1HZ       LYS 177  -0.552 -12.725   9.330
  571    HZ2  LYS 177          2HZ       LYS 177   1.049 -12.808   9.018
  572    HZ3  LYS 177          3HZ       LYS 177   0.473 -13.322  10.474
  573    H    MET 178           H        MET 178  -3.236 -14.656   7.804
  574    HA   MET 178           HA       MET 178  -4.710 -12.336   6.740
  575    HB2  MET 178          1HB       MET 178  -4.431 -13.391   9.571
  576    HB3  MET 178          2HB       MET 178  -5.375 -11.979   9.100
  577    HG2  MET 178          1HG       MET 178  -5.849 -14.858   8.273
  578    HG3  MET 178          2HG       MET 178  -6.845 -13.883   9.342
  579    HE1  MET 178          1HE       MET 178  -7.007 -11.051   7.668
  580    HE2  MET 178          2HE       MET 178  -8.540 -11.346   6.826
  581    HE3  MET 178          3HE       MET 178  -8.357 -11.830   8.527
  582    H    VAL 179           H        VAL 179  -4.066 -10.302   6.799
  583    HA   VAL 179           HA       VAL 179  -1.638  -9.559   8.333
  584    HB   VAL 179           HB       VAL 179  -0.798  -8.235   6.483
  585   HG11  VAL 179          1HG1      VAL 179  -1.364 -11.047   5.484
  586   HG12  VAL 179          2HG1      VAL 179   0.012  -9.992   5.107
  587   HG13  VAL 179          3HG1      VAL 179  -0.175 -10.635   6.743
  588   HG21  VAL 179          1HG2      VAL 179  -3.046  -9.336   4.770
  589   HG22  VAL 179          2HG2      VAL 179  -2.871  -7.647   5.297
  590   HG23  VAL 179          3HG2      VAL 179  -1.670  -8.365   4.223
  591    H    GLU 180           H        GLU 180  -1.377  -7.313   8.780
  592    HA   GLU 180           HA       GLU 180  -4.011  -5.962   9.253
  593    HB2  GLU 180          1HB       GLU 180  -2.505  -6.585  11.206
  594    HB3  GLU 180          2HB       GLU 180  -1.351  -5.400  10.590
  595    HG2  GLU 180          1HG       GLU 180  -3.337  -3.712  10.659
  596    HG3  GLU 180          2HG       GLU 180  -4.202  -4.950  11.562
  597    H    CYS 181           H        CYS 181  -4.523  -4.244   8.024
  598    HA   CYS 181           HA       CYS 181  -2.394  -2.625   6.736
  599    HB2  CYS 181          1HB       CYS 181  -5.374  -2.733   6.212
  600    HB3  CYS 181          2HB       CYS 181  -4.221  -1.677   5.387
  601    HG   CYS 181           HG       CYS 181  -4.819  -3.719   3.838
  602    H    LYS 182           H        LYS 182  -1.982  -0.562   7.269
  603    HA   LYS 182           HA       LYS 182  -3.811   0.993   9.061
  604    HB2  LYS 182          1HB       LYS 182  -0.811   0.674   9.535
  605    HB3  LYS 182          2HB       LYS 182  -1.920   1.691  10.455
  606    HG2  LYS 182          1HG       LYS 182  -3.155  -0.352  11.176
  607    HG3  LYS 182          2HG       LYS 182  -1.967  -1.361  10.344
  608    HD2  LYS 182          1HD       LYS 182  -1.233   0.636  12.526
  609    HD3  LYS 182          2HD       LYS 182  -1.673  -1.025  12.874
  610    HE2  LYS 182          1HE       LYS 182   0.687  -0.217  11.111
  611    HE3  LYS 182          2HE       LYS 182   0.784  -0.603  12.829
  612    HZ1  LYS 182          1HZ       LYS 182  -0.204  -2.825  12.260
  613    HZ2  LYS 182          2HZ       LYS 182   1.295  -2.605  11.665
  614    HZ3  LYS 182          3HZ       LYS 182  -0.015  -2.482  10.682
  615    H    LYS 183           H        LYS 183  -3.716   3.283   8.713
  616    HA   LYS 183           HA       LYS 183  -2.640   4.275   6.221
  617    HB2  LYS 183          1HB       LYS 183  -3.532   5.713   8.751
  618    HB3  LYS 183          2HB       LYS 183  -2.898   6.552   7.335
  619    HG2  LYS 183          1HG       LYS 183  -4.696   5.562   5.926
  620    HG3  LYS 183          2HG       LYS 183  -5.405   4.827   7.381
  621    HD2  LYS 183          1HD       LYS 183  -5.677   7.064   8.398
  622    HD3  LYS 183          2HD       LYS 183  -4.887   7.818   6.998
  623    HE2  LYS 183          1HE       LYS 183  -6.711   6.998   5.526
  624    HE3  LYS 183          2HE       LYS 183  -7.516   6.272   6.926
  625    HZ1  LYS 183          1HZ       LYS 183  -6.957   9.179   6.613
  626    HZ2  LYS 183          2HZ       LYS 183  -7.737   8.500   7.880
  627    HZ3  LYS 183          3HZ       LYS 183  -8.423   8.496   6.396
  628    H    ALA 184           H        ALA 184  -0.726   5.211   5.666
  629    HA   ALA 184           HA       ALA 184   1.559   4.449   7.190
  630    HB1  ALA 184          1HB       ALA 184   1.550   4.464   4.770
  631    HB2  ALA 184          2HB       ALA 184   1.302   6.231   4.746
  632    HB3  ALA 184          3HB       ALA 184   2.814   5.551   5.387
  633    H    GLN 185           H        GLN 185   1.664   5.354   9.154
  634    HA   GLN 185           HA       GLN 185   1.922   8.254   9.612
  635    HB2  GLN 185          1HB       GLN 185   2.041   5.763  11.324
  636    HB3  GLN 185          2HB       GLN 185   2.439   7.325  11.998
  637    HG2  GLN 185          1HG       GLN 185  -0.225   6.719  10.641
  638    HG3  GLN 185          2HG       GLN 185   0.077   6.493  12.360
  639   HE21  GLN 185          1HE2      GLN 185  -1.886   8.033  12.361
  640   HE22  GLN 185          2HE2      GLN 185  -1.486   9.745  12.381
  641    HA   PRO 186           HA       PRO 186   6.143   8.594   8.803
  642    HB2  PRO 186          1HB       PRO 186   7.091  10.464  10.566
  643    HB3  PRO 186          2HB       PRO 186   5.806  10.821   9.377
  644    HG2  PRO 186          1HG       PRO 186   5.444   9.981  12.285
  645    HG3  PRO 186          2HG       PRO 186   4.770  11.436  11.469
  646    HD2  PRO 186          1HD       PRO 186   3.362   9.175  11.747
  647    HD3  PRO 186          2HD       PRO 186   3.231  10.093  10.226
  648    H    LYS 187           H        LYS 187   8.478   8.732   9.771
  649    HA   LYS 187           HA       LYS 187   9.116   6.411  11.428
  650    HB2  LYS 187          1HB       LYS 187  10.714   8.554  10.029
  651    HB3  LYS 187          2HB       LYS 187  11.495   7.562  11.249
  652    HG2  LYS 187          1HG       LYS 187   9.952   6.279   8.979
  653    HG3  LYS 187          2HG       LYS 187  11.613   6.804   8.762
  654    HD2  LYS 187          1HD       LYS 187  10.746   4.885  10.969
  655    HD3  LYS 187          2HD       LYS 187  11.288   4.340   9.409
  656    HE2  LYS 187          1HE       LYS 187  12.961   5.992  11.333
  657    HE3  LYS 187          2HE       LYS 187  13.049   4.242  11.152
  658    HZ1  LYS 187          1HZ       LYS 187  14.772   5.437   9.880
  659    HZ2  LYS 187          2HZ       LYS 187  13.642   6.136   8.940
  660    HZ3  LYS 187          3HZ       LYS 187  13.879   4.513   8.898
  661    H    GLU 188           H        GLU 188   7.590   7.203  12.986
  662    HA   GLU 188           HA       GLU 188   8.980   8.313  15.371
  663    HB2  GLU 188          1HB       GLU 188   7.825  10.221  14.329
  664    HB3  GLU 188          2HB       GLU 188   6.294   9.326  14.368
  665    HG2  GLU 188          1HG       GLU 188   6.351   9.260  16.821
  666    HG3  GLU 188          2HG       GLU 188   7.940  10.033  16.830
  667    H    VAL 189           H        VAL 189   6.083   6.771  14.004
  668    HA   VAL 189           HA       VAL 189   5.290   5.390  16.433
  669    HB   VAL 189           HB       VAL 189   3.534   4.436  15.096
  670   HG11  VAL 189          1HG1      VAL 189   3.307   6.806  15.855
  671   HG12  VAL 189          2HG1      VAL 189   3.898   7.363  14.273
  672   HG13  VAL 189          3HG1      VAL 189   2.382   6.447  14.391
  673   HG21  VAL 189          1HG2      VAL 189   3.288   4.655  12.765
  674   HG22  VAL 189          2HG2      VAL 189   4.617   5.819  12.615
  675   HG23  VAL 189          3HG2      VAL 189   4.958   4.119  12.947
  676    H    MET 190           H        MET 190   7.965   4.781  15.871
  677    HA   MET 190           HA       MET 190   8.287   2.487  14.201
  678    HB2  MET 190          1HB       MET 190  10.153   3.934  16.052
  679    HB3  MET 190          2HB       MET 190  10.654   2.561  15.052
  680    HG2  MET 190          1HG       MET 190   9.976   3.664  13.014
  681    HG3  MET 190          2HG       MET 190   9.284   5.013  13.881
  682    HE1  MET 190          1HE       MET 190  10.334   6.693  15.017
  683    HE2  MET 190          2HE       MET 190  11.424   5.807  16.094
  684    HE3  MET 190          3HE       MET 190  12.059   7.144  15.092
  685    H    SER 191           H        SER 191   7.035   2.462  17.299
  686    HA   SER 191           HA       SER 191   8.351   0.356  18.566
  687    HB2  SER 191          1HB       SER 191   5.417   1.129  18.719
  688    HB3  SER 191          2HB       SER 191   6.251   0.051  19.856
  689    HG   SER 191           HG       SER 191   6.199   2.217  20.614
  690    HA   PRO 192           HA       PRO 192   7.038  -3.062  15.900
  691    HB2  PRO 192          1HB       PRO 192   8.132  -5.174  17.226
  692    HB3  PRO 192          2HB       PRO 192   9.125  -3.966  16.351
  693    HG2  PRO 192          1HG       PRO 192   8.491  -4.045  19.319
  694    HG3  PRO 192          2HG       PRO 192  10.092  -3.852  18.534
  695    HD2  PRO 192          1HD       PRO 192   8.641  -1.716  19.411
  696    HD3  PRO 192          2HD       PRO 192   9.628  -1.623  17.920
  697    H    THR 193           H        THR 193   5.398  -4.597  15.817
  698    HA   THR 193           HA       THR 193   3.558  -4.764  18.092
  699    HB   THR 193           HB       THR 193   1.941  -5.674  16.782
  700    HG1  THR 193          1HG       THR 193   3.868  -6.167  14.788
  701   HG21  THR 193          1HG2      THR 193   2.448  -3.302  16.141
  702   HG22  THR 193          2HG2      THR 193   1.665  -4.252  14.869
  703   HG23  THR 193          3HG2      THR 193   3.405  -3.908  14.771
  704    H    GLY 194           H        GLY 194   2.627  -6.832  18.836
  705    HA2  GLY 194          1HA       GLY 194   4.725  -8.390  19.985
  706    HA3  GLY 194          2HA       GLY 194   3.002  -8.715  20.118
  707    H    SER 195           H        SER 195   5.748 -10.145  19.301
  708    HA   SER 195           HA       SER 195   4.546 -12.002  17.285
  709    HB2  SER 195          1HB       SER 195   6.686 -12.013  16.114
  710    HB3  SER 195          2HB       SER 195   6.030 -10.369  16.204
  711    HG   SER 195           HG       SER 195   8.261 -10.430  16.742
  712    H    ALA 196           H        ALA 196   5.792 -11.910  20.375
  713    HA   ALA 196           HA       ALA 196   7.640 -14.103  20.328
  714    HB1  ALA 196          1HB       ALA 196   6.166 -12.774  22.643
  715    HB2  ALA 196          2HB       ALA 196   7.614 -13.794  22.768
  716    HB3  ALA 196          3HB       ALA 196   7.709 -12.232  21.939
  717    H    ARG 197           H        ARG 197   4.268 -14.281  20.090
  718    HA   ARG 197           HA       ARG 197   4.249 -17.134  20.846
  719    HB2  ARG 197          1HB       ARG 197   3.632 -15.644  22.873
  720    HB3  ARG 197          2HB       ARG 197   2.184 -15.212  21.981
  721    HG2  ARG 197          1HG       ARG 197   1.615 -16.900  23.538
  722    HG3  ARG 197          2HG       ARG 197   1.535 -17.666  21.958
  723    HD2  ARG 197          1HD       ARG 197   4.127 -17.849  23.525
  724    HD3  ARG 197          2HD       ARG 197   2.741 -18.753  24.112
  725    HE   ARG 197           HE       ARG 197   2.634 -20.068  22.165
  726   HH11  ARG 197          1HH1      ARG 197   5.693 -18.303  22.356
  727   HH12  ARG 197          2HH1      ARG 197   6.493 -19.495  21.375
  728   HH21  ARG 197          1HH2      ARG 197   3.637 -21.345  20.779
  729   HH22  ARG 197          2HH2      ARG 197   5.364 -21.189  20.499
  730    H    GLY 198           H        GLY 198   3.009 -18.352  19.593
  731    HA2  GLY 198          1HA       GLY 198   1.491 -17.149  17.346
  732    HA3  GLY 198          2HA       GLY 198   1.971 -18.830  17.538
  733    H    ARG 199           H        ARG 199  -0.191 -19.370  16.902
  734    HA   ARG 199           HA       ARG 199  -2.539 -18.825  18.485
  735    HB2  ARG 199          1HB       ARG 199  -2.581 -19.531  16.148
  736    HB3  ARG 199          2HB       ARG 199  -1.880 -21.094  16.548
  737    HG2  ARG 199          1HG       ARG 199  -4.478 -20.253  17.858
  738    HG3  ARG 199          2HG       ARG 199  -4.492 -20.749  16.171
  739    HD2  ARG 199          1HD       ARG 199  -3.627 -22.928  16.661
  740    HD3  ARG 199          2HD       ARG 199  -3.315 -22.536  18.341
  741    HE   ARG 199           HE       ARG 199  -5.879 -23.235  17.123
  742   HH11  ARG 199          1HH1      ARG 199  -4.470 -21.696  19.969
  743   HH12  ARG 199          2HH1      ARG 199  -5.874 -22.059  20.940
  744   HH21  ARG 199          1HH2      ARG 199  -7.623 -23.617  18.429
  745   HH22  ARG 199          2HH2      ARG 199  -7.606 -23.097  20.089
  746    H    SER 200           H        SER 200   0.088 -20.999  19.005
  747    HA   SER 200           HA       SER 200  -0.986 -21.784  21.638
  748    HB2  SER 200          1HB       SER 200  -1.611 -23.640  20.096
  749    HB3  SER 200          2HB       SER 200   0.102 -23.831  19.665
  750    HG   SER 200           HG       SER 200  -0.559 -25.254  21.389
  751    H5'    G 201           H5'        G 201   5.884 -14.731   8.632
  752   H5''    G 201           H5"        G 201   5.241 -13.094   8.791
  753    H4'    G 201           H4'        G 201   6.033 -13.836  10.938
  754    H3'    G 201           H3'        G 201   6.878 -11.422   9.769
  755    H2'    G 201           H2'        G 201   9.023 -12.233   9.234
  756   HO2'    G 201           HO2        G 201   9.086 -11.123  11.848
  757    H1'    G 201           H1'        G 201   8.988 -13.685  11.905
  758    H8     G 201          8H          G 201  10.169 -14.135   8.202
  759    H1     G 201          1H          G 201  14.234 -16.201  12.767
  760    H21    G 201          1H2         G 201  13.276 -15.868  14.785
  761    H22    G 201          2H2         G 201  11.677 -15.149  14.880
  762   HO5'    G 201           HO5        G 201   6.488 -12.690   7.153
  763    H5'    U 202           H5'        U 202   5.498  -9.368   9.963
  764   H5''    U 202           H5"        U 202   7.140  -9.292  10.611
  765    H4'    U 202           H4'        U 202   6.651  -7.127   9.924
  766    H3'    U 202           H3'        U 202   7.282  -7.514  12.566
  767    H2'    U 202           H2'        U 202   5.064  -7.512  13.342
  768   HO2'    U 202           HO2        U 202   6.365  -5.409  14.004
  769    H1'    U 202           H1'        U 202   4.339  -5.202  11.533
  770    H3     U 202          3H          U 202  -0.038  -5.383  12.770
  771    H5     U 202          5H          U 202   1.103  -9.413  12.851
  772    H6     U 202          6H          U 202   3.355  -8.756  12.184
  773    H5'    A 203           H5'        A 203   7.193  -2.390  13.703
  774   H5''    A 203           H5"        A 203   6.312  -3.294  12.455
  775    H4'    A 203           H4'        A 203   7.294  -1.784  10.731
  776    H3'    A 203           H3'        A 203   8.702  -0.559  12.973
  777    H2'    A 203           H2'        A 203   6.963   0.973  13.337
  778   HO2'    A 203           HO2        A 203   8.696   2.052  11.698
  779    H1'    A 203           H1'        A 203   6.185   0.597  10.443
  780    H8     A 203          8H          A 203   4.096   0.319  13.705
  781    H61    A 203          1H6         A 203   0.153   3.763  10.223
  782    H62    A 203          2H6         A 203   0.244   2.899  11.771
  783    H2     A 203          2H          A 203   3.946   3.763   8.268
  784    H5'    G 204           H5'        G 204   9.939   2.082   8.836
  785   H5''    G 204           H5"        G 204   9.256   0.516   8.379
  786    H4'    G 204           H4'        G 204  11.353   0.108   7.003
  787    H3'    G 204           H3'        G 204  12.416   2.276   8.321
  788    H2'    G 204           H2'        G 204  10.856   3.801   7.481
  789   HO2'    G 204           HO2        G 204  13.181   4.266   6.537
  790    H1'    G 204           H1'        G 204  11.080   2.590   4.742
  791    H8     G 204          8H          G 204   9.424   3.797   3.219
  792    H1     G 204          1H          G 204   5.810   5.875   8.137
  793    H21    G 204          1H2         G 204   6.696   5.147  10.073
  794    H22    G 204          2H2         G 204   8.023   4.014  10.047
  795    H5'    U 205           H5'        U 205  14.008   1.470   4.000
  796   H5''    U 205           H5"        U 205  15.772   1.653   3.929
  797    H4'    U 205           H4'        U 205  15.517   3.784   2.710
  798    H3'    U 205           H3'        U 205  12.959   3.996   3.749
  799   HO3'    U 205           HO3        U 205  12.733   5.675   2.252
  800    H2'    U 205           H2'        U 205  12.173   2.086   2.523
  801   HO2'    U 205           HO2        U 205  11.570   4.379   0.898
  802    H1'    U 205           H1'        U 205  13.639   3.342   0.175
  803    H3     U 205          3H          U 205  11.993   0.476  -2.913
  804    H5     U 205          5H          U 205  12.566  -2.004   0.406
  805    H6     U 205          6H          U 205  13.280  -0.051   1.699
  Start of MODEL    6
    1    H1   GLY 105          1H        GLY 105  -3.449  15.161   2.641
    2    H2   GLY 105          2H        GLY 105  -3.609  15.742   1.119
    3    H3   GLY 105          3H        GLY 105  -3.214  16.758   2.344
    4    HA2  GLY 105          1HA       GLY 105  -1.266  16.284   1.004
    5    HA3  GLY 105          2HA       GLY 105  -1.091  15.677   2.661
    6    H    SER 106           H        SER 106  -0.093  14.806  -0.165
    7    HA   SER 106           HA       SER 106  -1.354  12.494  -1.030
    8    HB2  SER 106          1HB       SER 106   1.593  13.220  -1.237
    9    HB3  SER 106          2HB       SER 106   0.752  12.011  -2.230
   10    HG   SER 106           HG       SER 106   0.856  14.058  -3.272
   11    H    HIS 107           H        HIS 107   0.802  12.655   1.743
   12    HA   HIS 107           HA       HIS 107   1.558   9.889   1.903
   13    HB2  HIS 107          1HB       HIS 107   2.033  10.395   4.237
   14    HB3  HIS 107          2HB       HIS 107   2.633  11.682   3.199
   15    HD2  HIS 107          2HD       HIS 107   0.765  11.203   6.319
   16    HE1  HIS 107          1HE       HIS 107  -0.295  15.140   5.077
   17    HE2  HIS 107          2HE       HIS 107  -0.337  13.494   7.014
   18    H    MET 108           H        MET 108  -1.515  11.481   2.575
   19    HA   MET 108           HA       MET 108  -2.706   9.449   4.206
   20    HB2  MET 108          1HB       MET 108  -3.548  11.779   3.871
   21    HB3  MET 108          2HB       MET 108  -3.980  11.361   2.215
   22    HG2  MET 108          1HG       MET 108  -5.941  11.320   3.635
   23    HG3  MET 108          2HG       MET 108  -5.614   9.718   3.002
   24    HE1  MET 108          1HE       MET 108  -5.561  12.089   6.125
   25    HE2  MET 108          2HE       MET 108  -4.968  11.031   7.424
   26    HE3  MET 108          3HE       MET 108  -3.860  11.563   6.147
   27    H    LYS 109           H        LYS 109  -1.920   9.446   0.792
   28    HA   LYS 109           HA       LYS 109  -3.734   7.256   0.098
   29    HB2  LYS 109          1HB       LYS 109  -1.402   8.403  -1.469
   30    HB3  LYS 109          2HB       LYS 109  -2.589   7.229  -2.041
   31    HG2  LYS 109          1HG       LYS 109  -4.409   8.925  -1.509
   32    HG3  LYS 109          2HG       LYS 109  -3.116  10.121  -1.276
   33    HD2  LYS 109          1HD       LYS 109  -2.303   9.500  -3.621
   34    HD3  LYS 109          2HD       LYS 109  -3.785   8.530  -3.778
   35    HE2  LYS 109          1HE       LYS 109  -5.155  10.564  -3.378
   36    HE3  LYS 109          2HE       LYS 109  -3.683  11.529  -3.217
   37    HZ1  LYS 109          1HZ       LYS 109  -3.141  10.979  -5.526
   38    HZ2  LYS 109          2HZ       LYS 109  -4.614  11.676  -5.467
   39    HZ3  LYS 109          3HZ       LYS 109  -4.484  10.058  -5.683
   40    H    LYS 110           H        LYS 110  -1.063   7.171   2.057
   41    HA   LYS 110           HA       LYS 110  -0.037   4.566   1.011
   42    HB2  LYS 110          1HB       LYS 110   1.499   6.528   1.199
   43    HB3  LYS 110          2HB       LYS 110   1.234   6.525   2.941
   44    HG2  LYS 110          1HG       LYS 110   2.212   4.197   3.033
   45    HG3  LYS 110          2HG       LYS 110   2.534   4.311   1.292
   46    HD2  LYS 110          1HD       LYS 110   3.922   6.352   1.702
   47    HD3  LYS 110          2HD       LYS 110   3.601   6.207   3.441
   48    HE2  LYS 110          1HE       LYS 110   4.682   3.939   3.393
   49    HE3  LYS 110          2HE       LYS 110   5.103   4.207   1.695
   50    HZ1  LYS 110          1HZ       LYS 110   6.411   6.150   2.423
   51    HZ2  LYS 110          2HZ       LYS 110   6.930   4.814   3.227
   52    HZ3  LYS 110          3HZ       LYS 110   5.990   5.883   3.991
   53    H    ILE 111           H        ILE 111  -0.106   2.736   2.160
   54    HA   ILE 111           HA       ILE 111  -0.996   2.806   5.015
   55    HB   ILE 111           HB       ILE 111  -2.164   0.737   4.785
   56   HG12  ILE 111          1HG1      ILE 111  -1.526   0.742   1.832
   57   HG13  ILE 111          2HG1      ILE 111  -0.827  -0.349   3.022
   58   HG21  ILE 111          1HG2      ILE 111  -3.334   2.890   4.335
   59   HG22  ILE 111          2HG2      ILE 111  -3.175   2.565   2.589
   60   HG23  ILE 111          3HG2      ILE 111  -4.108   1.468   3.639
   61   HD11  ILE 111          1HD1      ILE 111  -3.752  -0.295   2.221
   62   HD12  ILE 111          2HD1      ILE 111  -2.548  -1.539   1.857
   63   HD13  ILE 111          3HD1      ILE 111  -3.065  -1.281   3.535
   64    H    PHE 112           H        PHE 112  -0.258   1.279   6.338
   65    HA   PHE 112           HA       PHE 112   2.314  -0.102   5.781
   66    HB2  PHE 112          1HB       PHE 112   2.056   1.259   7.850
   67    HB3  PHE 112          2HB       PHE 112   0.635   0.330   8.288
   68    HD1  PHE 112          1HD       PHE 112   4.256   0.461   8.337
   69    HD2  PHE 112          2HD       PHE 112   0.861  -2.129   8.911
   70    HE1  PHE 112          1HE       PHE 112   5.692  -1.148   9.532
   71    HE2  PHE 112          2HE       PHE 112   2.303  -3.741  10.130
   72    HZ   PHE 112           HZ       PHE 112   4.727  -3.258  10.429
   73    H    VAL 113           H        VAL 113   2.360  -2.351   5.733
   74    HA   VAL 113           HA       VAL 113  -0.119  -3.910   6.255
   75    HB   VAL 113           HB       VAL 113   1.772  -4.484   3.957
   76   HG11  VAL 113          1HG1      VAL 113  -0.934  -5.657   4.723
   77   HG12  VAL 113          2HG1      VAL 113   0.005  -6.068   3.269
   78   HG13  VAL 113          3HG1      VAL 113   0.643  -6.472   4.865
   79   HG21  VAL 113          1HG2      VAL 113   0.571  -2.456   3.383
   80   HG22  VAL 113          2HG2      VAL 113  -0.074  -3.809   2.459
   81   HG23  VAL 113          3HG2      VAL 113  -0.980  -3.194   3.861
   82    H    GLY 114           H        GLY 114   0.255  -5.492   7.750
   83    HA2  GLY 114          1HA       GLY 114   3.038  -6.590   8.037
   84    HA3  GLY 114          2HA       GLY 114   2.161  -5.973   9.423
   85    H    GLY 115           H        GLY 115   3.248  -8.599   9.098
   86    HA2  GLY 115          1HA       GLY 115   2.453 -10.667   9.981
   87    HA3  GLY 115          2HA       GLY 115   0.819 -10.302   9.437
   88    H    LEU 116           H        LEU 116   3.260  -9.651   7.097
   89    HA   LEU 116           HA       LEU 116   2.198 -11.558   5.187
   90    HB2  LEU 116          1HB       LEU 116   4.625  -9.717   5.224
   91    HB3  LEU 116          2HB       LEU 116   4.197 -10.694   3.829
   92    HG   LEU 116           HG       LEU 116   2.164  -8.757   5.000
   93   HD11  LEU 116          1HD1      LEU 116   2.960  -7.092   3.350
   94   HD12  LEU 116          2HD1      LEU 116   4.329  -8.157   2.950
   95   HD13  LEU 116          3HD1      LEU 116   4.194  -7.442   4.571
   96   HD21  LEU 116          1HD2      LEU 116   2.677  -9.706   2.148
   97   HD22  LEU 116          2HD2      LEU 116   1.268  -8.806   2.747
   98   HD23  LEU 116          3HD2      LEU 116   1.524 -10.496   3.229
   99    H    SER 117           H        SER 117   3.045 -13.505   4.461
  100    HA   SER 117           HA       SER 117   5.080 -14.845   6.096
  101    HB2  SER 117          1HB       SER 117   4.705 -16.762   4.696
  102    HB3  SER 117          2HB       SER 117   3.143 -16.073   5.166
  103    HG   SER 117           HG       SER 117   3.167 -16.562   2.951
  104    H    VAL 118           H        VAL 118   7.150 -15.553   5.346
  105    HA   VAL 118           HA       VAL 118   8.488 -13.797   3.494
  106    HB   VAL 118           HB       VAL 118  10.466 -14.980   3.836
  107   HG11  VAL 118          1HG1      VAL 118   8.963 -15.195   6.479
  108   HG12  VAL 118          2HG1      VAL 118  10.707 -15.009   6.234
  109   HG13  VAL 118          3HG1      VAL 118   9.615 -13.687   5.796
  110   HG21  VAL 118          1HG2      VAL 118  10.620 -17.148   5.017
  111   HG22  VAL 118          2HG2      VAL 118   8.851 -17.283   5.003
  112   HG23  VAL 118          3HG2      VAL 118   9.769 -17.297   3.479
  113    H    ASN 119           H        ASN 119   6.579 -16.566   2.903
  114    HA   ASN 119           HA       ASN 119   7.613 -17.176   0.238
  115    HB2  ASN 119          1HB       ASN 119   6.421 -18.847   1.611
  116    HB3  ASN 119          2HB       ASN 119   4.985 -17.821   1.654
  117   HD21  ASN 119          1HD2      ASN 119   7.012 -19.855  -0.454
  118   HD22  ASN 119          2HD2      ASN 119   5.773 -20.042  -1.686
  119    H    THR 120           H        THR 120   5.147 -14.982   1.601
  120    HA   THR 120           HA       THR 120   4.051 -14.119  -0.935
  121    HB   THR 120           HB       THR 120   4.059 -12.712   1.766
  122    HG1  THR 120          1HG       THR 120   2.983 -14.595   1.955
  123   HG21  THR 120          1HG2      THR 120   3.482 -11.066   0.106
  124   HG22  THR 120          2HG2      THR 120   1.984 -11.615   0.869
  125   HG23  THR 120          3HG2      THR 120   2.419 -12.204  -0.743
  126    H    THR 121           H        THR 121   4.628 -12.561  -2.289
  127    HA   THR 121           HA       THR 121   6.947 -10.831  -1.595
  128    HB   THR 121           HB       THR 121   7.512 -12.664  -3.205
  129    HG1  THR 121          1HG       THR 121   8.823 -11.240  -4.301
  130   HG21  THR 121          1HG2      THR 121   6.062 -10.849  -5.198
  131   HG22  THR 121          2HG2      THR 121   5.511 -12.467  -4.703
  132   HG23  THR 121          3HG2      THR 121   7.045 -12.280  -5.566
  133    H    VAL 122           H        VAL 122   7.199  -8.889  -2.937
  134    HA   VAL 122           HA       VAL 122   5.127  -7.143  -2.251
  135    HB   VAL 122           HB       VAL 122   7.552  -6.627  -2.613
  136   HG11  VAL 122          1HG1      VAL 122   6.806  -6.235  -5.542
  137   HG12  VAL 122          2HG1      VAL 122   8.358  -5.893  -4.763
  138   HG13  VAL 122          3HG1      VAL 122   7.811  -7.567  -4.918
  139   HG21  VAL 122          1HG2      VAL 122   5.882  -4.868  -2.199
  140   HG22  VAL 122          2HG2      VAL 122   7.171  -4.324  -3.297
  141   HG23  VAL 122          3HG2      VAL 122   5.579  -4.741  -3.948
  142    H    GLU 123           H        GLU 123   5.601  -8.687  -5.401
  143    HA   GLU 123           HA       GLU 123   3.583  -7.148  -6.770
  144    HB2  GLU 123          1HB       GLU 123   4.757  -9.895  -7.390
  145    HB3  GLU 123          2HB       GLU 123   3.727  -8.944  -8.477
  146    HG2  GLU 123          1HG       GLU 123   5.420  -7.089  -8.388
  147    HG3  GLU 123          2HG       GLU 123   6.485  -8.146  -7.454
  148    H    ASP 124           H        ASP 124   3.379 -10.072  -4.754
  149    HA   ASP 124           HA       ASP 124   0.675 -10.849  -5.511
  150    HB2  ASP 124          1HB       ASP 124   1.990 -11.191  -2.785
  151    HB3  ASP 124          2HB       ASP 124   0.644 -12.100  -3.438
  152    H    VAL 125           H        VAL 125   2.140  -8.777  -3.003
  153    HA   VAL 125           HA       VAL 125  -0.290  -8.016  -1.700
  154    HB   VAL 125           HB       VAL 125   2.392  -6.580  -1.743
  155   HG11  VAL 125          1HG1      VAL 125   1.677  -5.648   0.432
  156   HG12  VAL 125          2HG1      VAL 125   0.606  -5.132  -0.872
  157   HG13  VAL 125          3HG1      VAL 125   0.090  -6.426   0.239
  158   HG21  VAL 125          1HG2      VAL 125   2.775  -7.756   0.418
  159   HG22  VAL 125          2HG2      VAL 125   1.286  -8.683   0.159
  160   HG23  VAL 125          3HG2      VAL 125   2.668  -8.879  -0.935
  161    H    LYS 126           H        LYS 126   1.646  -6.302  -4.202
  162    HA   LYS 126           HA       LYS 126  -0.158  -4.104  -4.520
  163    HB2  LYS 126          1HB       LYS 126   2.125  -4.064  -5.332
  164    HB3  LYS 126          2HB       LYS 126   1.806  -5.364  -6.484
  165    HG2  LYS 126          1HG       LYS 126   0.425  -3.983  -7.843
  166    HG3  LYS 126          2HG       LYS 126   0.235  -2.770  -6.570
  167    HD2  LYS 126          1HD       LYS 126   2.693  -2.267  -6.728
  168    HD3  LYS 126          2HD       LYS 126   2.797  -3.357  -8.112
  169    HE2  LYS 126          1HE       LYS 126   1.069  -0.838  -7.925
  170    HE3  LYS 126          2HE       LYS 126   2.636  -0.945  -8.729
  171    HZ1  LYS 126          1HZ       LYS 126   0.892  -1.171 -10.346
  172    HZ2  LYS 126          2HZ       LYS 126   0.152  -2.375  -9.542
  173    HZ3  LYS 126          3HZ       LYS 126   1.623  -2.627 -10.233
  174    H    HIS 127           H        HIS 127  -0.037  -7.184  -6.406
  175    HA   HIS 127           HA       HIS 127  -2.294  -6.625  -8.031
  176    HB2  HIS 127          1HB       HIS 127  -0.595  -8.404  -8.419
  177    HB3  HIS 127          2HB       HIS 127  -1.253  -9.318  -7.056
  178    HD2  HIS 127          2HD       HIS 127  -2.516  -7.787 -10.407
  179    HE1  HIS 127          1HE       HIS 127  -4.828 -11.304  -9.689
  180    HE2  HIS 127          2HE       HIS 127  -4.400  -9.401 -11.328
  181    H    TYR 128           H        TYR 128  -2.172  -8.188  -4.783
  182    HA   TYR 128           HA       TYR 128  -4.965  -8.731  -4.698
  183    HB2  TYR 128          1HB       TYR 128  -3.551  -9.926  -3.232
  184    HB3  TYR 128          2HB       TYR 128  -2.930  -8.447  -2.504
  185    HD1  TYR 128          1HD       TYR 128  -5.811 -10.730  -2.699
  186    HD2  TYR 128          2HD       TYR 128  -4.241  -7.159  -0.846
  187    HE1  TYR 128          1HE       TYR 128  -7.649 -10.792  -1.026
  188    HE2  TYR 128          2HE       TYR 128  -6.093  -7.216   0.811
  189    HH   TYR 128           HH       TYR 128  -8.690  -9.681   0.685
  190    H    PHE 129           H        PHE 129  -3.210  -5.857  -3.454
  191    HA   PHE 129           HA       PHE 129  -5.646  -4.658  -2.559
  192    HB2  PHE 129          1HB       PHE 129  -2.865  -3.586  -2.802
  193    HB3  PHE 129          2HB       PHE 129  -4.220  -2.559  -2.370
  194    HD1  PHE 129          1HD       PHE 129  -1.682  -4.537  -0.996
  195    HD2  PHE 129          2HD       PHE 129  -5.848  -3.594  -0.445
  196    HE1  PHE 129          1HE       PHE 129  -1.549  -5.309   1.362
  197    HE2  PHE 129          2HE       PHE 129  -5.709  -4.400   1.900
  198    HZ   PHE 129           HZ       PHE 129  -3.565  -5.248   2.808
  199    H    GLU 130           H        GLU 130  -4.198  -4.514  -5.705
  200    HA   GLU 130           HA       GLU 130  -5.587  -2.313  -6.799
  201    HB2  GLU 130          1HB       GLU 130  -4.548  -4.895  -7.956
  202    HB3  GLU 130          2HB       GLU 130  -5.406  -3.731  -8.974
  203    HG2  GLU 130          1HG       GLU 130  -3.834  -1.987  -8.521
  204    HG3  GLU 130          2HG       GLU 130  -3.027  -2.930  -7.279
  205    H    GLN 131           H        GLN 131  -6.979  -5.319  -5.786
  206    HA   GLN 131           HA       GLN 131  -9.301  -5.462  -7.449
  207    HB2  GLN 131          1HB       GLN 131  -8.834  -6.297  -4.543
  208    HB3  GLN 131          2HB       GLN 131 -10.228  -6.774  -5.524
  209    HG2  GLN 131          1HG       GLN 131  -8.743  -7.788  -7.169
  210    HG3  GLN 131          2HG       GLN 131  -7.321  -7.421  -6.201
  211   HE21  GLN 131          1HE2      GLN 131  -7.443  -8.217  -3.840
  212   HE22  GLN 131          2HE2      GLN 131  -8.191  -9.793  -3.572
  213    H    PHE 132           H        PHE 132  -8.763  -3.926  -4.348
  214    HA   PHE 132           HA       PHE 132 -11.397  -2.765  -4.022
  215    HB2  PHE 132          1HB       PHE 132  -8.746  -1.917  -2.768
  216    HB3  PHE 132          2HB       PHE 132 -10.345  -1.403  -2.256
  217    HD1  PHE 132          1HD       PHE 132  -7.771  -3.834  -1.823
  218    HD2  PHE 132          2HD       PHE 132 -12.045  -3.340  -1.617
  219    HE1  PHE 132          1HE       PHE 132  -7.930  -5.852  -0.380
  220    HE2  PHE 132          2HE       PHE 132 -12.210  -5.393  -0.219
  221    HZ   PHE 132           HZ       PHE 132 -10.147  -6.638   0.413
  222    H    GLY 133           H        GLY 133  -8.396  -1.545  -5.375
  223    HA2  GLY 133          1HA       GLY 133  -9.416   0.101  -7.357
  224    HA3  GLY 133          2HA       GLY 133  -9.182   1.160  -5.960
  225    H    LYS 134           H        LYS 134  -7.690   1.450  -8.331
  226    HA   LYS 134           HA       LYS 134  -5.413  -0.150  -8.540
  227    HB2  LYS 134          1HB       LYS 134  -6.220   1.136 -10.417
  228    HB3  LYS 134          2HB       LYS 134  -5.827   2.657  -9.606
  229    HG2  LYS 134          1HG       LYS 134  -3.429   2.042  -9.602
  230    HG3  LYS 134          2HG       LYS 134  -3.810   0.487 -10.360
  231    HD2  LYS 134          1HD       LYS 134  -4.613   1.727 -12.373
  232    HD3  LYS 134          2HD       LYS 134  -4.161   3.252 -11.603
  233    HE2  LYS 134          1HE       LYS 134  -2.305   0.953 -12.372
  234    HE3  LYS 134          2HE       LYS 134  -2.415   2.531 -13.154
  235    HZ1  LYS 134          1HZ       LYS 134  -1.649   3.522 -11.001
  236    HZ2  LYS 134          2HZ       LYS 134  -0.536   2.538 -11.689
  237    HZ3  LYS 134          3HZ       LYS 134  -1.399   2.016 -10.402
  238    H    VAL 135           H        VAL 135  -3.453  -0.151  -7.959
  239    HA   VAL 135           HA       VAL 135  -2.486   1.530  -5.707
  240    HB   VAL 135           HB       VAL 135  -1.608  -1.155  -6.811
  241   HG11  VAL 135          1HG1      VAL 135  -0.176  -1.354  -4.820
  242   HG12  VAL 135          2HG1      VAL 135   0.357  -0.031  -5.860
  243   HG13  VAL 135          3HG1      VAL 135  -0.553   0.310  -4.371
  244   HG21  VAL 135          1HG2      VAL 135  -3.787  -1.161  -5.554
  245   HG22  VAL 135          2HG2      VAL 135  -2.511  -2.043  -4.703
  246   HG23  VAL 135          3HG2      VAL 135  -2.969  -0.406  -4.180
  247    H    ASP 136           H        ASP 136  -0.740   2.783  -5.899
  248    HA   ASP 136           HA       ASP 136   0.382   3.447  -8.538
  249    HB2  ASP 136          1HB       ASP 136  -0.229   5.261  -7.047
  250    HB3  ASP 136          2HB       ASP 136   0.726   4.573  -5.745
  251    H    ASP 137           H        ASP 137   1.561   2.193  -5.380
  252    HA   ASP 137           HA       ASP 137   3.810   0.769  -6.636
  253    HB2  ASP 137          1HB       ASP 137   4.464   3.261  -6.355
  254    HB3  ASP 137          2HB       ASP 137   4.319   3.010  -4.618
  255    H    ALA 138           H        ALA 138   5.014  -0.487  -5.018
  256    HA   ALA 138           HA       ALA 138   4.010  -0.684  -2.282
  257    HB1  ALA 138          1HB       ALA 138   3.883  -3.082  -4.164
  258    HB2  ALA 138          2HB       ALA 138   3.585  -3.120  -2.415
  259    HB3  ALA 138          3HB       ALA 138   2.486  -2.222  -3.479
  260    H    MET 139           H        MET 139   5.489  -1.705  -0.853
  261    HA   MET 139           HA       MET 139   8.000  -2.859  -1.866
  262    HB2  MET 139          1HB       MET 139   9.453  -1.275  -0.674
  263    HB3  MET 139          2HB       MET 139   8.588  -0.536  -2.019
  264    HG2  MET 139          1HG       MET 139   6.975   0.489  -0.439
  265    HG3  MET 139          2HG       MET 139   7.825  -0.265   0.912
  266    HE1  MET 139          1HE       MET 139   8.369   1.782   2.321
  267    HE2  MET 139          2HE       MET 139   8.875   3.342   1.639
  268    HE3  MET 139          3HE       MET 139   7.283   2.668   1.222
  269    H    LEU 140           H        LEU 140   8.829  -4.363  -0.492
  270    HA   LEU 140           HA       LEU 140   7.686  -4.549   2.267
  271    HB2  LEU 140          1HB       LEU 140   9.016  -6.757   0.683
  272    HB3  LEU 140          2HB       LEU 140   8.232  -6.881   2.257
  273    HG   LEU 140           HG       LEU 140   6.881  -6.346  -0.417
  274   HD11  LEU 140          1HD1      LEU 140   5.773  -8.488   0.021
  275   HD12  LEU 140          2HD1      LEU 140   6.633  -8.637   1.565
  276   HD13  LEU 140          3HD1      LEU 140   7.536  -8.689   0.035
  277   HD21  LEU 140          1HD2      LEU 140   5.700  -6.347   2.380
  278   HD22  LEU 140          2HD2      LEU 140   4.736  -6.529   0.894
  279   HD23  LEU 140          3HD2      LEU 140   5.635  -5.043   1.173
  280    H    MET 141           H        MET 141   9.014  -4.784   4.062
  281    HA   MET 141           HA       MET 141  11.572  -3.368   3.683
  282    HB2  MET 141          1HB       MET 141  10.024  -4.121   6.185
  283    HB3  MET 141          2HB       MET 141  11.527  -3.193   6.136
  284    HG2  MET 141          1HG       MET 141   8.872  -2.360   4.927
  285    HG3  MET 141          2HG       MET 141   9.628  -1.722   6.374
  286    HE1  MET 141          1HE       MET 141  10.092  -0.153   2.217
  287    HE2  MET 141          2HE       MET 141  10.076  -1.918   2.385
  288    HE3  MET 141          3HE       MET 141   8.728  -0.959   3.036
  289    H    PHE 142           H        PHE 142  13.227  -4.599   3.074
  290    HA   PHE 142           HA       PHE 142  13.675  -7.242   4.096
  291    HB2  PHE 142          1HB       PHE 142  15.097  -5.599   2.090
  292    HB3  PHE 142          2HB       PHE 142  15.885  -7.001   2.791
  293    HD1  PHE 142          1HD       PHE 142  15.459  -9.170   1.966
  294    HD2  PHE 142          2HD       PHE 142  12.687  -5.991   1.086
  295    HE1  PHE 142          1HE       PHE 142  14.187 -10.689   0.468
  296    HE2  PHE 142          2HE       PHE 142  11.393  -7.520  -0.377
  297    HZ   PHE 142           HZ       PHE 142  12.131  -9.876  -0.679
  298    H    ASP 143           H        ASP 143  15.220  -8.246   5.214
  299    HA   ASP 143           HA       ASP 143  17.021  -6.535   6.862
  300    HB2  ASP 143          1HB       ASP 143  15.407  -7.357   8.349
  301    HB3  ASP 143          2HB       ASP 143  15.511  -8.991   7.695
  302    H    LYS 144           H        LYS 144  19.001  -6.627   6.170
  303    HA   LYS 144           HA       LYS 144  19.885  -8.492   4.199
  304    HB2  LYS 144          1HB       LYS 144  21.429  -6.469   5.871
  305    HB3  LYS 144          2HB       LYS 144  22.099  -7.360   4.496
  306    HG2  LYS 144          1HG       LYS 144  20.371  -6.405   3.000
  307    HG3  LYS 144          2HG       LYS 144  19.693  -5.485   4.357
  308    HD2  LYS 144          1HD       LYS 144  21.825  -4.253   4.611
  309    HD3  LYS 144          2HD       LYS 144  22.544  -5.218   3.318
  310    HE2  LYS 144          1HE       LYS 144  21.935  -3.086   2.405
  311    HE3  LYS 144          2HE       LYS 144  20.894  -4.323   1.700
  312    HZ1  LYS 144          1HZ       LYS 144  20.095  -2.528   3.934
  313    HZ2  LYS 144          2HZ       LYS 144  19.109  -3.602   3.183
  314    HZ3  LYS 144          3HZ       LYS 144  19.670  -2.314   2.375
  315    H    THR 145           H        THR 145  20.072  -8.770   7.673
  316    HA   THR 145           HA       THR 145  22.084 -10.841   7.685
  317    HB   THR 145           HB       THR 145  20.068 -10.475   9.870
  318    HG1  THR 145          1HG       THR 145  21.264  -8.818  10.670
  319   HG21  THR 145          1HG2      THR 145  22.040 -10.970  11.305
  320   HG22  THR 145          2HG2      THR 145  23.039 -11.163   9.847
  321   HG23  THR 145          3HG2      THR 145  21.702 -12.287  10.179
  322    H    THR 146           H        THR 146  18.638 -10.907   7.135
  323    HA   THR 146           HA       THR 146  18.678 -13.882   7.108
  324    HB   THR 146           HB       THR 146  16.439 -14.008   7.526
  325    HG1  THR 146          1HG       THR 146  15.074 -12.189   7.443
  326   HG21  THR 146          1HG2      THR 146  17.209 -11.531   9.128
  327   HG22  THR 146          2HG2      THR 146  17.688 -13.193   9.543
  328   HG23  THR 146          3HG2      THR 146  15.975 -12.740   9.534
  329    H    ASN 147           H        ASN 147  18.438 -11.208   5.004
  330    HA   ASN 147           HA       ASN 147  18.073 -10.911   2.830
  331    HB2  ASN 147          1HB       ASN 147  19.908 -12.635   2.670
  332    HB3  ASN 147          2HB       ASN 147  18.665 -13.861   2.420
  333   HD21  ASN 147          1HD2      ASN 147  19.587 -14.333   0.326
  334   HD22  ASN 147          2HD2      ASN 147  19.352 -13.218  -1.012
  335    H    ARG 148           H        ARG 148  15.867 -11.434   4.536
  336    HA   ARG 148           HA       ARG 148  13.757 -11.890   2.486
  337    HB2  ARG 148          1HB       ARG 148  13.715 -12.996   5.331
  338    HB3  ARG 148          2HB       ARG 148  12.354 -13.025   4.222
  339    HG2  ARG 148          1HG       ARG 148  14.987 -14.498   3.790
  340    HG3  ARG 148          2HG       ARG 148  13.495 -15.200   4.405
  341    HD2  ARG 148          1HD       ARG 148  12.331 -14.666   2.297
  342    HD3  ARG 148          2HD       ARG 148  13.790 -13.936   1.641
  343    HE   ARG 148           HE       ARG 148  13.236 -16.809   2.047
  344   HH11  ARG 148          1HH1      ARG 148  15.705 -14.474   1.111
  345   HH12  ARG 148          2HH1      ARG 148  16.594 -15.680   0.215
  346   HH21  ARG 148          1HH2      ARG 148  14.478 -18.276   0.961
  347   HH22  ARG 148          2HH2      ARG 148  15.940 -17.769   0.170
  348    H    HIS 149           H        HIS 149  11.649 -10.934   3.208
  349    HA   HIS 149           HA       HIS 149  12.077  -8.327   4.486
  350    HB2  HIS 149          1HB       HIS 149   9.807  -7.823   3.982
  351    HB3  HIS 149          2HB       HIS 149  10.604  -8.464   2.552
  352    HD2  HIS 149          2HD       HIS 149   9.382 -10.417   1.338
  353    HE1  HIS 149          1HE       HIS 149   6.468 -11.331   4.308
  354    HE2  HIS 149          2HE       HIS 149   7.219 -11.803   1.917
  355    H    ARG 150           H        ARG 150  11.048  -7.575   6.326
  356    HA   ARG 150           HA       ARG 150  11.111  -9.435   8.556
  357    HB2  ARG 150          1HB       ARG 150  10.520  -6.464   8.348
  358    HB3  ARG 150          2HB       ARG 150  10.655  -7.339   9.883
  359    HG2  ARG 150          1HG       ARG 150  12.973  -8.019   9.296
  360    HG3  ARG 150          2HG       ARG 150  12.890  -7.022   7.835
  361    HD2  ARG 150          1HD       ARG 150  12.486  -5.984  10.678
  362    HD3  ARG 150          2HD       ARG 150  14.007  -5.924   9.800
  363    HE   ARG 150           HE       ARG 150  11.562  -4.621   8.689
  364   HH11  ARG 150          1HH1      ARG 150  14.914  -4.119   9.786
  365   HH12  ARG 150          2HH1      ARG 150  14.853  -2.459   9.184
  366   HH21  ARG 150          1HH2      ARG 150  11.724  -2.498   8.043
  367   HH22  ARG 150          2HH2      ARG 150  13.226  -1.638   8.350
  368    H    GLY 151           H        GLY 151   8.773  -9.650   6.570
  369    HA2  GLY 151          1HA       GLY 151   6.599 -10.361   6.734
  370    HA3  GLY 151          2HA       GLY 151   6.653 -10.188   8.488
  371    H    PHE 152           H        PHE 152   7.544  -7.295   6.726
  372    HA   PHE 152           HA       PHE 152   4.785  -6.322   6.576
  373    HB2  PHE 152          1HB       PHE 152   5.020  -4.498   8.056
  374    HB3  PHE 152          2HB       PHE 152   5.520  -5.905   8.949
  375    HD1  PHE 152          1HD       PHE 152   7.943  -6.171   9.617
  376    HD2  PHE 152          2HD       PHE 152   6.519  -2.690   7.512
  377    HE1  PHE 152          1HE       PHE 152   9.939  -4.890  10.380
  378    HE2  PHE 152          2HE       PHE 152   8.502  -1.420   8.248
  379    HZ   PHE 152           HZ       PHE 152  10.195  -2.502   9.741
  380    H    GLY 153           H        GLY 153   4.614  -4.202   5.606
  381    HA2  GLY 153          1HA       GLY 153   6.834  -2.896   4.270
  382    HA3  GLY 153          2HA       GLY 153   5.863  -3.885   3.175
  383    H    PHE 154           H        PHE 154   5.680  -1.699   2.230
  384    HA   PHE 154           HA       PHE 154   3.246  -0.319   3.213
  385    HB2  PHE 154          1HB       PHE 154   5.727   0.937   2.036
  386    HB3  PHE 154          2HB       PHE 154   4.196   1.777   2.239
  387    HD1  PHE 154          1HD       PHE 154   7.065   0.286   3.999
  388    HD2  PHE 154          2HD       PHE 154   3.330   2.380   4.474
  389    HE1  PHE 154          1HE       PHE 154   7.619   0.729   6.357
  390    HE2  PHE 154          2HE       PHE 154   3.915   2.883   6.828
  391    HZ   PHE 154           HZ       PHE 154   6.070   2.065   7.781
  392    H    VAL 155           H        VAL 155   1.817   0.591   1.781
  393    HA   VAL 155           HA       VAL 155   2.128   0.018  -1.121
  394    HB   VAL 155           HB       VAL 155  -0.416  -0.632   0.394
  395   HG11  VAL 155          1HG1      VAL 155   0.384  -1.099  -2.499
  396   HG12  VAL 155          2HG1      VAL 155  -1.115  -1.675  -1.737
  397   HG13  VAL 155          3HG1      VAL 155  -0.843   0.056  -1.923
  398   HG21  VAL 155          1HG2      VAL 155   1.608  -2.561  -0.797
  399   HG22  VAL 155          2HG2      VAL 155   1.275  -2.336   0.934
  400   HG23  VAL 155          3HG2      VAL 155   0.019  -2.982  -0.114
  401    H    THR 156           H        THR 156   1.457   1.630  -2.416
  402    HA   THR 156           HA       THR 156   0.028   3.927  -1.188
  403    HB   THR 156           HB       THR 156   1.908   4.350  -3.475
  404    HG1  THR 156          1HG       THR 156   3.161   3.473  -1.878
  405   HG21  THR 156          1HG2      THR 156   0.367   6.190  -2.969
  406   HG22  THR 156          2HG2      THR 156   2.012   6.627  -2.492
  407   HG23  THR 156          3HG2      THR 156   0.836   6.144  -1.251
  408    H    PHE 157           H        PHE 157  -1.716   4.824  -2.135
  409    HA   PHE 157           HA       PHE 157  -2.844   3.317  -4.391
  410    HB2  PHE 157          1HB       PHE 157  -4.066   4.754  -2.051
  411    HB3  PHE 157          2HB       PHE 157  -5.007   4.222  -3.430
  412    HD1  PHE 157          1HD       PHE 157  -5.816   2.015  -3.578
  413    HD2  PHE 157          2HD       PHE 157  -2.651   2.911  -0.798
  414    HE1  PHE 157          1HE       PHE 157  -6.019  -0.260  -2.609
  415    HE2  PHE 157          2HE       PHE 157  -2.827   0.625   0.123
  416    HZ   PHE 157           HZ       PHE 157  -4.526  -0.954  -0.741
  417    H    GLU 158           H        GLU 158  -4.281   4.275  -5.910
  418    HA   GLU 158           HA       GLU 158  -3.341   6.837  -6.974
  419    HB2  GLU 158          1HB       GLU 158  -5.702   5.078  -7.712
  420    HB3  GLU 158          2HB       GLU 158  -5.271   6.544  -8.580
  421    HG2  GLU 158          1HG       GLU 158  -3.458   4.112  -8.275
  422    HG3  GLU 158          2HG       GLU 158  -4.490   4.465  -9.657
  423    H    SER 159           H        SER 159  -6.036   5.920  -4.853
  424    HA   SER 159           HA       SER 159  -6.627   8.809  -4.466
  425    HB2  SER 159          1HB       SER 159  -8.284   8.060  -6.056
  426    HB3  SER 159          2HB       SER 159  -8.704   6.676  -5.029
  427    HG   SER 159           HG       SER 159 -10.086   8.607  -4.863
  428    H    GLU 160           H        GLU 160  -7.344   9.417  -2.481
  429    HA   GLU 160           HA       GLU 160  -6.637   7.843  -0.164
  430    HB2  GLU 160          1HB       GLU 160  -8.401  10.313  -0.414
  431    HB3  GLU 160          2HB       GLU 160  -7.743   9.661   1.094
  432    HG2  GLU 160          1HG       GLU 160  -5.457  10.138   0.340
  433    HG3  GLU 160          2HG       GLU 160  -6.065  10.742  -1.207
  434    H    ASP 161           H        ASP 161  -9.616   8.229  -2.047
  435    HA   ASP 161           HA       ASP 161 -11.441   7.206  -0.083
  436    HB2  ASP 161          1HB       ASP 161 -11.600   7.394  -3.098
  437    HB3  ASP 161          2HB       ASP 161 -12.884   6.704  -2.115
  438    H    ILE 162           H        ILE 162  -9.304   5.509  -2.300
  439    HA   ILE 162           HA       ILE 162 -10.498   2.889  -1.776
  440    HB   ILE 162           HB       ILE 162  -7.639   3.388  -2.649
  441   HG12  ILE 162          1HG1      ILE 162  -8.872   4.578  -4.280
  442   HG13  ILE 162          2HG1      ILE 162  -8.366   3.038  -4.956
  443   HG21  ILE 162          1HG2      ILE 162  -8.056   1.111  -1.979
  444   HG22  ILE 162          2HG2      ILE 162  -9.557   1.028  -2.914
  445   HG23  ILE 162          3HG2      ILE 162  -7.990   1.132  -3.741
  446   HD11  ILE 162          1HD1      ILE 162 -11.177   3.788  -4.030
  447   HD12  ILE 162          2HD1      ILE 162 -10.627   3.501  -5.689
  448   HD13  ILE 162          3HD1      ILE 162 -10.711   2.151  -4.535
  449    H    VAL 163           H        VAL 163  -7.772   4.808  -0.414
  450    HA   VAL 163           HA       VAL 163  -6.799   2.797   1.314
  451    HB   VAL 163           HB       VAL 163  -6.809   5.830   1.721
  452   HG11  VAL 163          1HG1      VAL 163  -5.357   3.659   3.253
  453   HG12  VAL 163          2HG1      VAL 163  -4.872   5.368   3.275
  454   HG13  VAL 163          3HG1      VAL 163  -6.446   4.892   3.908
  455   HG21  VAL 163          1HG2      VAL 163  -4.420   5.507   1.023
  456   HG22  VAL 163          2HG2      VAL 163  -4.810   3.838   0.596
  457   HG23  VAL 163          3HG2      VAL 163  -5.610   5.187  -0.254
  458    H    GLU 164           H        GLU 164  -9.385   5.231   1.895
  459    HA   GLU 164           HA       GLU 164 -10.058   4.379   4.553
  460    HB2  GLU 164          1HB       GLU 164 -11.843   5.526   2.363
  461    HB3  GLU 164          2HB       GLU 164 -12.329   5.348   4.041
  462    HG2  GLU 164          1HG       GLU 164 -10.044   7.100   3.049
  463    HG3  GLU 164          2HG       GLU 164 -11.665   7.653   3.437
  464    H    LYS 165           H        LYS 165 -11.415   3.235   1.424
  465    HA   LYS 165           HA       LYS 165 -13.267   1.339   2.466
  466    HB2  LYS 165          1HB       LYS 165 -13.155   2.202   0.128
  467    HB3  LYS 165          2HB       LYS 165 -11.684   1.276  -0.146
  468    HG2  LYS 165          1HG       LYS 165 -12.921  -0.842   0.239
  469    HG3  LYS 165          2HG       LYS 165 -14.403   0.093   0.532
  470    HD2  LYS 165          1HD       LYS 165 -14.239   1.021  -1.794
  471    HD3  LYS 165          2HD       LYS 165 -12.758   0.092  -2.045
  472    HE2  LYS 165          1HE       LYS 165 -14.544  -1.092  -3.109
  473    HE3  LYS 165          2HE       LYS 165 -14.030  -2.025  -1.702
  474    HZ1  LYS 165          1HZ       LYS 165 -16.457  -1.881  -1.875
  475    HZ2  LYS 165          2HZ       LYS 165 -16.420  -0.254  -1.789
  476    HZ3  LYS 165          3HZ       LYS 165 -15.968  -1.156  -0.500
  477    H    VAL 166           H        VAL 166  -9.897   0.926   1.519
  478    HA   VAL 166           HA       VAL 166  -9.626  -1.875   2.145
  479    HB   VAL 166           HB       VAL 166  -7.550   0.341   1.924
  480   HG11  VAL 166          1HG1      VAL 166  -7.211  -2.676   1.845
  481   HG12  VAL 166          2HG1      VAL 166  -5.945  -1.493   1.465
  482   HG13  VAL 166          3HG1      VAL 166  -6.582  -1.598   3.113
  483   HG21  VAL 166          1HG2      VAL 166  -8.255  -1.790  -0.128
  484   HG22  VAL 166          2HG2      VAL 166  -8.958  -0.178  -0.178
  485   HG23  VAL 166          3HG2      VAL 166  -7.219  -0.360  -0.336
  486    H    CYS 167           H        CYS 167  -8.715   1.070   4.007
  487    HA   CYS 167           HA       CYS 167  -7.662  -0.325   6.240
  488    HB2  CYS 167          1HB       CYS 167  -8.722   2.500   5.903
  489    HB3  CYS 167          2HB       CYS 167  -8.083   1.909   7.441
  490    HG   CYS 167           HG       CYS 167  -6.666   2.214   4.506
  491    H    GLU 168           H        GLU 168 -11.048   0.674   5.673
  492    HA   GLU 168           HA       GLU 168 -12.019   0.042   8.294
  493    HB2  GLU 168          1HB       GLU 168 -13.308   0.195   5.556
  494    HB3  GLU 168          2HB       GLU 168 -14.248  -0.241   6.972
  495    HG2  GLU 168          1HG       GLU 168 -12.628   2.333   6.760
  496    HG3  GLU 168          2HG       GLU 168 -14.326   2.192   6.318
  497    H    ILE 169           H        ILE 169 -11.090  -2.136   5.725
  498    HA   ILE 169           HA       ILE 169 -12.590  -4.440   6.721
  499    HB   ILE 169           HB       ILE 169 -10.298  -4.135   4.762
  500   HG12  ILE 169          1HG1      ILE 169 -13.216  -4.905   4.254
  501   HG13  ILE 169          2HG1      ILE 169 -12.698  -3.229   4.250
  502   HG21  ILE 169          1HG2      ILE 169 -11.855  -6.659   5.444
  503   HG22  ILE 169          2HG2      ILE 169 -10.779  -6.476   4.043
  504   HG23  ILE 169          3HG2      ILE 169 -10.113  -6.373   5.657
  505   HD11  ILE 169          1HD1      ILE 169 -12.801  -4.028   1.987
  506   HD12  ILE 169          2HD1      ILE 169 -11.124  -3.657   2.414
  507   HD13  ILE 169          3HD1      ILE 169 -11.676  -5.349   2.341
  508    H    HIS 170           H        HIS 170  -9.457  -3.037   7.347
  509    HA   HIS 170           HA       HIS 170  -7.854  -3.309   8.880
  510    HB2  HIS 170          1HB       HIS 170  -9.719  -3.158  10.434
  511    HB3  HIS 170          2HB       HIS 170  -9.877  -4.909  10.448
  512    HD2  HIS 170          2HD       HIS 170  -6.277  -3.543  10.609
  513    HE1  HIS 170          1HE       HIS 170  -7.320  -4.728  14.567
  514    HE2  HIS 170          2HE       HIS 170  -5.404  -4.012  13.053
  515    H    PHE 171           H        PHE 171  -9.314  -6.586   8.748
  516    HA   PHE 171           HA       PHE 171  -6.613  -7.637   8.212
  517    HB2  PHE 171          1HB       PHE 171  -8.760  -8.931   9.774
  518    HB3  PHE 171          2HB       PHE 171  -7.599  -9.906   8.892
  519    HD1  PHE 171          1HD       PHE 171  -5.259 -10.009   9.470
  520    HD2  PHE 171          2HD       PHE 171  -7.946  -7.428  11.643
  521    HE1  PHE 171          1HE       PHE 171  -3.561  -9.753  11.265
  522    HE2  PHE 171          2HE       PHE 171  -6.237  -7.164  13.430
  523    HZ   PHE 171           HZ       PHE 171  -4.046  -8.328  13.244
  524    H    HIS 172           H        HIS 172  -5.993  -8.359   6.448
  525    HA   HIS 172           HA       HIS 172  -7.930  -8.940   4.236
  526    HB2  HIS 172          1HB       HIS 172  -5.220  -7.569   4.321
  527    HB3  HIS 172          2HB       HIS 172  -5.973  -8.124   2.837
  528    HD2  HIS 172          2HD       HIS 172  -6.454  -5.470   5.622
  529    HE1  HIS 172          1HE       HIS 172  -8.989  -4.348   2.409
  530    HE2  HIS 172          2HE       HIS 172  -8.021  -3.607   4.621
  531    H    GLU 173           H        GLU 173  -7.236 -10.497   2.609
  532    HA   GLU 173           HA       GLU 173  -5.568 -12.671   3.828
  533    HB2  GLU 173          1HB       GLU 173  -7.947 -13.176   3.758
  534    HB3  GLU 173          2HB       GLU 173  -7.970 -12.907   2.006
  535    HG2  GLU 173          1HG       GLU 173  -6.300 -14.760   1.734
  536    HG3  GLU 173          2HG       GLU 173  -6.336 -15.021   3.477
  537    H    ILE 174           H        ILE 174  -3.606 -12.744   2.912
  538    HA   ILE 174           HA       ILE 174  -3.384 -12.530  -0.077
  539    HB   ILE 174           HB       ILE 174  -1.331 -11.511   1.915
  540   HG12  ILE 174          1HG1      ILE 174  -3.392 -10.039   0.228
  541   HG13  ILE 174          2HG1      ILE 174  -3.256 -10.039   1.984
  542   HG21  ILE 174          1HG2      ILE 174  -0.182 -10.674  -0.104
  543   HG22  ILE 174          2HG2      ILE 174  -0.394 -12.412  -0.220
  544   HG23  ILE 174          3HG2      ILE 174  -1.469 -11.335  -1.136
  545   HD11  ILE 174          1HD1      ILE 174  -2.436  -7.945   1.247
  546   HD12  ILE 174          2HD1      ILE 174  -1.008  -8.887   1.731
  547   HD13  ILE 174          3HD1      ILE 174  -1.411  -8.682   0.010
  548    H    ASN 175           H        ASN 175  -2.587 -14.309  -1.007
  549    HA   ASN 175           HA       ASN 175  -2.009 -16.484  -1.192
  550    HB2  ASN 175          1HB       ASN 175   0.280 -15.624   0.605
  551    HB3  ASN 175          2HB       ASN 175   0.236 -17.125  -0.306
  552   HD21  ASN 175          1HD2      ASN 175   1.852 -14.488  -0.406
  553   HD22  ASN 175          2HD2      ASN 175   1.992 -14.245  -2.150
  554    H    ASN 176           H        ASN 176  -4.051 -16.107   0.605
  555    HA   ASN 176           HA       ASN 176  -5.294 -16.919   2.252
  556    HB2  ASN 176          1HB       ASN 176  -5.014 -18.982   1.009
  557    HB3  ASN 176          2HB       ASN 176  -3.594 -19.404   1.966
  558   HD21  ASN 176          1HD2      ASN 176  -7.043 -18.387   2.644
  559   HD22  ASN 176          2HD2      ASN 176  -7.267 -19.689   3.808
  560    H    LYS 177           H        LYS 177  -2.373 -15.797   2.981
  561    HA   LYS 177           HA       LYS 177  -2.377 -16.361   5.878
  562    HB2  LYS 177          1HB       LYS 177  -0.323 -15.882   4.193
  563    HB3  LYS 177          2HB       LYS 177  -0.738 -14.213   4.496
  564    HG2  LYS 177          1HG       LYS 177   1.033 -14.871   5.975
  565    HG3  LYS 177          2HG       LYS 177  -0.408 -14.550   6.933
  566    HD2  LYS 177          1HD       LYS 177   0.910 -16.533   7.672
  567    HD3  LYS 177          2HD       LYS 177  -0.771 -16.919   7.320
  568    HE2  LYS 177          1HE       LYS 177  -0.168 -17.883   5.153
  569    HE3  LYS 177          2HE       LYS 177   1.504 -17.343   5.331
  570    HZ1  LYS 177          1HZ       LYS 177   1.764 -18.848   7.196
  571    HZ2  LYS 177          2HZ       LYS 177   1.244 -19.695   5.899
  572    HZ3  LYS 177          3HZ       LYS 177   0.197 -19.341   7.099
  573    H    MET 178           H        MET 178  -3.031 -14.868   7.438
  574    HA   MET 178           HA       MET 178  -4.780 -12.642   6.577
  575    HB2  MET 178          1HB       MET 178  -4.171 -13.867   9.281
  576    HB3  MET 178          2HB       MET 178  -5.106 -12.387   9.096
  577    HG2  MET 178          1HG       MET 178  -6.044 -14.647   7.401
  578    HG3  MET 178          2HG       MET 178  -6.131 -14.923   9.135
  579    HE1  MET 178          1HE       MET 178  -7.350 -12.740   6.139
  580    HE2  MET 178          2HE       MET 178  -8.487 -11.609   6.907
  581    HE3  MET 178          3HE       MET 178  -6.745 -11.437   7.192
  582    H    VAL 179           H        VAL 179  -4.112 -10.614   6.444
  583    HA   VAL 179           HA       VAL 179  -1.718  -9.736   7.964
  584    HB   VAL 179           HB       VAL 179  -0.877  -8.422   6.189
  585   HG11  VAL 179          1HG1      VAL 179  -0.149 -10.103   4.647
  586   HG12  VAL 179          2HG1      VAL 179  -0.247 -10.798   6.274
  587   HG13  VAL 179          3HG1      VAL 179  -1.500 -11.175   5.061
  588   HG21  VAL 179          1HG2      VAL 179  -2.914  -7.696   5.049
  589   HG22  VAL 179          2HG2      VAL 179  -1.766  -8.406   3.918
  590   HG23  VAL 179          3HG2      VAL 179  -3.178  -9.349   4.440
  591    H    GLU 180           H        GLU 180  -1.555  -7.593   8.486
  592    HA   GLU 180           HA       GLU 180  -4.214  -6.333   9.030
  593    HB2  GLU 180          1HB       GLU 180  -2.772  -7.155  10.905
  594    HB3  GLU 180          2HB       GLU 180  -1.557  -5.957  10.448
  595    HG2  GLU 180          1HG       GLU 180  -3.108  -4.134  10.907
  596    HG3  GLU 180          2HG       GLU 180  -4.429  -5.283  11.149
  597    H    CYS 181           H        CYS 181  -4.727  -4.470   8.018
  598    HA   CYS 181           HA       CYS 181  -2.606  -2.766   6.802
  599    HB2  CYS 181          1HB       CYS 181  -4.388  -1.558   5.704
  600    HB3  CYS 181          2HB       CYS 181  -4.478  -3.278   5.330
  601    HG   CYS 181           HG       CYS 181  -6.343  -3.883   7.036
  602    H    LYS 182           H        LYS 182  -2.255  -0.661   7.364
  603    HA   LYS 182           HA       LYS 182  -3.896   0.693   9.429
  604    HB2  LYS 182          1HB       LYS 182  -0.925   0.957   9.732
  605    HB3  LYS 182          2HB       LYS 182  -2.180   1.191  10.923
  606    HG2  LYS 182          1HG       LYS 182  -2.334  -1.260  11.266
  607    HG3  LYS 182          2HG       LYS 182  -1.150  -1.524   9.967
  608    HD2  LYS 182          1HD       LYS 182   0.472  -0.066  11.242
  609    HD3  LYS 182          2HD       LYS 182  -0.670  -0.070  12.597
  610    HE2  LYS 182          1HE       LYS 182  -0.428  -2.552  12.751
  611    HE3  LYS 182          2HE       LYS 182   0.659  -2.520  11.355
  612    HZ1  LYS 182          1HZ       LYS 182   1.174  -1.345  14.025
  613    HZ2  LYS 182          2HZ       LYS 182   2.051  -0.918  12.722
  614    HZ3  LYS 182          3HZ       LYS 182   2.102  -2.450  13.249
  615    H    LYS 183           H        LYS 183  -3.708   3.062   9.195
  616    HA   LYS 183           HA       LYS 183  -2.711   4.046   6.627
  617    HB2  LYS 183          1HB       LYS 183  -3.628   5.475   9.148
  618    HB3  LYS 183          2HB       LYS 183  -2.984   6.322   7.736
  619    HG2  LYS 183          1HG       LYS 183  -4.730   5.302   6.298
  620    HG3  LYS 183          2HG       LYS 183  -5.438   4.511   7.724
  621    HD2  LYS 183          1HD       LYS 183  -5.880   6.693   8.760
  622    HD3  LYS 183          2HD       LYS 183  -5.048   7.524   7.429
  623    HE2  LYS 183          1HE       LYS 183  -6.726   6.620   5.828
  624    HE3  LYS 183          2HE       LYS 183  -7.586   5.850   7.169
  625    HZ1  LYS 183          1HZ       LYS 183  -7.141   8.774   6.885
  626    HZ2  LYS 183          2HZ       LYS 183  -7.976   8.059   8.107
  627    HZ3  LYS 183          3HZ       LYS 183  -8.547   8.011   6.572
  628    H    ALA 184           H        ALA 184  -0.755   4.942   6.074
  629    HA   ALA 184           HA       ALA 184   1.463   4.234   7.801
  630    HB1  ALA 184          1HB       ALA 184   2.864   5.040   5.968
  631    HB2  ALA 184          2HB       ALA 184   1.582   3.966   5.374
  632    HB3  ALA 184          3HB       ALA 184   1.438   5.731   5.167
  633    H    GLN 185           H        GLN 185   2.688   5.463   9.102
  634    HA   GLN 185           HA       GLN 185   2.577   8.424   8.926
  635    HB2  GLN 185          1HB       GLN 185   2.421   6.780  11.473
  636    HB3  GLN 185          2HB       GLN 185   2.715   8.523  11.421
  637    HG2  GLN 185          1HG       GLN 185   0.507   8.738  10.152
  638    HG3  GLN 185          2HG       GLN 185   0.204   7.041  10.555
  639   HE21  GLN 185          1HE2      GLN 185   0.663   6.620  13.120
  640   HE22  GLN 185          2HE2      GLN 185  -0.034   7.854  14.156
  641    HA   PRO 186           HA       PRO 186   6.854   8.327   8.527
  642    HB2  PRO 186          1HB       PRO 186   7.177  10.538  10.548
  643    HB3  PRO 186          2HB       PRO 186   7.749  10.458   8.849
  644    HG2  PRO 186          1HG       PRO 186   5.578  11.935   9.499
  645    HG3  PRO 186          2HG       PRO 186   5.579  10.932   8.008
  646    HD2  PRO 186          1HD       PRO 186   4.362  10.296  10.706
  647    HD3  PRO 186          2HD       PRO 186   3.657  10.130   9.073
  648    H    LYS 187           H        LYS 187   8.902   7.615   9.367
  649    HA   LYS 187           HA       LYS 187   8.771   5.945  11.706
  650    HB2  LYS 187          1HB       LYS 187  11.072   5.385  11.242
  651    HB3  LYS 187          2HB       LYS 187  10.182   5.452   9.726
  652    HG2  LYS 187          1HG       LYS 187  11.094   7.784   9.362
  653    HG3  LYS 187          2HG       LYS 187  12.095   7.559  10.813
  654    HD2  LYS 187          1HD       LYS 187  13.047   5.478   9.687
  655    HD3  LYS 187          2HD       LYS 187  12.197   5.960   8.216
  656    HE2  LYS 187          1HE       LYS 187  14.369   7.520   9.693
  657    HE3  LYS 187          2HE       LYS 187  14.547   6.657   8.163
  658    HZ1  LYS 187          1HZ       LYS 187  12.927   9.111   8.637
  659    HZ2  LYS 187          2HZ       LYS 187  12.877   8.251   7.230
  660    HZ3  LYS 187          3HZ       LYS 187  14.257   8.977   7.714
  661    H    GLU 188           H        GLU 188   9.610   9.192  11.356
  662    HA   GLU 188           HA       GLU 188  11.048   9.643  13.817
  663    HB2  GLU 188          1HB       GLU 188   9.386  11.546  12.099
  664    HB3  GLU 188          2HB       GLU 188  10.444  12.010  13.423
  665    HG2  GLU 188          1HG       GLU 188  11.734  12.406  11.530
  666    HG3  GLU 188          2HG       GLU 188  12.379  10.919  12.209
  667    H    VAL 189           H        VAL 189   7.637   9.193  13.159
  668    HA   VAL 189           HA       VAL 189   7.037   9.740  16.021
  669    HB   VAL 189           HB       VAL 189   4.896  10.319  15.654
  670   HG11  VAL 189          1HG1      VAL 189   6.207  11.441  13.142
  671   HG12  VAL 189          2HG1      VAL 189   4.866  12.139  14.070
  672   HG13  VAL 189          3HG1      VAL 189   6.481  12.053  14.792
  673   HG21  VAL 189          1HG2      VAL 189   4.977   9.248  12.814
  674   HG22  VAL 189          2HG2      VAL 189   4.090   8.547  14.189
  675   HG23  VAL 189          3HG2      VAL 189   3.624  10.122  13.551
  676    H    MET 190           H        MET 190   6.720   7.350  13.467
  677    HA   MET 190           HA       MET 190   5.760   5.281  15.351
  678    HB2  MET 190          1HB       MET 190   6.342   5.121  12.370
  679    HB3  MET 190          2HB       MET 190   5.597   3.869  13.366
  680    HG2  MET 190          1HG       MET 190   4.480   6.574  12.614
  681    HG3  MET 190          2HG       MET 190   3.882   4.997  12.123
  682    HE1  MET 190          1HE       MET 190   2.193   3.684  15.453
  683    HE2  MET 190          2HE       MET 190   2.389   3.385  13.718
  684    HE3  MET 190          3HE       MET 190   3.800   3.311  14.800
  685    H    SER 191           H        SER 191   7.767   5.605  16.639
  686    HA   SER 191           HA       SER 191  10.153   4.215  15.625
  687    HB2  SER 191          1HB       SER 191  11.051   4.578  17.894
  688    HB3  SER 191          2HB       SER 191  10.555   6.072  17.083
  689    HG   SER 191           HG       SER 191   9.853   5.987  19.272
  690    HA   PRO 192           HA       PRO 192   8.660   0.230  16.759
  691    HB2  PRO 192          1HB       PRO 192  10.965  -1.220  17.148
  692    HB3  PRO 192          2HB       PRO 192  10.399  -0.654  15.551
  693    HG2  PRO 192          1HG       PRO 192  12.431   0.667  17.379
  694    HG3  PRO 192          2HG       PRO 192  12.584   0.321  15.626
  695    HD2  PRO 192          1HD       PRO 192  11.840   2.770  16.523
  696    HD3  PRO 192          2HD       PRO 192  11.086   2.067  15.060
  697    H    THR 193           H        THR 193   8.179  -1.118  18.472
  698    HA   THR 193           HA       THR 193   8.659  -0.083  21.141
  699    HB   THR 193           HB       THR 193   6.958  -1.374  21.946
  700    HG1  THR 193          1HG       THR 193   6.149  -3.176  20.893
  701   HG21  THR 193          1HG2      THR 193   6.136   0.301  20.249
  702   HG22  THR 193          2HG2      THR 193   5.056  -1.080  20.498
  703   HG23  THR 193          3HG2      THR 193   6.073  -1.010  19.047
  704    H    GLY 194           H        GLY 194  10.576  -2.075  19.393
  705    HA2  GLY 194          1HA       GLY 194  12.503  -3.249  20.092
  706    HA3  GLY 194          2HA       GLY 194  11.936  -3.210  21.758
  707    H    SER 195           H        SER 195  12.355  -5.454  22.035
  708    HA   SER 195           HA       SER 195  11.249  -7.517  20.358
  709    HB2  SER 195          1HB       SER 195  11.854  -9.022  22.254
  710    HB3  SER 195          2HB       SER 195  13.176  -8.021  21.643
  711    HG   SER 195           HG       SER 195  11.618  -7.508  23.983
  712    H    ALA 196           H        ALA 196   9.322  -8.483  20.332
  713    HA   ALA 196           HA       ALA 196   7.442  -8.387  22.586
  714    HB1  ALA 196          1HB       ALA 196   5.667  -7.297  21.248
  715    HB2  ALA 196          2HB       ALA 196   7.058  -6.219  21.445
  716    HB3  ALA 196          3HB       ALA 196   6.808  -7.066  19.904
  717    H    ARG 197           H        ARG 197   5.603  -9.754  22.299
  718    HA   ARG 197           HA       ARG 197   6.191 -12.221  20.868
  719    HB2  ARG 197          1HB       ARG 197   5.282 -12.083  23.167
  720    HB3  ARG 197          2HB       ARG 197   3.781 -11.390  22.542
  721    HG2  ARG 197          1HG       ARG 197   3.257 -13.468  21.361
  722    HG3  ARG 197          2HG       ARG 197   4.848 -14.142  21.770
  723    HD2  ARG 197          1HD       ARG 197   4.244 -14.023  24.195
  724    HD3  ARG 197          2HD       ARG 197   2.669 -13.370  23.755
  725    HE   ARG 197           HE       ARG 197   1.953 -15.459  22.996
  726   HH11  ARG 197          1HH1      ARG 197   5.325 -15.753  23.924
  727   HH12  ARG 197          2HH1      ARG 197   5.251 -17.494  23.960
  728   HH21  ARG 197          1HH2      ARG 197   1.945 -17.673  23.037
  729   HH22  ARG 197          2HH2      ARG 197   3.387 -18.543  23.468
  730    H    GLY 198           H        GLY 198   4.219  -9.478  20.094
  731    HA2  GLY 198          1HA       GLY 198   3.490  -9.294  17.682
  732    HA3  GLY 198          2HA       GLY 198   2.859 -10.930  17.844
  733    H    ARG 199           H        ARG 199   0.696 -10.414  17.463
  734    HA   ARG 199           HA       ARG 199  -0.804  -8.449  19.046
  735    HB2  ARG 199          1HB       ARG 199  -1.781 -10.815  17.398
  736    HB3  ARG 199          2HB       ARG 199  -2.801  -9.568  18.094
  737    HG2  ARG 199          1HG       ARG 199  -0.769  -9.179  15.853
  738    HG3  ARG 199          2HG       ARG 199  -2.519  -9.236  15.719
  739    HD2  ARG 199          1HD       ARG 199  -2.157  -6.968  15.632
  740    HD3  ARG 199          2HD       ARG 199  -2.524  -7.184  17.335
  741    HE   ARG 199           HE       ARG 199  -0.202  -6.889  17.878
  742   HH11  ARG 199          1HH1      ARG 199  -0.812  -6.090  14.464
  743   HH12  ARG 199          2HH1      ARG 199   0.849  -5.549  14.291
  744   HH21  ARG 199          1HH2      ARG 199   1.845  -6.117  17.474
  745   HH22  ARG 199          2HH2      ARG 199   2.242  -5.584  15.853
  746    H    SER 200           H        SER 200  -2.257  -8.807  20.679
  747    HA   SER 200           HA       SER 200  -1.443 -10.527  22.790
  748    HB2  SER 200          1HB       SER 200  -4.040  -8.990  22.402
  749    HB3  SER 200          2HB       SER 200  -3.502  -9.737  23.920
  750    HG   SER 200           HG       SER 200  -2.878  -7.513  23.807
  751    H5'    G 201           H5'        G 201   3.942 -13.009  14.943
  752   H5''    G 201           H5"        G 201   3.463 -13.954  13.526
  753    H4'    G 201           H4'        G 201   6.285 -13.003  14.171
  754    H3'    G 201           H3'        G 201   4.273 -11.379  13.198
  755    H2'    G 201           H2'        G 201   3.724 -12.766  11.344
  756   HO2'    G 201           HO2        G 201   5.623 -10.792  10.646
  757    H1'    G 201           H1'        G 201   6.682 -13.100  10.823
  758    H8     G 201          8H          G 201   6.824 -14.443   8.666
  759    H1     G 201          1H          G 201   1.638 -17.991  10.128
  760    H21    G 201          1H2         G 201   0.690 -17.155  11.991
  761    H22    G 201          2H2         G 201   1.419 -15.768  12.782
  762   HO5'    G 201           HO5        G 201   3.827 -15.289  15.395
  763    H5'    U 202           H5'        U 202   6.584  -8.585  11.399
  764   H5''    U 202           H5"        U 202   7.455  -7.583  12.567
  765    H4'    U 202           H4'        U 202   6.181  -6.147  11.149
  766    H3'    U 202           H3'        U 202   5.949  -5.981  13.895
  767    H2'    U 202           H2'        U 202   3.909  -7.231  13.958
  768   HO2'    U 202           HO2        U 202   3.314  -4.466  13.916
  769    H1'    U 202           H1'        U 202   3.056  -5.637  11.536
  770    H3     U 202          3H          U 202  -1.103  -7.260  12.296
  771    H5     U 202          5H          U 202   1.299 -10.658  12.780
  772    H6     U 202          6H          U 202   3.279  -9.251  12.409
  773    H5'    A 203           H5'        A 203   7.141  -2.764  11.213
  774   H5''    A 203           H5"        A 203   7.907  -2.751  12.798
  775    H4'    A 203           H4'        A 203   8.757  -1.065  11.139
  776    H3'    A 203           H3'        A 203   8.823  -0.755  13.804
  777    H2'    A 203           H2'        A 203   6.519  -0.143  13.986
  778   HO2'    A 203           HO2        A 203   8.012   2.277  14.001
  779    H1'    A 203           H1'        A 203   6.976   1.973  11.873
  780    H8     A 203          8H          A 203   4.367  -0.187  13.667
  781    H61    A 203          1H6         A 203   0.410   3.418  10.356
  782    H62    A 203          2H6         A 203   0.452   2.288  11.716
  783    H2     A 203          2H          A 203   4.360   4.065   8.840
  784    H5'    G 204           H5'        G 204  10.443   2.006   9.894
  785   H5''    G 204           H5"        G 204   9.146   0.814   9.690
  786    H4'    G 204           H4'        G 204  10.867  -0.516   8.281
  787    H3'    G 204           H3'        G 204  12.703   1.350   9.046
  788    H2'    G 204           H2'        G 204  11.410   3.184   8.133
  789   HO2'    G 204           HO2        G 204  13.695   2.654   6.906
  790    H1'    G 204           H1'        G 204  11.127   1.501   5.647
  791    H8     G 204          8H          G 204   9.983   2.990   3.896
  792    H1     G 204          1H          G 204   6.116   5.661   8.304
  793    H21    G 204          1H2         G 204   6.591   4.752  10.264
  794    H22    G 204          2H2         G 204   7.995   3.717  10.443
  795    H5'    U 205           H5'        U 205  13.727  -2.105   5.935
  796   H5''    U 205           H5"        U 205  15.443  -2.365   6.279
  797    H4'    U 205           H4'        U 205  14.994  -3.253   4.108
  798    H3'    U 205           H3'        U 205  16.971  -1.338   4.420
  799   HO3'    U 205           HO3        U 205  17.006  -2.068   1.885
  800    H2'    U 205           H2'        U 205  15.747   0.473   3.574
  801   HO2'    U 205           HO2        U 205  17.463   0.354   2.069
  802    H1'    U 205           H1'        U 205  14.475  -1.293   1.482
  803    H3     U 205          3H          U 205  12.067   2.204  -0.075
  804    H5     U 205          5H          U 205  12.401   3.089   3.998
  805    H6     U 205          6H          U 205  13.541   0.961   4.333
  Start of MODEL    7
    1    H1   GLY 105          1H        GLY 105   0.958  16.317   1.031
    2    H2   GLY 105          2H        GLY 105   0.640  16.286   2.637
    3    H3   GLY 105          3H        GLY 105  -0.003  15.144   1.652
    4    HA2  GLY 105          1HA       GLY 105   2.184  14.260   1.144
    5    HA3  GLY 105          2HA       GLY 105   2.870  15.478   2.236
    6    H    SER 106           H        SER 106   3.583  14.399   3.983
    7    HA   SER 106           HA       SER 106   3.708  13.049   5.795
    8    HB2  SER 106          1HB       SER 106   0.835  13.984   6.047
    9    HB3  SER 106          2HB       SER 106   1.813  13.300   7.361
   10    HG   SER 106           HG       SER 106   1.898  15.588   7.348
   11    H    HIS 107           H        HIS 107   3.134  11.470   3.478
   12    HA   HIS 107           HA       HIS 107   2.495   9.427   2.767
   13    HB2  HIS 107          1HB       HIS 107   2.974   8.749   5.686
   14    HB3  HIS 107          2HB       HIS 107   2.803   7.563   4.405
   15    HD2  HIS 107          2HD       HIS 107   4.587   8.219   2.145
   16    HE1  HIS 107          1HE       HIS 107   7.672   9.570   4.754
   17    HE2  HIS 107          2HE       HIS 107   7.134   8.844   2.377
   18    H    MET 108           H        MET 108   0.209  11.179   3.605
   19    HA   MET 108           HA       MET 108  -1.789   9.626   4.848
   20    HB2  MET 108          1HB       MET 108  -1.998  12.007   2.971
   21    HB3  MET 108          2HB       MET 108  -3.371  11.340   3.862
   22    HG2  MET 108          1HG       MET 108  -0.830  12.382   5.170
   23    HG3  MET 108          2HG       MET 108  -2.315  13.305   4.968
   24    HE1  MET 108          1HE       MET 108  -0.721  12.821   7.749
   25    HE2  MET 108          2HE       MET 108  -2.145  13.871   7.551
   26    HE3  MET 108          3HE       MET 108  -2.114  12.645   8.838
   27    H    LYS 109           H        LYS 109  -0.909   9.565   1.437
   28    HA   LYS 109           HA       LYS 109  -3.260   7.928   0.731
   29    HB2  LYS 109          1HB       LYS 109  -0.944   8.960  -0.927
   30    HB3  LYS 109          2HB       LYS 109  -2.123   7.800  -1.535
   31    HG2  LYS 109          1HG       LYS 109  -3.962   9.444  -0.841
   32    HG3  LYS 109          2HG       LYS 109  -2.666  10.646  -0.660
   33    HD2  LYS 109          1HD       LYS 109  -1.974  10.174  -3.031
   34    HD3  LYS 109          2HD       LYS 109  -3.316   9.020  -3.163
   35    HE2  LYS 109          1HE       LYS 109  -4.937  10.837  -2.720
   36    HE3  LYS 109          2HE       LYS 109  -3.610  11.998  -2.594
   37    HZ1  LYS 109          1HZ       LYS 109  -4.251  10.416  -5.042
   38    HZ2  LYS 109          2HZ       LYS 109  -3.048  11.518  -4.913
   39    HZ3  LYS 109          3HZ       LYS 109  -4.603  12.001  -4.823
   40    H    LYS 110           H        LYS 110  -0.851   6.997   2.579
   41    HA   LYS 110           HA       LYS 110  -0.387   4.382   1.197
   42    HB2  LYS 110          1HB       LYS 110   1.537   6.010   1.399
   43    HB3  LYS 110          2HB       LYS 110   1.453   5.802   3.146
   44    HG2  LYS 110          1HG       LYS 110   1.990   3.397   2.894
   45    HG3  LYS 110          2HG       LYS 110   1.927   3.564   1.137
   46    HD2  LYS 110          1HD       LYS 110   4.240   3.587   1.714
   47    HD3  LYS 110          2HD       LYS 110   3.817   5.234   1.265
   48    HE2  LYS 110          1HE       LYS 110   3.644   5.875   3.634
   49    HE3  LYS 110          2HE       LYS 110   3.913   4.210   4.145
   50    HZ1  LYS 110          1HZ       LYS 110   5.905   5.566   4.297
   51    HZ2  LYS 110          2HZ       LYS 110   5.918   5.844   2.678
   52    HZ3  LYS 110          3HZ       LYS 110   6.155   4.328   3.279
   53    H    ILE 111           H        ILE 111  -0.566   2.497   2.272
   54    HA   ILE 111           HA       ILE 111  -1.437   2.563   5.138
   55    HB   ILE 111           HB       ILE 111  -2.628   0.546   4.901
   56   HG12  ILE 111          1HG1      ILE 111  -1.574   0.337   2.083
   57   HG13  ILE 111          2HG1      ILE 111  -1.259  -0.747   3.431
   58   HG21  ILE 111          1HG2      ILE 111  -3.744   2.657   4.255
   59   HG22  ILE 111          2HG2      ILE 111  -3.447   2.262   2.540
   60   HG23  ILE 111          3HG2      ILE 111  -4.481   1.222   3.548
   61   HD11  ILE 111          1HD1      ILE 111  -3.639  -1.439   3.458
   62   HD12  ILE 111          2HD1      ILE 111  -3.929  -0.428   2.021
   63   HD13  ILE 111          3HD1      ILE 111  -2.816  -1.802   1.928
   64    H    PHE 112           H        PHE 112  -0.641   1.101   6.490
   65    HA   PHE 112           HA       PHE 112   1.975  -0.220   5.985
   66    HB2  PHE 112          1HB       PHE 112   1.538   1.177   8.045
   67    HB3  PHE 112          2HB       PHE 112   0.207   0.111   8.455
   68    HD1  PHE 112          1HD       PHE 112   3.845   0.471   8.263
   69    HD2  PHE 112          2HD       PHE 112   0.630  -2.163   9.372
   70    HE1  PHE 112          1HE       PHE 112   5.441  -0.909   9.514
   71    HE2  PHE 112          2HE       PHE 112   2.235  -3.573  10.645
   72    HZ   PHE 112           HZ       PHE 112   4.648  -2.951  10.730
   73    H    VAL 113           H        VAL 113   2.041  -2.452   5.901
   74    HA   VAL 113           HA       VAL 113  -0.438  -4.054   6.341
   75    HB   VAL 113           HB       VAL 113   1.604  -4.606   4.170
   76   HG11  VAL 113          1HG1      VAL 113  -0.036  -6.270   3.412
   77   HG12  VAL 113          2HG1      VAL 113   0.455  -6.614   5.070
   78   HG13  VAL 113          3HG1      VAL 113  -1.118  -5.846   4.761
   79   HG21  VAL 113          1HG2      VAL 113  -0.170  -4.003   2.561
   80   HG22  VAL 113          2HG2      VAL 113  -1.187  -3.422   3.900
   81   HG23  VAL 113          3HG2      VAL 113   0.351  -2.616   3.512
   82    H    GLY 114           H        GLY 114  -0.132  -5.411   8.006
   83    HA2  GLY 114          1HA       GLY 114   2.657  -6.377   8.626
   84    HA3  GLY 114          2HA       GLY 114   1.494  -5.889   9.846
   85    H    GLY 115           H        GLY 115   2.962  -8.455   9.316
   86    HA2  GLY 115          1HA       GLY 115   2.337 -10.592  10.124
   87    HA3  GLY 115          2HA       GLY 115   0.658 -10.305   9.680
   88    H    LEU 116           H        LEU 116   3.200  -9.623   7.355
   89    HA   LEU 116           HA       LEU 116   1.969 -11.356   5.362
   90    HB2  LEU 116          1HB       LEU 116   4.393  -9.528   5.447
   91    HB3  LEU 116          2HB       LEU 116   4.072 -10.532   4.042
   92    HG   LEU 116           HG       LEU 116   1.915  -8.670   5.099
   93   HD11  LEU 116          1HD1      LEU 116   4.132  -8.019   3.127
   94   HD12  LEU 116          2HD1      LEU 116   3.901  -7.276   4.724
   95   HD13  LEU 116          3HD1      LEU 116   2.709  -7.001   3.444
   96   HD21  LEU 116          1HD2      LEU 116   2.589  -9.715   2.307
   97   HD22  LEU 116          2HD2      LEU 116   1.155  -8.774   2.768
   98   HD23  LEU 116          3HD2      LEU 116   1.359 -10.434   3.356
   99    H    SER 117           H        SER 117   2.554 -13.338   4.680
  100    HA   SER 117           HA       SER 117   4.518 -14.928   6.054
  101    HB2  SER 117          1HB       SER 117   2.638 -16.016   4.967
  102    HB3  SER 117          2HB       SER 117   3.130 -15.360   3.394
  103    HG   SER 117           HG       SER 117   4.366 -17.370   4.956
  104    H    VAL 118           H        VAL 118   6.626 -15.437   5.552
  105    HA   VAL 118           HA       VAL 118   8.142 -13.787   3.780
  106    HB   VAL 118           HB       VAL 118   8.913 -15.002   5.869
  107   HG11  VAL 118          1HG1      VAL 118   9.963 -17.171   5.601
  108   HG12  VAL 118          2HG1      VAL 118   8.250 -17.304   5.173
  109   HG13  VAL 118          3HG1      VAL 118   9.488 -17.256   3.894
  110   HG21  VAL 118          1HG2      VAL 118  10.727 -15.100   3.433
  111   HG22  VAL 118          2HG2      VAL 118  10.383 -13.660   4.420
  112   HG23  VAL 118          3HG2      VAL 118  11.213 -15.047   5.138
  113    H    ASN 119           H        ASN 119   6.182 -16.485   3.017
  114    HA   ASN 119           HA       ASN 119   7.496 -17.191   0.493
  115    HB2  ASN 119          1HB       ASN 119   6.045 -18.763   1.753
  116    HB3  ASN 119          2HB       ASN 119   4.676 -17.664   1.566
  117   HD21  ASN 119          1HD2      ASN 119   6.886 -19.836  -0.199
  118   HD22  ASN 119          2HD2      ASN 119   5.814 -20.014  -1.581
  119    H    THR 120           H        THR 120   5.091 -14.828   1.571
  120    HA   THR 120           HA       THR 120   4.178 -13.994  -1.025
  121    HB   THR 120           HB       THR 120   4.077 -12.518   1.620
  122    HG1  THR 120          1HG       THR 120   2.180 -13.561   1.933
  123   HG21  THR 120          1HG2      THR 120   2.054 -11.458   0.750
  124   HG22  THR 120          2HG2      THR 120   2.303 -12.232  -0.822
  125   HG23  THR 120          3HG2      THR 120   3.467 -11.032  -0.223
  126    H    THR 121           H        THR 121   4.843 -12.490  -2.380
  127    HA   THR 121           HA       THR 121   7.141 -10.761  -1.604
  128    HB   THR 121           HB       THR 121   7.669 -12.505  -3.315
  129    HG1  THR 121          1HG       THR 121   8.954 -11.034  -4.373
  130   HG21  THR 121          1HG2      THR 121   7.144 -12.011  -5.644
  131   HG22  THR 121          2HG2      THR 121   6.162 -10.608  -5.183
  132   HG23  THR 121          3HG2      THR 121   5.636 -12.251  -4.754
  133    H    VAL 122           H        VAL 122   7.365  -8.731  -2.859
  134    HA   VAL 122           HA       VAL 122   5.253  -7.033  -2.122
  135    HB   VAL 122           HB       VAL 122   7.672  -6.456  -2.433
  136   HG11  VAL 122          1HG1      VAL 122   6.957  -5.993  -5.360
  137   HG12  VAL 122          2HG1      VAL 122   8.492  -5.649  -4.549
  138   HG13  VAL 122          3HG1      VAL 122   7.978  -7.327  -4.763
  139   HG21  VAL 122          1HG2      VAL 122   5.655  -4.590  -3.734
  140   HG22  VAL 122          2HG2      VAL 122   5.977  -4.742  -1.991
  141   HG23  VAL 122          3HG2      VAL 122   7.239  -4.145  -3.093
  142    H    GLU 123           H        GLU 123   5.827  -8.462  -5.314
  143    HA   GLU 123           HA       GLU 123   3.786  -6.975  -6.693
  144    HB2  GLU 123          1HB       GLU 123   4.995  -9.707  -7.301
  145    HB3  GLU 123          2HB       GLU 123   3.957  -8.769  -8.391
  146    HG2  GLU 123          1HG       GLU 123   5.626  -6.894  -8.300
  147    HG3  GLU 123          2HG       GLU 123   6.700  -7.933  -7.358
  148    H    ASP 124           H        ASP 124   3.634  -9.950  -4.727
  149    HA   ASP 124           HA       ASP 124   0.920 -10.696  -5.459
  150    HB2  ASP 124          1HB       ASP 124   2.295 -11.133  -2.783
  151    HB3  ASP 124          2HB       ASP 124   0.894 -11.981  -3.401
  152    H    VAL 125           H        VAL 125   2.370  -8.763  -2.781
  153    HA   VAL 125           HA       VAL 125  -0.087  -8.054  -1.540
  154    HB   VAL 125           HB       VAL 125   2.515  -6.479  -1.512
  155   HG11  VAL 125          1HG1      VAL 125   0.183  -6.536   0.455
  156   HG12  VAL 125          2HG1      VAL 125   1.720  -5.674   0.691
  157   HG13  VAL 125          3HG1      VAL 125   0.631  -5.177  -0.603
  158   HG21  VAL 125          1HG2      VAL 125   1.501  -8.773   0.213
  159   HG22  VAL 125          2HG2      VAL 125   2.977  -8.736  -0.773
  160   HG23  VAL 125          3HG2      VAL 125   2.857  -7.729   0.668
  161    H    LYS 126           H        LYS 126   1.742  -6.318  -4.078
  162    HA   LYS 126           HA       LYS 126  -0.106  -4.152  -4.405
  163    HB2  LYS 126          1HB       LYS 126   2.167  -4.133  -5.270
  164    HB3  LYS 126          2HB       LYS 126   1.812  -5.465  -6.377
  165    HG2  LYS 126          1HG       LYS 126   0.334  -4.093  -7.697
  166    HG3  LYS 126          2HG       LYS 126   0.350  -2.799  -6.484
  167    HD2  LYS 126          1HD       LYS 126   2.820  -2.531  -6.851
  168    HD3  LYS 126          2HD       LYS 126   2.734  -3.715  -8.158
  169    HE2  LYS 126          1HE       LYS 126   1.263  -1.035  -8.050
  170    HE3  LYS 126          2HE       LYS 126   2.759  -1.351  -8.934
  171    HZ1  LYS 126          1HZ       LYS 126   0.933  -1.523 -10.446
  172    HZ2  LYS 126          2HZ       LYS 126   0.092  -2.542  -9.497
  173    HZ3  LYS 126          3HZ       LYS 126   1.480  -3.046 -10.231
  174    H    HIS 127           H        HIS 127   0.007  -7.304  -6.175
  175    HA   HIS 127           HA       HIS 127  -2.337  -6.803  -7.746
  176    HB2  HIS 127          1HB       HIS 127  -1.037  -9.406  -6.861
  177    HB3  HIS 127          2HB       HIS 127  -2.356  -9.300  -8.019
  178    HD2  HIS 127          2HD       HIS 127  -0.463  -6.437  -9.100
  179    HE1  HIS 127          1HE       HIS 127   1.538  -9.653 -11.054
  180    HE2  HIS 127          2HE       HIS 127   1.229  -7.128 -10.992
  181    H    TYR 128           H        TYR 128  -2.063  -8.362  -4.511
  182    HA   TYR 128           HA       TYR 128  -4.852  -8.895  -4.307
  183    HB2  TYR 128          1HB       TYR 128  -2.591  -8.925  -2.382
  184    HB3  TYR 128          2HB       TYR 128  -4.213  -8.833  -1.760
  185    HD1  TYR 128          1HD       TYR 128  -5.833 -10.630  -2.019
  186    HD2  TYR 128          2HD       TYR 128  -1.819 -11.034  -3.535
  187    HE1  TYR 128          1HE       TYR 128  -6.109 -13.097  -2.100
  188    HE2  TYR 128          2HE       TYR 128  -2.084 -13.501  -3.593
  189    HH   TYR 128           HH       TYR 128  -5.137 -15.114  -2.657
  190    H    PHE 129           H        PHE 129  -3.061  -6.005  -3.093
  191    HA   PHE 129           HA       PHE 129  -5.542  -4.863  -2.178
  192    HB2  PHE 129          1HB       PHE 129  -2.784  -3.732  -2.354
  193    HB3  PHE 129          2HB       PHE 129  -4.169  -2.728  -1.966
  194    HD1  PHE 129          1HD       PHE 129  -5.773  -3.538  -0.048
  195    HD2  PHE 129          2HD       PHE 129  -1.739  -4.947  -0.577
  196    HE1  PHE 129          1HE       PHE 129  -5.715  -4.296   2.321
  197    HE2  PHE 129          2HE       PHE 129  -1.684  -5.681   1.790
  198    HZ   PHE 129           HZ       PHE 129  -3.673  -5.355   3.244
  199    H    GLU 130           H        GLU 130  -4.122  -4.744  -5.325
  200    HA   GLU 130           HA       GLU 130  -5.564  -2.546  -6.377
  201    HB2  GLU 130          1HB       GLU 130  -4.369  -5.046  -7.553
  202    HB3  GLU 130          2HB       GLU 130  -5.337  -3.976  -8.576
  203    HG2  GLU 130          1HG       GLU 130  -3.931  -2.079  -8.128
  204    HG3  GLU 130          2HG       GLU 130  -3.006  -2.966  -6.923
  205    H    GLN 131           H        GLN 131  -6.984  -5.519  -5.285
  206    HA   GLN 131           HA       GLN 131  -9.202  -5.616  -7.101
  207    HB2  GLN 131          1HB       GLN 131 -10.166  -7.157  -5.608
  208    HB3  GLN 131          2HB       GLN 131  -8.427  -7.427  -5.505
  209    HG2  GLN 131          1HG       GLN 131  -8.430  -6.023  -3.387
  210    HG3  GLN 131          2HG       GLN 131 -10.189  -5.957  -3.488
  211   HE21  GLN 131          1HE2      GLN 131  -7.419  -8.114  -2.998
  212   HE22  GLN 131          2HE2      GLN 131  -8.369  -9.466  -2.353
  213    H    PHE 132           H        PHE 132  -8.559  -3.566  -4.311
  214    HA   PHE 132           HA       PHE 132 -11.339  -2.679  -4.018
  215    HB2  PHE 132          1HB       PHE 132  -8.761  -1.745  -2.698
  216    HB3  PHE 132          2HB       PHE 132 -10.389  -1.275  -2.222
  217    HD1  PHE 132          1HD       PHE 132  -7.770  -3.642  -1.695
  218    HD2  PHE 132          2HD       PHE 132 -12.063  -3.277  -1.690
  219    HE1  PHE 132          1HE       PHE 132  -7.940  -5.711  -0.337
  220    HE2  PHE 132          2HE       PHE 132 -12.234  -5.370  -0.366
  221    HZ   PHE 132           HZ       PHE 132 -10.174  -6.584   0.320
  222    H    GLY 133           H        GLY 133  -8.446  -1.501  -5.568
  223    HA2  GLY 133          1HA       GLY 133  -9.494   0.272  -7.391
  224    HA3  GLY 133          2HA       GLY 133  -9.227   1.254  -5.948
  225    H    LYS 134           H        LYS 134  -7.761   2.033  -8.020
  226    HA   LYS 134           HA       LYS 134  -5.480   0.454  -8.616
  227    HB2  LYS 134          1HB       LYS 134  -6.446   2.033 -10.204
  228    HB3  LYS 134          2HB       LYS 134  -5.993   3.390  -9.171
  229    HG2  LYS 134          1HG       LYS 134  -4.448   3.187 -11.010
  230    HG3  LYS 134          2HG       LYS 134  -3.606   2.877  -9.497
  231    HD2  LYS 134          1HD       LYS 134  -3.513   0.485  -9.979
  232    HD3  LYS 134          2HD       LYS 134  -4.616   0.675 -11.344
  233    HE2  LYS 134          1HE       LYS 134  -2.278   0.383 -12.063
  234    HE3  LYS 134          2HE       LYS 134  -2.970   1.910 -12.615
  235    HZ1  LYS 134          1HZ       LYS 134  -1.246   1.718 -10.196
  236    HZ2  LYS 134          2HZ       LYS 134  -1.742   3.088 -10.947
  237    HZ3  LYS 134          3HZ       LYS 134  -0.679   2.103 -11.692
  238    H    VAL 135           H        VAL 135  -3.554   0.331  -7.965
  239    HA   VAL 135           HA       VAL 135  -2.602   1.747  -5.512
  240    HB   VAL 135           HB       VAL 135  -1.899  -0.900  -6.819
  241   HG11  VAL 135          1HG1      VAL 135  -0.363  -1.299  -4.910
  242   HG12  VAL 135          2HG1      VAL 135   0.216  -0.035  -5.999
  243   HG13  VAL 135          3HG1      VAL 135  -0.527   0.397  -4.445
  244   HG21  VAL 135          1HG2      VAL 135  -3.013  -0.194  -4.064
  245   HG22  VAL 135          2HG2      VAL 135  -3.967  -0.827  -5.417
  246   HG23  VAL 135          3HG2      VAL 135  -2.708  -1.833  -4.681
  247    H    ASP 136           H        ASP 136  -0.846   2.994  -5.593
  248    HA   ASP 136           HA       ASP 136   0.326   3.770  -8.174
  249    HB2  ASP 136          1HB       ASP 136  -0.260   5.552  -6.711
  250    HB3  ASP 136          2HB       ASP 136   0.549   4.798  -5.344
  251    H    ASP 137           H        ASP 137   1.475   2.305  -5.103
  252    HA   ASP 137           HA       ASP 137   3.643   0.870  -6.438
  253    HB2  ASP 137          1HB       ASP 137   4.447   3.320  -6.110
  254    HB3  ASP 137          2HB       ASP 137   4.344   3.022  -4.377
  255    H    ALA 138           H        ALA 138   4.877  -0.426  -4.816
  256    HA   ALA 138           HA       ALA 138   3.837  -0.613  -2.080
  257    HB1  ALA 138          1HB       ALA 138   3.825  -3.022  -3.952
  258    HB2  ALA 138          2HB       ALA 138   3.480  -3.057  -2.211
  259    HB3  ALA 138          3HB       ALA 138   2.386  -2.196  -3.313
  260    H    MET 139           H        MET 139   5.304  -1.625  -0.616
  261    HA   MET 139           HA       MET 139   7.845  -2.724  -1.585
  262    HB2  MET 139          1HB       MET 139   9.292  -1.160  -0.398
  263    HB3  MET 139          2HB       MET 139   8.427  -0.400  -1.729
  264    HG2  MET 139          1HG       MET 139   6.838   0.626  -0.132
  265    HG3  MET 139          2HG       MET 139   7.676  -0.163   1.207
  266    HE1  MET 139          1HE       MET 139   8.818   3.371   2.040
  267    HE2  MET 139          2HE       MET 139   7.206   2.737   1.622
  268    HE3  MET 139          3HE       MET 139   8.296   1.790   2.662
  269    H    LEU 140           H        LEU 140   8.677  -4.216  -0.215
  270    HA   LEU 140           HA       LEU 140   7.501  -4.461   2.523
  271    HB2  LEU 140          1HB       LEU 140   9.106  -6.538   1.009
  272    HB3  LEU 140          2HB       LEU 140   8.259  -6.737   2.543
  273    HG   LEU 140           HG       LEU 140   6.997  -6.321  -0.200
  274   HD11  LEU 140          1HD1      LEU 140   6.892  -8.639   1.766
  275   HD12  LEU 140          2HD1      LEU 140   7.860  -8.586   0.277
  276   HD13  LEU 140          3HD1      LEU 140   6.087  -8.565   0.184
  277   HD21  LEU 140          1HD2      LEU 140   5.573  -5.145   1.351
  278   HD22  LEU 140          2HD2      LEU 140   5.701  -6.456   2.545
  279   HD23  LEU 140          3HD2      LEU 140   4.825  -6.700   1.012
  280    H    MET 141           H        MET 141   8.802  -4.501   4.351
  281    HA   MET 141           HA       MET 141  11.417  -3.143   4.005
  282    HB2  MET 141          1HB       MET 141   9.822  -3.801   6.501
  283    HB3  MET 141          2HB       MET 141  11.353  -2.919   6.466
  284    HG2  MET 141          1HG       MET 141   8.729  -2.020   5.210
  285    HG3  MET 141          2HG       MET 141   9.494  -1.397   6.659
  286    HE1  MET 141          1HE       MET 141  10.156   0.068   2.449
  287    HE2  MET 141          2HE       MET 141  10.277  -1.682   2.645
  288    HE3  MET 141          3HE       MET 141   8.789  -0.841   3.141
  289    H    PHE 142           H        PHE 142  13.367  -3.964   4.551
  290    HA   PHE 142           HA       PHE 142  13.469  -6.887   4.903
  291    HB2  PHE 142          1HB       PHE 142  15.133  -5.102   3.220
  292    HB3  PHE 142          2HB       PHE 142  15.768  -6.635   3.781
  293    HD1  PHE 142          1HD       PHE 142  15.166  -8.688   2.762
  294    HD2  PHE 142          2HD       PHE 142  12.891  -5.134   1.912
  295    HE1  PHE 142          1HE       PHE 142  13.907  -9.916   1.009
  296    HE2  PHE 142          2HE       PHE 142  11.603  -6.370   0.180
  297    HZ   PHE 142           HZ       PHE 142  12.117  -8.762  -0.280
  298    H    ASP 143           H        ASP 143  14.977  -8.087   5.894
  299    HA   ASP 143           HA       ASP 143  16.356  -6.797   8.185
  300    HB2  ASP 143          1HB       ASP 143  15.054  -8.440   9.111
  301    HB3  ASP 143          2HB       ASP 143  15.267  -9.543   7.749
  302    H    LYS 144           H        LYS 144  18.463  -6.385   8.065
  303    HA   LYS 144           HA       LYS 144  20.060  -7.387   5.832
  304    HB2  LYS 144          1HB       LYS 144  20.915  -5.765   8.264
  305    HB3  LYS 144          2HB       LYS 144  21.850  -6.010   6.792
  306    HG2  LYS 144          1HG       LYS 144  19.250  -4.445   7.050
  307    HG3  LYS 144          2HG       LYS 144  20.871  -3.809   6.780
  308    HD2  LYS 144          1HD       LYS 144  20.924  -4.999   4.552
  309    HD3  LYS 144          2HD       LYS 144  19.267  -5.543   4.842
  310    HE2  LYS 144          1HE       LYS 144  19.133  -3.659   3.399
  311    HE3  LYS 144          2HE       LYS 144  18.502  -3.183   4.973
  312    HZ1  LYS 144          1HZ       LYS 144  20.001  -1.507   4.023
  313    HZ2  LYS 144          2HZ       LYS 144  21.239  -2.565   3.979
  314    HZ3  LYS 144          3HZ       LYS 144  20.632  -2.074   5.417
  315    H    THR 145           H        THR 145  19.421  -8.723   8.907
  316    HA   THR 145           HA       THR 145  21.897 -10.174   9.189
  317    HB   THR 145           HB       THR 145  19.439 -11.199  10.521
  318    HG1  THR 145          1HG       THR 145  19.115  -9.105  10.830
  319   HG21  THR 145          1HG2      THR 145  21.629 -12.246  10.966
  320   HG22  THR 145          2HG2      THR 145  20.991 -11.445  12.411
  321   HG23  THR 145          3HG2      THR 145  22.286 -10.671  11.470
  322    H    THR 146           H        THR 146  18.745 -11.101   7.912
  323    HA   THR 146           HA       THR 146  19.914 -13.613   6.803
  324    HB   THR 146           HB       THR 146  17.858 -14.702   7.135
  325    HG1  THR 146          1HG       THR 146  16.840 -12.238   8.091
  326   HG21  THR 146          1HG2      THR 146  18.254 -13.079   9.682
  327   HG22  THR 146          2HG2      THR 146  19.231 -14.488   9.211
  328   HG23  THR 146          3HG2      THR 146  17.494 -14.672   9.510
  329    H    ASN 147           H        ASN 147  18.776 -10.679   5.695
  330    HA   ASN 147           HA       ASN 147  18.117  -9.839   3.756
  331    HB2  ASN 147          1HB       ASN 147  19.236 -12.373   2.522
  332    HB3  ASN 147          2HB       ASN 147  18.817 -10.910   1.643
  333   HD21  ASN 147          1HD2      ASN 147  21.467 -12.451   2.595
  334   HD22  ASN 147          2HD2      ASN 147  22.487 -11.067   2.963
  335    H    ARG 148           H        ARG 148  16.279 -11.800   5.228
  336    HA   ARG 148           HA       ARG 148  14.117 -12.197   3.224
  337    HB2  ARG 148          1HB       ARG 148  14.409 -12.754   6.196
  338    HB3  ARG 148          2HB       ARG 148  12.897 -13.011   5.330
  339    HG2  ARG 148          1HG       ARG 148  13.698 -14.818   4.106
  340    HG3  ARG 148          2HG       ARG 148  15.382 -14.318   4.219
  341    HD2  ARG 148          1HD       ARG 148  14.930 -16.344   5.523
  342    HD3  ARG 148          2HD       ARG 148  15.574 -15.040   6.494
  343    HE   ARG 148           HE       ARG 148  12.813 -16.145   6.552
  344   HH11  ARG 148          1HH1      ARG 148  15.094 -13.912   8.064
  345   HH12  ARG 148          2HH1      ARG 148  14.140 -13.831   9.519
  346   HH21  ARG 148          1HH2      ARG 148  11.649 -15.917   8.419
  347   HH22  ARG 148          2HH2      ARG 148  12.254 -14.918   9.704
  348    H    HIS 149           H        HIS 149  11.973 -11.233   3.598
  349    HA   HIS 149           HA       HIS 149  12.145  -8.452   4.539
  350    HB2  HIS 149          1HB       HIS 149   9.985  -8.090   3.763
  351    HB3  HIS 149          2HB       HIS 149  10.827  -9.009   2.534
  352    HD2  HIS 149          2HD       HIS 149   9.386 -10.847   1.495
  353    HE1  HIS 149          1HE       HIS 149   6.404 -11.216   4.505
  354    HE2  HIS 149          2HE       HIS 149   7.091 -11.928   2.153
  355    H    ARG 150           H        ARG 150  10.824  -7.573   6.201
  356    HA   ARG 150           HA       ARG 150  11.093  -9.153   8.635
  357    HB2  ARG 150          1HB       ARG 150  10.176  -6.287   8.194
  358    HB3  ARG 150          2HB       ARG 150  10.538  -7.027   9.762
  359    HG2  ARG 150          1HG       ARG 150  12.852  -7.534   8.329
  360    HG3  ARG 150          2HG       ARG 150  12.377  -5.954   7.709
  361    HD2  ARG 150          1HD       ARG 150  12.676  -6.655  10.666
  362    HD3  ARG 150          2HD       ARG 150  13.947  -5.961   9.688
  363    HE   ARG 150           HE       ARG 150  11.695  -4.550  10.832
  364   HH11  ARG 150          1HH1      ARG 150  14.236  -4.228   8.328
  365   HH12  ARG 150          2HH1      ARG 150  14.244  -2.487   8.640
  366   HH21  ARG 150          1HH2      ARG 150  13.095  -1.543   9.909
  367   HH22  ARG 150          2HH2      ARG 150  11.931  -2.289  11.001
  368    H    GLY 151           H        GLY 151   8.654  -9.539   6.632
  369    HA2  GLY 151          1HA       GLY 151   6.526 -10.377   6.923
  370    HA3  GLY 151          2HA       GLY 151   6.707 -10.239   8.674
  371    H    PHE 152           H        PHE 152   7.303  -7.298   6.893
  372    HA   PHE 152           HA       PHE 152   4.514  -6.447   6.853
  373    HB2  PHE 152          1HB       PHE 152   4.684  -4.642   8.371
  374    HB3  PHE 152          2HB       PHE 152   5.313  -6.021   9.232
  375    HD1  PHE 152          1HD       PHE 152   7.779  -6.159   9.746
  376    HD2  PHE 152          2HD       PHE 152   6.045  -2.736   7.781
  377    HE1  PHE 152          1HE       PHE 152   9.838  -4.839  10.217
  378    HE2  PHE 152          2HE       PHE 152   8.069  -1.409   8.295
  379    HZ   PHE 152           HZ       PHE 152   9.979  -2.465   9.492
  380    H    GLY 153           H        GLY 153   4.320  -4.293   5.889
  381    HA2  GLY 153          1HA       GLY 153   6.497  -2.953   4.537
  382    HA3  GLY 153          2HA       GLY 153   5.597  -4.008   3.442
  383    H    PHE 154           H        PHE 154   5.231  -1.961   2.369
  384    HA   PHE 154           HA       PHE 154   2.831  -0.527   3.365
  385    HB2  PHE 154          1HB       PHE 154   5.323   0.656   2.109
  386    HB3  PHE 154          2HB       PHE 154   3.822   1.524   2.390
  387    HD1  PHE 154          1HD       PHE 154   3.071   2.135   4.652
  388    HD2  PHE 154          2HD       PHE 154   6.769   0.023   3.999
  389    HE1  PHE 154          1HE       PHE 154   3.800   2.694   6.955
  390    HE2  PHE 154          2HE       PHE 154   7.464   0.508   6.320
  391    HZ   PHE 154           HZ       PHE 154   5.986   1.866   7.807
  392    H    VAL 155           H        VAL 155   1.411   0.388   1.915
  393    HA   VAL 155           HA       VAL 155   1.848  -0.024  -0.992
  394    HB   VAL 155           HB       VAL 155  -0.811  -0.717   0.280
  395   HG11  VAL 155          1HG1      VAL 155  -0.998   0.114  -2.023
  396   HG12  VAL 155          2HG1      VAL 155   0.248  -1.044  -2.548
  397   HG13  VAL 155          3HG1      VAL 155  -1.329  -1.616  -1.959
  398   HG21  VAL 155          1HG2      VAL 155   0.777  -2.479   0.887
  399   HG22  VAL 155          2HG2      VAL 155  -0.354  -3.043  -0.339
  400   HG23  VAL 155          3HG2      VAL 155   1.305  -2.607  -0.805
  401    H    THR 156           H        THR 156   1.571   1.771  -2.076
  402    HA   THR 156           HA       THR 156   0.049   4.019  -0.902
  403    HB   THR 156           HB       THR 156   1.882   4.369  -3.235
  404    HG1  THR 156          1HG       THR 156   3.532   4.790  -1.827
  405   HG21  THR 156          1HG2      THR 156   0.451   6.283  -2.645
  406   HG22  THR 156          2HG2      THR 156   2.133   6.635  -2.238
  407   HG23  THR 156          3HG2      THR 156   0.988   6.191  -0.952
  408    H    PHE 157           H        PHE 157  -1.610   5.105  -1.936
  409    HA   PHE 157           HA       PHE 157  -2.789   3.639  -4.231
  410    HB2  PHE 157          1HB       PHE 157  -4.065   5.052  -1.902
  411    HB3  PHE 157          2HB       PHE 157  -4.947   4.474  -3.305
  412    HD1  PHE 157          1HD       PHE 157  -5.632   2.201  -3.497
  413    HD2  PHE 157          2HD       PHE 157  -2.732   3.302  -0.508
  414    HE1  PHE 157          1HE       PHE 157  -5.794  -0.064  -2.492
  415    HE2  PHE 157          2HE       PHE 157  -2.838   1.026   0.431
  416    HZ   PHE 157           HZ       PHE 157  -4.373  -0.671  -0.546
  417    H    GLU 158           H        GLU 158  -3.967   4.702  -5.840
  418    HA   GLU 158           HA       GLU 158  -2.877   7.358  -6.525
  419    HB2  GLU 158          1HB       GLU 158  -4.890   5.603  -7.977
  420    HB3  GLU 158          2HB       GLU 158  -4.304   7.185  -8.528
  421    HG2  GLU 158          1HG       GLU 158  -1.929   6.245  -8.307
  422    HG3  GLU 158          2HG       GLU 158  -2.663   4.654  -8.108
  423    H    SER 159           H        SER 159  -6.065   6.128  -5.460
  424    HA   SER 159           HA       SER 159  -6.875   8.958  -4.912
  425    HB2  SER 159          1HB       SER 159  -8.399   7.993  -6.473
  426    HB3  SER 159          2HB       SER 159  -8.615   6.552  -5.466
  427    HG   SER 159           HG       SER 159 -10.273   8.223  -5.252
  428    H    GLU 160           H        GLU 160  -7.320   9.569  -2.904
  429    HA   GLU 160           HA       GLU 160  -6.472   7.986  -0.651
  430    HB2  GLU 160          1HB       GLU 160  -6.338  10.481  -0.937
  431    HB3  GLU 160          2HB       GLU 160  -8.093  10.561  -0.714
  432    HG2  GLU 160          1HG       GLU 160  -7.839   9.583   1.551
  433    HG3  GLU 160          2HG       GLU 160  -6.092   9.436   1.290
  434    H    ASP 161           H        ASP 161  -9.577   8.345  -2.275
  435    HA   ASP 161           HA       ASP 161 -11.245   7.412  -0.126
  436    HB2  ASP 161          1HB       ASP 161 -11.615   7.413  -3.127
  437    HB3  ASP 161          2HB       ASP 161 -12.807   6.754  -2.017
  438    H    ILE 162           H        ILE 162  -9.198   5.632  -2.373
  439    HA   ILE 162           HA       ILE 162 -10.340   3.038  -1.719
  440    HB   ILE 162           HB       ILE 162  -7.513   3.515  -2.688
  441   HG12  ILE 162          1HG1      ILE 162  -8.791   4.685  -4.292
  442   HG13  ILE 162          2HG1      ILE 162  -8.326   3.135  -4.972
  443   HG21  ILE 162          1HG2      ILE 162  -9.439   1.151  -2.872
  444   HG22  ILE 162          2HG2      ILE 162  -7.879   1.239  -3.719
  445   HG23  ILE 162          3HG2      ILE 162  -7.922   1.249  -1.963
  446   HD11  ILE 162          1HD1      ILE 162 -11.095   3.925  -3.953
  447   HD12  ILE 162          2HD1      ILE 162 -10.604   3.632  -5.629
  448   HD13  ILE 162          3HD1      ILE 162 -10.666   2.284  -4.474
  449    H    VAL 163           H        VAL 163  -7.707   5.049  -0.372
  450    HA   VAL 163           HA       VAL 163  -6.593   3.108   1.359
  451    HB   VAL 163           HB       VAL 163  -6.893   6.103   1.908
  452   HG11  VAL 163          1HG1      VAL 163  -4.884   5.912   3.272
  453   HG12  VAL 163          2HG1      VAL 163  -6.149   4.862   3.920
  454   HG13  VAL 163          3HG1      VAL 163  -4.822   4.171   2.962
  455   HG21  VAL 163          1HG2      VAL 163  -5.797   5.722  -0.280
  456   HG22  VAL 163          2HG2      VAL 163  -4.670   6.347   0.920
  457   HG23  VAL 163          3HG2      VAL 163  -4.640   4.624   0.506
  458    H    GLU 164           H        GLU 164  -9.348   5.353   1.882
  459    HA   GLU 164           HA       GLU 164 -10.033   4.479   4.540
  460    HB2  GLU 164          1HB       GLU 164 -11.809   5.636   2.349
  461    HB3  GLU 164          2HB       GLU 164 -12.247   5.500   4.044
  462    HG2  GLU 164          1HG       GLU 164  -9.987   7.216   2.922
  463    HG3  GLU 164          2HG       GLU 164 -11.589   7.785   3.368
  464    H    LYS 165           H        LYS 165 -11.319   3.487   1.343
  465    HA   LYS 165           HA       LYS 165 -13.232   1.575   2.152
  466    HB2  LYS 165          1HB       LYS 165 -12.936   2.543  -0.106
  467    HB3  LYS 165          2HB       LYS 165 -11.428   1.662  -0.303
  468    HG2  LYS 165          1HG       LYS 165 -12.633  -0.493  -0.248
  469    HG3  LYS 165          2HG       LYS 165 -14.171   0.380  -0.042
  470    HD2  LYS 165          1HD       LYS 165 -13.776   1.563  -2.198
  471    HD3  LYS 165          2HD       LYS 165 -12.237   0.699  -2.391
  472    HE2  LYS 165          1HE       LYS 165 -13.469  -1.465  -2.418
  473    HE3  LYS 165          2HE       LYS 165 -14.999  -0.592  -2.254
  474    HZ1  LYS 165          1HZ       LYS 165 -14.500  -1.123  -4.587
  475    HZ2  LYS 165          2HZ       LYS 165 -13.098  -0.272  -4.526
  476    HZ3  LYS 165          3HZ       LYS 165 -14.539   0.496  -4.382
  477    H    VAL 166           H        VAL 166  -9.815   1.079   1.417
  478    HA   VAL 166           HA       VAL 166  -9.695  -1.752   1.992
  479    HB   VAL 166           HB       VAL 166  -7.525   0.379   1.952
  480   HG11  VAL 166          1HG1      VAL 166  -7.302  -2.646   1.882
  481   HG12  VAL 166          2HG1      VAL 166  -5.969  -1.523   1.546
  482   HG13  VAL 166          3HG1      VAL 166  -6.684  -1.575   3.161
  483   HG21  VAL 166          1HG2      VAL 166  -8.055  -1.670  -0.214
  484   HG22  VAL 166          2HG2      VAL 166  -8.834  -0.090  -0.255
  485   HG23  VAL 166          3HG2      VAL 166  -7.079  -0.184  -0.281
  486    H    CYS 167           H        CYS 167  -8.736   1.143   3.933
  487    HA   CYS 167           HA       CYS 167  -7.761  -0.358   6.132
  488    HB2  CYS 167          1HB       CYS 167  -7.200   2.002   5.586
  489    HB3  CYS 167          2HB       CYS 167  -8.824   2.501   6.097
  490    HG   CYS 167           HG       CYS 167  -8.627   1.706   8.569
  491    H    GLU 168           H        GLU 168 -11.101   0.832   5.512
  492    HA   GLU 168           HA       GLU 168 -12.247   0.324   8.017
  493    HB2  GLU 168          1HB       GLU 168 -13.223   1.644   6.236
  494    HB3  GLU 168          2HB       GLU 168 -13.318   0.232   5.163
  495    HG2  GLU 168          1HG       GLU 168 -14.930  -0.826   6.602
  496    HG3  GLU 168          2HG       GLU 168 -14.731   0.446   7.822
  497    H    ILE 169           H        ILE 169 -11.346  -1.980   5.489
  498    HA   ILE 169           HA       ILE 169 -12.934  -4.206   6.488
  499    HB   ILE 169           HB       ILE 169 -10.580  -4.018   4.589
  500   HG12  ILE 169          1HG1      ILE 169 -13.511  -4.652   3.974
  501   HG13  ILE 169          2HG1      ILE 169 -12.924  -2.996   4.008
  502   HG21  ILE 169          1HG2      ILE 169 -12.288  -6.458   5.219
  503   HG22  ILE 169          2HG2      ILE 169 -11.161  -6.332   3.851
  504   HG23  ILE 169          3HG2      ILE 169 -10.541  -6.263   5.486
  505   HD11  ILE 169          1HD1      ILE 169 -11.922  -5.148   2.127
  506   HD12  ILE 169          2HD1      ILE 169 -12.959  -3.768   1.734
  507   HD13  ILE 169          3HD1      ILE 169 -11.284  -3.488   2.239
  508    H    HIS 170           H        HIS 170  -9.751  -2.955   7.157
  509    HA   HIS 170           HA       HIS 170  -8.246  -3.219   8.776
  510    HB2  HIS 170          1HB       HIS 170 -10.265  -3.061  10.193
  511    HB3  HIS 170          2HB       HIS 170 -10.329  -4.816  10.278
  512    HD2  HIS 170          2HD       HIS 170  -6.878  -3.100  10.568
  513    HE1  HIS 170          1HE       HIS 170  -7.924  -4.450  14.469
  514    HE2  HIS 170          2HE       HIS 170  -6.050  -3.487  13.021
  515    H    PHE 171           H        PHE 171  -9.754  -6.420   8.353
  516    HA   PHE 171           HA       PHE 171  -7.037  -7.552   8.090
  517    HB2  PHE 171          1HB       PHE 171  -9.307  -8.758   9.562
  518    HB3  PHE 171          2HB       PHE 171  -8.137  -9.789   8.758
  519    HD1  PHE 171          1HD       PHE 171  -5.773  -9.836   9.379
  520    HD2  PHE 171          2HD       PHE 171  -8.607  -7.396  11.531
  521    HE1  PHE 171          1HE       PHE 171  -4.148  -9.588  11.240
  522    HE2  PHE 171          2HE       PHE 171  -6.982  -7.164  13.397
  523    HZ   PHE 171           HZ       PHE 171  -4.752  -8.263  13.255
  524    H    HIS 172           H        HIS 172  -6.342  -8.450   6.401
  525    HA   HIS 172           HA       HIS 172  -8.229  -9.083   4.157
  526    HB2  HIS 172          1HB       HIS 172  -5.543  -7.656   4.132
  527    HB3  HIS 172          2HB       HIS 172  -6.381  -8.219   2.693
  528    HD2  HIS 172          2HD       HIS 172  -6.861  -5.602   5.559
  529    HE1  HIS 172          1HE       HIS 172  -9.147  -4.291   2.238
  530    HE2  HIS 172          2HE       HIS 172  -8.296  -3.665   4.528
  531    H    GLU 173           H        GLU 173  -7.517 -10.686   2.647
  532    HA   GLU 173           HA       GLU 173  -5.622 -12.693   3.803
  533    HB2  GLU 173          1HB       GLU 173  -7.968 -13.395   3.561
  534    HB3  GLU 173          2HB       GLU 173  -7.895 -13.054   1.826
  535    HG2  GLU 173          1HG       GLU 173  -6.123 -14.772   1.562
  536    HG3  GLU 173          2HG       GLU 173  -6.161 -15.083   3.300
  537    H    ILE 174           H        ILE 174  -3.744 -13.068   2.778
  538    HA   ILE 174           HA       ILE 174  -3.422 -12.525  -0.138
  539    HB   ILE 174           HB       ILE 174  -1.491 -11.564   2.016
  540   HG12  ILE 174          1HG1      ILE 174  -3.370 -10.028   0.180
  541   HG13  ILE 174          2HG1      ILE 174  -3.393 -10.077   1.942
  542   HG21  ILE 174          1HG2      ILE 174  -0.356 -12.420  -0.050
  543   HG22  ILE 174          2HG2      ILE 174  -1.324 -11.294  -1.017
  544   HG23  ILE 174          3HG2      ILE 174  -0.146 -10.689   0.156
  545   HD11  ILE 174          1HD1      ILE 174  -1.344  -8.701   0.187
  546   HD12  ILE 174          2HD1      ILE 174  -2.491  -7.984   1.324
  547   HD13  ILE 174          3HD1      ILE 174  -1.133  -8.947   1.939
  548    H    ASN 175           H        ASN 175  -2.563 -14.314  -1.091
  549    HA   ASN 175           HA       ASN 175  -1.868 -16.452  -1.289
  550    HB2  ASN 175          1HB       ASN 175   0.352 -15.440   0.514
  551    HB3  ASN 175          2HB       ASN 175   0.410 -16.965  -0.356
  552   HD21  ASN 175          1HD2      ASN 175   2.144 -14.645  -0.554
  553   HD22  ASN 175          2HD2      ASN 175   2.194 -14.286  -2.284
  554    H    ASN 176           H        ASN 176  -3.907 -16.192   0.552
  555    HA   ASN 176           HA       ASN 176  -5.091 -17.095   2.179
  556    HB2  ASN 176          1HB       ASN 176  -3.303 -19.527   1.974
  557    HB3  ASN 176          2HB       ASN 176  -4.902 -19.454   2.711
  558   HD21  ASN 176          1HD2      ASN 176  -6.603 -18.260   1.016
  559   HD22  ASN 176          2HD2      ASN 176  -6.552 -19.080  -0.544
  560    H    LYS 177           H        LYS 177  -2.190 -15.910   2.971
  561    HA   LYS 177           HA       LYS 177  -2.343 -16.470   5.882
  562    HB2  LYS 177          1HB       LYS 177  -0.115 -16.254   4.814
  563    HB3  LYS 177          2HB       LYS 177  -0.544 -14.658   4.207
  564    HG2  LYS 177          1HG       LYS 177   0.887 -14.343   6.053
  565    HG3  LYS 177          2HG       LYS 177  -0.715 -13.838   6.564
  566    HD2  LYS 177          1HD       LYS 177  -0.979 -16.114   7.696
  567    HD3  LYS 177          2HD       LYS 177   0.665 -16.497   7.178
  568    HE2  LYS 177          1HE       LYS 177   0.792 -15.779   9.446
  569    HE3  LYS 177          2HE       LYS 177   1.493 -14.496   8.441
  570    HZ1  LYS 177          1HZ       LYS 177  -1.293 -14.486   9.473
  571    HZ2  LYS 177          2HZ       LYS 177  -0.557 -13.240   8.693
  572    HZ3  LYS 177          3HZ       LYS 177  -0.081 -13.692  10.202
  573    H    MET 178           H        MET 178  -3.113 -14.927   7.387
  574    HA   MET 178           HA       MET 178  -4.781 -12.738   6.277
  575    HB2  MET 178          1HB       MET 178  -4.517 -13.796   9.107
  576    HB3  MET 178          2HB       MET 178  -5.514 -12.425   8.636
  577    HG2  MET 178          1HG       MET 178  -5.839 -15.301   7.720
  578    HG3  MET 178          2HG       MET 178  -6.889 -14.418   8.819
  579    HE1  MET 178          1HE       MET 178  -8.500 -12.420   8.071
  580    HE2  MET 178          2HE       MET 178  -7.187 -11.535   7.255
  581    HE3  MET 178          3HE       MET 178  -8.695 -11.878   6.389
  582    H    VAL 179           H        VAL 179  -4.319 -10.646   6.439
  583    HA   VAL 179           HA       VAL 179  -1.996  -9.767   8.065
  584    HB   VAL 179           HB       VAL 179  -1.216  -8.275   6.361
  585   HG11  VAL 179          1HG1      VAL 179  -1.530 -11.045   5.150
  586   HG12  VAL 179          2HG1      VAL 179  -0.276  -9.838   4.809
  587   HG13  VAL 179          3HG1      VAL 179  -0.365 -10.582   6.416
  588   HG21  VAL 179          1HG2      VAL 179  -2.019  -8.290   4.052
  589   HG22  VAL 179          2HG2      VAL 179  -3.343  -9.384   4.495
  590   HG23  VAL 179          3HG2      VAL 179  -3.280  -7.731   5.148
  591    H    GLU 180           H        GLU 180  -1.991  -7.649   8.743
  592    HA   GLU 180           HA       GLU 180  -4.719  -6.432   8.991
  593    HB2  GLU 180          1HB       GLU 180  -3.414  -7.017  11.071
  594    HB3  GLU 180          2HB       GLU 180  -2.229  -5.794  10.593
  595    HG2  GLU 180          1HG       GLU 180  -4.073  -4.085  10.574
  596    HG3  GLU 180          2HG       GLU 180  -5.190  -5.334  11.139
  597    H    CYS 181           H        CYS 181  -5.184  -4.527   8.006
  598    HA   CYS 181           HA       CYS 181  -2.970  -2.894   6.853
  599    HB2  CYS 181          1HB       CYS 181  -4.698  -1.679   5.629
  600    HB3  CYS 181          2HB       CYS 181  -4.699  -3.404   5.237
  601    HG   CYS 181           HG       CYS 181  -6.612  -1.869   7.464
  602    H    LYS 182           H        LYS 182  -2.496  -0.914   7.611
  603    HA   LYS 182           HA       LYS 182  -4.341   0.498   9.493
  604    HB2  LYS 182          1HB       LYS 182  -1.343   0.492   9.934
  605    HB3  LYS 182          2HB       LYS 182  -2.582   1.134  10.991
  606    HG2  LYS 182          1HG       LYS 182  -3.237  -1.141  11.655
  607    HG3  LYS 182          2HG       LYS 182  -2.093  -1.837  10.481
  608    HD2  LYS 182          1HD       LYS 182  -0.225  -0.612  11.613
  609    HD3  LYS 182          2HD       LYS 182  -1.347  -0.084  12.871
  610    HE2  LYS 182          1HE       LYS 182  -0.801  -2.994  12.157
  611    HE3  LYS 182          2HE       LYS 182   0.144  -2.103  13.350
  612    HZ1  LYS 182          1HZ       LYS 182  -1.607  -3.367  14.405
  613    HZ2  LYS 182          2HZ       LYS 182  -2.775  -2.663  13.544
  614    HZ3  LYS 182          3HZ       LYS 182  -1.915  -1.773  14.635
  615    H    LYS 183           H        LYS 183  -4.056   2.864   9.349
  616    HA   LYS 183           HA       LYS 183  -2.989   3.848   6.806
  617    HB2  LYS 183          1HB       LYS 183  -3.964   5.256   9.310
  618    HB3  LYS 183          2HB       LYS 183  -3.308   6.127   7.912
  619    HG2  LYS 183          1HG       LYS 183  -5.003   5.250   6.432
  620    HG3  LYS 183          2HG       LYS 183  -5.599   4.135   7.666
  621    HD2  LYS 183          1HD       LYS 183  -6.285   6.074   9.081
  622    HD3  LYS 183          2HD       LYS 183  -5.766   7.175   7.780
  623    HE2  LYS 183          1HE       LYS 183  -7.353   6.079   6.220
  624    HE3  LYS 183          2HE       LYS 183  -7.843   4.951   7.491
  625    HZ1  LYS 183          1HZ       LYS 183  -8.719   6.842   8.749
  626    HZ2  LYS 183          2HZ       LYS 183  -9.390   6.795   7.246
  627    HZ3  LYS 183          3HZ       LYS 183  -8.240   7.892   7.576
  628    H    ALA 184           H        ALA 184  -1.021   4.757   6.313
  629    HA   ALA 184           HA       ALA 184   1.147   3.856   8.003
  630    HB1  ALA 184          1HB       ALA 184   1.284   3.736   5.564
  631    HB2  ALA 184          2HB       ALA 184   1.204   5.514   5.464
  632    HB3  ALA 184          3HB       ALA 184   2.595   4.727   6.237
  633    H    GLN 185           H        GLN 185   1.801   4.874   9.763
  634    HA   GLN 185           HA       GLN 185   1.640   7.745  10.262
  635    HB2  GLN 185          1HB       GLN 185   3.422   5.592  11.478
  636    HB3  GLN 185          2HB       GLN 185   3.211   7.236  12.095
  637    HG2  GLN 185          1HG       GLN 185   0.781   6.724  12.474
  638    HG3  GLN 185          2HG       GLN 185   1.126   5.030  12.078
  639   HE21  GLN 185          1HE2      GLN 185   3.294   4.234  13.363
  640   HE22  GLN 185          2HE2      GLN 185   3.444   4.804  15.013
  641    HA   PRO 186           HA       PRO 186   4.986   8.983   7.682
  642    HB2  PRO 186          1HB       PRO 186   6.280  10.984   9.085
  643    HB3  PRO 186          2HB       PRO 186   4.673  11.166   8.318
  644    HG2  PRO 186          1HG       PRO 186   5.278  10.451  11.214
  645    HG3  PRO 186          2HG       PRO 186   4.170  11.723  10.598
  646    HD2  PRO 186          1HD       PRO 186   3.225   9.318  11.335
  647    HD3  PRO 186          2HD       PRO 186   2.589  10.089   9.856
  648    H    LYS 187           H        LYS 187   7.207   8.655   7.225
  649    HA   LYS 187           HA       LYS 187   8.520   6.577   8.583
  650    HB2  LYS 187          1HB       LYS 187   8.684   7.090   6.196
  651    HB3  LYS 187          2HB       LYS 187   9.543   8.598   6.550
  652    HG2  LYS 187          1HG       LYS 187  11.461   7.449   7.324
  653    HG3  LYS 187          2HG       LYS 187  10.576   5.923   7.488
  654    HD2  LYS 187          1HD       LYS 187  12.151   5.905   5.591
  655    HD3  LYS 187          2HD       LYS 187  10.479   5.619   5.097
  656    HE2  LYS 187          1HE       LYS 187  10.266   7.899   4.270
  657    HE3  LYS 187          2HE       LYS 187  11.867   8.324   4.899
  658    HZ1  LYS 187          1HZ       LYS 187  11.854   7.764   2.483
  659    HZ2  LYS 187          2HZ       LYS 187  11.435   6.215   2.836
  660    HZ3  LYS 187          3HZ       LYS 187  12.867   6.811   3.336
  661    H    GLU 188           H        GLU 188   8.554   9.796   9.458
  662    HA   GLU 188           HA       GLU 188  11.092   9.794  10.952
  663    HB2  GLU 188          1HB       GLU 188   8.733  11.720  10.971
  664    HB3  GLU 188          2HB       GLU 188  10.272  12.008  11.771
  665    HG2  GLU 188          1HG       GLU 188   9.855  11.718   8.763
  666    HG3  GLU 188          2HG       GLU 188  10.048  13.226   9.640
  667    H    VAL 189           H        VAL 189   7.891   8.629  11.629
  668    HA   VAL 189           HA       VAL 189   7.709   9.370  14.353
  669    HB   VAL 189           HB       VAL 189   5.877   8.649  12.730
  670   HG11  VAL 189          1HG1      VAL 189   5.174   6.365  12.724
  671   HG12  VAL 189          2HG1      VAL 189   6.885   6.356  12.282
  672   HG13  VAL 189          3HG1      VAL 189   6.370   5.888  13.921
  673   HG21  VAL 189          1HG2      VAL 189   5.443   9.295  15.036
  674   HG22  VAL 189          2HG2      VAL 189   4.398   7.954  14.543
  675   HG23  VAL 189          3HG2      VAL 189   5.799   7.642  15.593
  676    H    MET 190           H        MET 190   8.792   6.303  13.001
  677    HA   MET 190           HA       MET 190   9.855   4.499  13.811
  678    HB2  MET 190          1HB       MET 190  11.370   6.634  15.329
  679    HB3  MET 190          2HB       MET 190  11.956   4.993  15.038
  680    HG2  MET 190          1HG       MET 190  11.114   6.659  12.654
  681    HG3  MET 190          2HG       MET 190  12.602   7.059  13.491
  682    HE1  MET 190          1HE       MET 190  11.053   3.367  12.483
  683    HE2  MET 190          2HE       MET 190  10.736   4.570  11.201
  684    HE3  MET 190          3HE       MET 190  11.911   3.264  10.944
  685    H    SER 191           H        SER 191   7.504   4.480  14.889
  686    HA   SER 191           HA       SER 191   7.290   4.528  17.676
  687    HB2  SER 191          1HB       SER 191   5.710   2.927  15.627
  688    HB3  SER 191          2HB       SER 191   5.250   3.085  17.328
  689    HG   SER 191           HG       SER 191   5.027   5.302  17.057
  690    HA   PRO 192           HA       PRO 192   9.306   0.870  19.140
  691    HB2  PRO 192          1HB       PRO 192   6.861   0.343  20.835
  692    HB3  PRO 192          2HB       PRO 192   8.589   0.335  21.311
  693    HG2  PRO 192          1HG       PRO 192   7.043   2.479  21.885
  694    HG3  PRO 192          2HG       PRO 192   8.694   2.729  21.226
  695    HD2  PRO 192          1HD       PRO 192   6.048   2.811  19.747
  696    HD3  PRO 192          2HD       PRO 192   7.431   3.943  19.669
  697    H    THR 193           H        THR 193   9.539  -1.252  18.614
  698    HA   THR 193           HA       THR 193   7.620  -2.517  16.866
  699    HB   THR 193           HB       THR 193   9.165  -4.123  16.342
  700    HG1  THR 193          1HG       THR 193  10.934  -4.622  17.615
  701   HG21  THR 193          1HG2      THR 193   9.967  -1.825  15.690
  702   HG22  THR 193          2HG2      THR 193  11.248  -3.031  15.857
  703   HG23  THR 193          3HG2      THR 193  11.004  -1.824  17.134
  704    H    GLY 194           H        GLY 194   6.781  -4.671  17.018
  705    HA2  GLY 194          1HA       GLY 194   6.769  -6.182  19.458
  706    HA3  GLY 194          2HA       GLY 194   5.270  -5.258  19.341
  707    H    SER 195           H        SER 195   6.378  -8.243  18.877
  708    HA   SER 195           HA       SER 195   5.542  -8.908  16.212
  709    HB2  SER 195          1HB       SER 195   5.836 -11.262  17.001
  710    HB3  SER 195          2HB       SER 195   7.242 -10.216  17.243
  711    HG   SER 195           HG       SER 195   6.773 -11.502  19.092
  712    H    ALA 196           H        ALA 196   3.861 -10.195  15.493
  713    HA   ALA 196           HA       ALA 196   1.623 -10.994  17.145
  714    HB1  ALA 196          1HB       ALA 196   1.034  -8.612  16.984
  715    HB2  ALA 196          2HB       ALA 196   1.235  -8.649  15.222
  716    HB3  ALA 196          3HB       ALA 196  -0.081  -9.564  15.988
  717    H    ARG 197           H        ARG 197   0.526 -12.675  16.152
  718    HA   ARG 197           HA       ARG 197   1.511 -13.607  13.547
  719    HB2  ARG 197          1HB       ARG 197   0.966 -15.013  15.662
  720    HB3  ARG 197          2HB       ARG 197  -0.726 -14.878  15.159
  721    HG2  ARG 197          1HG       ARG 197  -0.066 -15.903  12.929
  722    HG3  ARG 197          2HG       ARG 197   1.593 -16.032  13.544
  723    HD2  ARG 197          1HD       ARG 197   0.535 -17.365  15.510
  724    HD3  ARG 197          2HD       ARG 197  -0.894 -17.501  14.490
  725    HE   ARG 197           HE       ARG 197   1.789 -18.715  14.087
  726   HH11  ARG 197          1HH1      ARG 197  -1.454 -18.419  12.686
  727   HH12  ARG 197          2HH1      ARG 197  -1.271 -19.935  11.848
  728   HH21  ARG 197          1HH2      ARG 197   1.933 -20.554  12.897
  729   HH22  ARG 197          2HH2      ARG 197   0.592 -21.073  11.921
  730    H    GLY 198           H        GLY 198  -1.400 -12.038  14.672
  731    HA2  GLY 198          1HA       GLY 198  -3.084 -10.995  13.368
  732    HA3  GLY 198          2HA       GLY 198  -2.531 -11.853  11.931
  733    H    ARG 199           H        ARG 199  -4.950 -12.104  11.785
  734    HA   ARG 199           HA       ARG 199  -6.394 -13.779  13.640
  735    HB2  ARG 199          1HB       ARG 199  -7.044 -12.931  10.785
  736    HB3  ARG 199          2HB       ARG 199  -8.176 -13.731  11.864
  737    HG2  ARG 199          1HG       ARG 199  -6.927 -10.992  12.307
  738    HG3  ARG 199          2HG       ARG 199  -8.569 -11.310  11.770
  739    HD2  ARG 199          1HD       ARG 199  -7.391 -12.020  14.490
  740    HD3  ARG 199          2HD       ARG 199  -8.464 -10.678  14.154
  741    HE   ARG 199           HE       ARG 199  -9.174 -13.533  14.368
  742   HH11  ARG 199          1HH1      ARG 199 -12.046 -10.865  13.619
  743   HH12  ARG 199          2HH1      ARG 199 -10.383 -10.374  13.446
  744   HH21  ARG 199          1HH2      ARG 199 -12.547 -12.916  14.221
  745   HH22  ARG 199          2HH2      ARG 199 -11.308 -14.093  14.543
  746    H    SER 200           H        SER 200  -4.308 -14.698  11.098
  747    HA   SER 200           HA       SER 200  -5.387 -17.369  10.609
  748    HB2  SER 200          1HB       SER 200  -3.199 -17.676   9.415
  749    HB3  SER 200          2HB       SER 200  -4.189 -16.332   8.817
  750    HG   SER 200           HG       SER 200  -2.212 -16.061  10.829
  751    H5'    G 201           H5'        G 201   3.800 -13.595  14.133
  752   H5''    G 201           H5"        G 201   3.562 -14.422  12.584
  753    H4'    G 201           H4'        G 201   6.121 -13.088  13.564
  754    H3'    G 201           H3'        G 201   3.963 -11.785  12.449
  755    H2'    G 201           H2'        G 201   3.818 -13.266  10.570
  756   HO2'    G 201           HO2        G 201   5.186 -10.868  10.049
  757    H1'    G 201           H1'        G 201   6.813 -12.886  10.314
  758    H8     G 201          8H          G 201   7.535 -13.996   8.163
  759    H1     G 201          1H          G 201   2.981 -18.545   8.496
  760    H21    G 201          1H2         G 201   1.779 -18.228  10.374
  761    H22    G 201          2H2         G 201   2.155 -16.870  11.422
  762   HO5'    G 201           HO5        G 201   5.283 -15.884  13.269
  763    H5'    U 202           H5'        U 202   5.881  -8.270  11.073
  764   H5''    U 202           H5"        U 202   6.926  -7.654  12.360
  765    H4'    U 202           H4'        U 202   5.688  -5.811  11.484
  766    H3'    U 202           H3'        U 202   5.731  -6.369  14.183
  767    H2'    U 202           H2'        U 202   3.607  -7.467  14.136
  768   HO2'    U 202           HO2        U 202   3.482  -5.767  15.716
  769    H1'    U 202           H1'        U 202   2.709  -5.168  12.385
  770    H3     U 202          3H          U 202  -1.612  -6.469  12.725
  771    H5     U 202          5H          U 202   0.407 -10.118  12.359
  772    H6     U 202          6H          U 202   2.534  -8.904  12.360
  773    H5'    A 203           H5'        A 203   7.085  -3.263  12.045
  774   H5''    A 203           H5"        A 203   8.310  -3.066  13.305
  775    H4'    A 203           H4'        A 203   8.655  -1.519  11.458
  776    H3'    A 203           H3'        A 203   8.741  -0.756  14.132
  777    H2'    A 203           H2'        A 203   6.581   0.131  14.212
  778   HO2'    A 203           HO2        A 203   8.002   1.914  14.676
  779    H1'    A 203           H1'        A 203   6.914   1.375  11.486
  780    H8     A 203          8H          A 203   4.403  -0.622  13.736
  781    H61    A 203          1H6         A 203   0.210   2.896  10.605
  782    H62    A 203          2H6         A 203   0.330   1.738  11.937
  783    H2     A 203          2H          A 203   4.089   3.779   9.043
  784    H5'    G 204           H5'        G 204   9.960   1.503  10.108
  785   H5''    G 204           H5"        G 204   9.820  -0.252  10.004
  786    H4'    G 204           H4'        G 204  11.608  -0.417   8.409
  787    H3'    G 204           H3'        G 204  12.805   1.872   9.410
  788    H2'    G 204           H2'        G 204  10.959   3.278   8.704
  789   HO2'    G 204           HO2        G 204  13.212   3.316   7.052
  790    H1'    G 204           H1'        G 204  11.219   1.746   6.111
  791    H8     G 204          8H          G 204   9.747   2.725   4.318
  792    H1     G 204          1H          G 204   5.762   5.518   8.522
  793    H21    G 204          1H2         G 204   6.449   5.018  10.596
  794    H22    G 204          2H2         G 204   7.733   3.844  10.839
  795    H5'    U 205           H5'        U 205  13.700  -1.750   6.372
  796   H5''    U 205           H5"        U 205  15.388  -2.190   6.685
  797    H4'    U 205           H4'        U 205  14.968  -2.890   4.487
  798    H3'    U 205           H3'        U 205  16.948  -0.991   4.817
  799   HO3'    U 205           HO3        U 205  17.140  -1.565   2.357
  800    H2'    U 205           H2'        U 205  15.659   0.852   4.130
  801   HO2'    U 205           HO2        U 205  17.357   0.857   2.598
  802    H1'    U 205           H1'        U 205  14.382  -0.829   1.967
  803    H3     U 205          3H          U 205  11.888   2.698   0.582
  804    H5     U 205          5H          U 205  12.280   3.428   4.676
  805    H6     U 205          6H          U 205  13.469   1.303   4.908
  Start of MODEL    8
    1    H1   GLY 105          1H        GLY 105   3.808  18.457   2.733
    2    H2   GLY 105          2H        GLY 105   4.977  17.309   2.686
    3    H3   GLY 105          3H        GLY 105   4.033  17.469   4.017
    4    HA2  GLY 105          1HA       GLY 105   3.102  16.618   1.352
    5    HA3  GLY 105          2HA       GLY 105   3.354  15.542   2.739
    6    H    SER 106           H        SER 106   0.941  15.467   1.598
    7    HA   SER 106           HA       SER 106  -0.850  16.356   3.741
    8    HB2  SER 106          1HB       SER 106  -0.830  18.374   2.357
    9    HB3  SER 106          2HB       SER 106  -1.239  17.424   0.919
   10    HG   SER 106           HG       SER 106  -3.068  18.447   1.903
   11    H    HIS 107           H        HIS 107  -0.815  15.030   0.391
   12    HA   HIS 107           HA       HIS 107  -3.080  13.281   0.778
   13    HB2  HIS 107          1HB       HIS 107  -0.948  13.609  -1.345
   14    HB3  HIS 107          2HB       HIS 107  -2.044  12.239  -1.381
   15    HD2  HIS 107          2HD       HIS 107  -1.858  15.644  -2.696
   16    HE1  HIS 107          1HE       HIS 107  -6.018  14.694  -2.733
   17    HE2  HIS 107          2HE       HIS 107  -4.247  16.316  -3.587
   18    H    MET 108           H        MET 108  -2.802  12.014   2.596
   19    HA   MET 108           HA       MET 108  -0.571  10.153   2.862
   20    HB2  MET 108          1HB       MET 108  -1.715  11.228   4.773
   21    HB3  MET 108          2HB       MET 108  -3.176  10.300   4.423
   22    HG2  MET 108          1HG       MET 108  -2.023   8.207   4.911
   23    HG3  MET 108          2HG       MET 108  -0.470   9.028   5.025
   24    HE1  MET 108          1HE       MET 108  -0.671  11.459   6.860
   25    HE2  MET 108          2HE       MET 108  -0.492  10.725   8.467
   26    HE3  MET 108          3HE       MET 108   0.481  10.125   7.107
   27    H    LYS 109           H        LYS 109  -1.287   9.648   0.425
   28    HA   LYS 109           HA       LYS 109  -3.334   7.591   0.126
   29    HB2  LYS 109          1HB       LYS 109  -1.310   8.726  -1.823
   30    HB3  LYS 109          2HB       LYS 109  -2.479   7.469  -2.234
   31    HG2  LYS 109          1HG       LYS 109  -4.345   8.975  -1.546
   32    HG3  LYS 109          2HG       LYS 109  -3.169  10.285  -1.353
   33    HD2  LYS 109          1HD       LYS 109  -2.429   9.805  -3.761
   34    HD3  LYS 109          2HD       LYS 109  -3.800   8.683  -3.868
   35    HE2  LYS 109          1HE       LYS 109  -5.356  10.571  -3.361
   36    HE3  LYS 109          2HE       LYS 109  -3.980  11.675  -3.274
   37    HZ1  LYS 109          1HZ       LYS 109  -5.048  11.719  -5.473
   38    HZ2  LYS 109          2HZ       LYS 109  -4.741  10.127  -5.710
   39    HZ3  LYS 109          3HZ       LYS 109  -3.509  11.197  -5.607
   40    H    LYS 110           H        LYS 110  -1.329   6.767   2.054
   41    HA   LYS 110           HA       LYS 110  -0.308   4.313   0.718
   42    HB2  LYS 110          1HB       LYS 110   1.457   6.115   0.681
   43    HB3  LYS 110          2HB       LYS 110   1.475   6.067   2.444
   44    HG2  LYS 110          1HG       LYS 110   2.165   3.652   2.340
   45    HG3  LYS 110          2HG       LYS 110   2.060   3.722   0.579
   46    HD2  LYS 110          1HD       LYS 110   4.357   3.906   1.077
   47    HD3  LYS 110          2HD       LYS 110   3.841   5.528   0.608
   48    HE2  LYS 110          1HE       LYS 110   3.680   6.164   3.017
   49    HE3  LYS 110          2HE       LYS 110   4.142   4.519   3.478
   50    HZ1  LYS 110          1HZ       LYS 110   5.869   6.431   2.000
   51    HZ2  LYS 110          2HZ       LYS 110   6.288   4.889   2.366
   52    HZ3  LYS 110          3HZ       LYS 110   6.051   5.966   3.562
   53    H    ILE 111           H        ILE 111  -0.310   2.512   1.881
   54    HA   ILE 111           HA       ILE 111  -0.994   2.666   4.795
   55    HB   ILE 111           HB       ILE 111  -2.182   0.597   4.670
   56   HG12  ILE 111          1HG1      ILE 111  -1.442   0.543   1.741
   57   HG13  ILE 111          2HG1      ILE 111  -0.948  -0.598   2.976
   58   HG21  ILE 111          1HG2      ILE 111  -3.239   2.375   2.444
   59   HG22  ILE 111          2HG2      ILE 111  -4.160   1.304   3.528
   60   HG23  ILE 111          3HG2      ILE 111  -3.361   2.733   4.189
   61   HD11  ILE 111          1HD1      ILE 111  -3.301  -1.354   3.238
   62   HD12  ILE 111          2HD1      ILE 111  -3.760  -0.296   1.880
   63   HD13  ILE 111          3HD1      ILE 111  -2.634  -1.636   1.619
   64    H    PHE 112           H        PHE 112  -0.185   1.213   6.117
   65    HA   PHE 112           HA       PHE 112   2.336  -0.236   5.547
   66    HB2  PHE 112          1HB       PHE 112   2.223   1.275   7.499
   67    HB3  PHE 112          2HB       PHE 112   0.762   0.484   8.069
   68    HD1  PHE 112          1HD       PHE 112   0.853  -1.816   9.061
   69    HD2  PHE 112          2HD       PHE 112   4.400   0.307   7.849
   70    HE1  PHE 112          1HE       PHE 112   2.260  -3.390  10.382
   71    HE2  PHE 112          2HE       PHE 112   5.786  -1.207   9.205
   72    HZ   PHE 112           HZ       PHE 112   4.732  -3.085  10.466
   73    H    VAL 113           H        VAL 113   2.278  -2.463   5.447
   74    HA   VAL 113           HA       VAL 113  -0.207  -3.928   6.221
   75    HB   VAL 113           HB       VAL 113   1.460  -4.544   3.767
   76   HG11  VAL 113          1HG1      VAL 113  -1.170  -5.684   4.800
   77   HG12  VAL 113          2HG1      VAL 113  -0.405  -6.088   3.246
   78   HG13  VAL 113          3HG1      VAL 113   0.395  -6.531   4.756
   79   HG21  VAL 113          1HG2      VAL 113  -0.552  -3.823   2.489
   80   HG22  VAL 113          2HG2      VAL 113  -1.256  -3.190   3.995
   81   HG23  VAL 113          3HG2      VAL 113   0.253  -2.504   3.332
   82    H    GLY 114           H        GLY 114   0.294  -5.138   7.932
   83    HA2  GLY 114          1HA       GLY 114   3.064  -6.291   8.168
   84    HA3  GLY 114          2HA       GLY 114   2.110  -5.699   9.514
   85    H    GLY 115           H        GLY 115   3.392  -8.348   8.814
   86    HA2  GLY 115          1HA       GLY 115   2.795 -10.404   9.877
   87    HA3  GLY 115          2HA       GLY 115   1.092 -10.130   9.508
   88    H    LEU 116           H        LEU 116   3.341  -9.523   6.926
   89    HA   LEU 116           HA       LEU 116   2.102 -11.435   5.151
   90    HB2  LEU 116          1HB       LEU 116   4.650  -9.778   4.966
   91    HB3  LEU 116          2HB       LEU 116   4.031 -10.732   3.629
   92    HG   LEU 116           HG       LEU 116   2.364  -8.531   4.917
   93   HD11  LEU 116          1HD1      LEU 116   3.126  -7.066   3.103
   94   HD12  LEU 116          2HD1      LEU 116   4.225  -8.337   2.515
   95   HD13  LEU 116          3HD1      LEU 116   4.502  -7.578   4.093
   96   HD21  LEU 116          1HD2      LEU 116   1.221 -10.231   3.399
   97   HD22  LEU 116          2HD2      LEU 116   2.322  -9.730   2.109
   98   HD23  LEU 116          3HD2      LEU 116   1.179  -8.562   2.795
   99    H    SER 117           H        SER 117   2.988 -13.276   4.153
  100    HA   SER 117           HA       SER 117   4.855 -14.928   5.661
  101    HB2  SER 117          1HB       SER 117   3.100 -15.950   4.277
  102    HB3  SER 117          2HB       SER 117   3.825 -15.251   2.825
  103    HG   SER 117           HG       SER 117   4.356 -17.513   3.537
  104    H    VAL 118           H        VAL 118   7.033 -15.199   5.350
  105    HA   VAL 118           HA       VAL 118   8.622 -13.344   3.810
  106    HB   VAL 118           HB       VAL 118  10.497 -14.884   4.270
  107   HG11  VAL 118          1HG1      VAL 118   8.749 -14.389   6.710
  108   HG12  VAL 118          2HG1      VAL 118  10.504 -14.644   6.695
  109   HG13  VAL 118          3HG1      VAL 118   9.814 -13.196   5.942
  110   HG21  VAL 118          1HG2      VAL 118   8.421 -16.663   5.626
  111   HG22  VAL 118          2HG2      VAL 118   9.323 -17.059   4.145
  112   HG23  VAL 118          3HG2      VAL 118  10.181 -16.869   5.679
  113    H    ASN 119           H        ASN 119   6.783 -16.060   2.802
  114    HA   ASN 119           HA       ASN 119   8.344 -16.597   0.352
  115    HB2  ASN 119          1HB       ASN 119   5.633 -17.629   1.302
  116    HB3  ASN 119          2HB       ASN 119   6.527 -18.204  -0.097
  117   HD21  ASN 119          1HD2      ASN 119   6.342 -18.304   3.417
  118   HD22  ASN 119          2HD2      ASN 119   7.549 -19.572   3.586
  119    H    THR 120           H        THR 120   5.826 -14.396   1.344
  120    HA   THR 120           HA       THR 120   4.553 -13.988  -1.222
  121    HB   THR 120           HB       THR 120   4.723 -12.197   1.230
  122    HG1  THR 120          1HG       THR 120   2.793 -13.112   1.759
  123   HG21  THR 120          1HG2      THR 120   2.853 -12.080  -1.152
  124   HG22  THR 120          2HG2      THR 120   3.980 -10.825  -0.598
  125   HG23  THR 120          3HG2      THR 120   2.571 -11.242   0.382
  126    H    THR 121           H        THR 121   5.034 -12.689  -2.855
  127    HA   THR 121           HA       THR 121   7.347 -10.836  -2.585
  128    HB   THR 121           HB       THR 121   7.626 -12.636  -4.270
  129    HG1  THR 121          1HG       THR 121   8.585 -11.184  -5.650
  130   HG21  THR 121          1HG2      THR 121   6.634 -12.298  -6.487
  131   HG22  THR 121          2HG2      THR 121   5.632 -10.965  -5.880
  132   HG23  THR 121          3HG2      THR 121   5.369 -12.623  -5.297
  133    H    VAL 122           H        VAL 122   7.295  -8.831  -3.728
  134    HA   VAL 122           HA       VAL 122   5.199  -7.209  -2.811
  135    HB   VAL 122           HB       VAL 122   7.570  -6.577  -3.321
  136   HG11  VAL 122          1HG1      VAL 122   6.607  -6.165  -6.185
  137   HG12  VAL 122          2HG1      VAL 122   8.192  -5.762  -5.508
  138   HG13  VAL 122          3HG1      VAL 122   7.713  -7.458  -5.659
  139   HG21  VAL 122          1HG2      VAL 122   5.852  -4.904  -2.760
  140   HG22  VAL 122          2HG2      VAL 122   7.062  -4.286  -3.908
  141   HG23  VAL 122          3HG2      VAL 122   5.453  -4.742  -4.488
  142    H    GLU 123           H        GLU 123   5.493  -8.710  -5.994
  143    HA   GLU 123           HA       GLU 123   3.336  -7.221  -7.198
  144    HB2  GLU 123          1HB       GLU 123   4.549  -9.919  -7.944
  145    HB3  GLU 123          2HB       GLU 123   3.415  -8.987  -8.938
  146    HG2  GLU 123          1HG       GLU 123   5.050  -7.081  -8.942
  147    HG3  GLU 123          2HG       GLU 123   6.212  -8.113  -8.102
  148    H    ASP 124           H        ASP 124   3.348 -10.143  -5.169
  149    HA   ASP 124           HA       ASP 124   0.633 -11.018  -5.742
  150    HB2  ASP 124          1HB       ASP 124   2.141 -11.217  -3.104
  151    HB3  ASP 124          2HB       ASP 124   0.748 -12.160  -3.590
  152    H    VAL 125           H        VAL 125   2.155  -8.833  -3.396
  153    HA   VAL 125           HA       VAL 125  -0.220  -8.076  -1.981
  154    HB   VAL 125           HB       VAL 125   2.466  -6.649  -2.179
  155   HG11  VAL 125          1HG1      VAL 125   0.695  -5.192  -1.237
  156   HG12  VAL 125          2HG1      VAL 125   0.294  -6.471  -0.063
  157   HG13  VAL 125          3HG1      VAL 125   1.874  -5.662  -0.009
  158   HG21  VAL 125          1HG2      VAL 125   1.414  -8.783  -0.276
  159   HG22  VAL 125          2HG2      VAL 125   2.818  -8.897  -1.359
  160   HG23  VAL 125          3HG2      VAL 125   2.858  -7.823   0.041
  161    H    LYS 126           H        LYS 126   1.590  -6.397  -4.613
  162    HA   LYS 126           HA       LYS 126  -0.254  -4.226  -4.863
  163    HB2  LYS 126          1HB       LYS 126   2.039  -4.289  -5.808
  164    HB3  LYS 126          2HB       LYS 126   1.513  -5.453  -7.034
  165    HG2  LYS 126          1HG       LYS 126   0.008  -3.822  -8.037
  166    HG3  LYS 126          2HG       LYS 126   0.201  -2.738  -6.657
  167    HD2  LYS 126          1HD       LYS 126   2.713  -2.650  -7.279
  168    HD3  LYS 126          2HD       LYS 126   2.228  -3.333  -8.835
  169    HE2  LYS 126          1HE       LYS 126   1.117  -0.779  -7.571
  170    HE3  LYS 126          2HE       LYS 126   2.426  -0.806  -8.747
  171    HZ1  LYS 126          1HZ       LYS 126   0.926  -1.629 -10.405
  172    HZ2  LYS 126          2HZ       LYS 126   0.202  -0.334  -9.687
  173    HZ3  LYS 126          3HZ       LYS 126  -0.318  -1.828  -9.356
  174    H    HIS 127           H        HIS 127  -0.246  -7.396  -6.566
  175    HA   HIS 127           HA       HIS 127  -2.576  -6.952  -8.165
  176    HB2  HIS 127          1HB       HIS 127  -1.061  -8.763  -8.628
  177    HB3  HIS 127          2HB       HIS 127  -1.286  -9.447  -7.016
  178    HD2  HIS 127          2HD       HIS 127  -3.165 -11.130  -6.651
  179    HE1  HIS 127          1HE       HIS 127  -5.123 -10.849 -10.436
  180    HE2  HIS 127          2HE       HIS 127  -5.028 -12.141  -8.241
  181    H    TYR 128           H        TYR 128  -2.285  -8.331  -4.834
  182    HA   TYR 128           HA       TYR 128  -5.068  -8.789  -4.550
  183    HB2  TYR 128          1HB       TYR 128  -3.606  -9.953  -3.125
  184    HB3  TYR 128          2HB       TYR 128  -2.892  -8.468  -2.507
  185    HD1  TYR 128          1HD       TYR 128  -5.861 -10.654  -2.390
  186    HD2  TYR 128          2HD       TYR 128  -4.009  -7.097  -0.793
  187    HE1  TYR 128          1HE       TYR 128  -7.570 -10.574  -0.574
  188    HE2  TYR 128          2HE       TYR 128  -5.712  -7.030   1.016
  189    HH   TYR 128           HH       TYR 128  -7.701  -7.903   1.783
  190    H    PHE 129           H        PHE 129  -3.230  -5.858  -3.638
  191    HA   PHE 129           HA       PHE 129  -5.624  -4.604  -2.660
  192    HB2  PHE 129          1HB       PHE 129  -2.857  -3.539  -3.059
  193    HB3  PHE 129          2HB       PHE 129  -4.202  -2.521  -2.552
  194    HD1  PHE 129          1HD       PHE 129  -1.609  -4.586  -1.363
  195    HD2  PHE 129          2HD       PHE 129  -5.692  -3.496  -0.531
  196    HE1  PHE 129          1HE       PHE 129  -1.400  -5.524   0.929
  197    HE2  PHE 129          2HE       PHE 129  -5.482  -4.475   1.743
  198    HZ   PHE 129           HZ       PHE 129  -3.341  -5.532   2.445
  199    H    GLU 130           H        GLU 130  -4.295  -4.592  -5.875
  200    HA   GLU 130           HA       GLU 130  -5.788  -2.400  -6.901
  201    HB2  GLU 130          1HB       GLU 130  -4.595  -4.873  -8.162
  202    HB3  GLU 130          2HB       GLU 130  -5.574  -3.739  -9.111
  203    HG2  GLU 130          1HG       GLU 130  -4.136  -1.863  -8.411
  204    HG3  GLU 130          2HG       GLU 130  -3.106  -2.973  -7.517
  205    H    GLN 131           H        GLN 131  -7.049  -5.374  -5.787
  206    HA   GLN 131           HA       GLN 131  -9.468  -5.590  -7.315
  207    HB2  GLN 131          1HB       GLN 131  -8.862  -6.266  -4.391
  208    HB3  GLN 131          2HB       GLN 131 -10.289  -6.799  -5.294
  209    HG2  GLN 131          1HG       GLN 131  -8.825  -7.891  -6.938
  210    HG3  GLN 131          2HG       GLN 131  -7.398  -7.501  -5.990
  211   HE21  GLN 131          1HE2      GLN 131  -7.513  -8.208  -3.599
  212   HE22  GLN 131          2HE2      GLN 131  -8.292  -9.757  -3.265
  213    H    PHE 132           H        PHE 132  -8.692  -3.880  -4.353
  214    HA   PHE 132           HA       PHE 132 -11.318  -2.742  -3.900
  215    HB2  PHE 132          1HB       PHE 132  -8.613  -1.901  -2.769
  216    HB3  PHE 132          2HB       PHE 132 -10.183  -1.373  -2.188
  217    HD1  PHE 132          1HD       PHE 132  -7.611  -3.768  -1.785
  218    HD2  PHE 132          2HD       PHE 132 -11.890  -3.331  -1.528
  219    HE1  PHE 132          1HE       PHE 132  -7.721  -5.750  -0.294
  220    HE2  PHE 132          2HE       PHE 132 -12.004  -5.355  -0.096
  221    HZ   PHE 132           HZ       PHE 132  -9.919  -6.565   0.530
  222    H    GLY 133           H        GLY 133  -8.435  -1.513  -5.475
  223    HA2  GLY 133          1HA       GLY 133  -9.582   0.208  -7.320
  224    HA3  GLY 133          2HA       GLY 133  -9.270   1.211  -5.899
  225    H    LYS 134           H        LYS 134  -7.892   1.764  -8.245
  226    HA   LYS 134           HA       LYS 134  -5.666   0.163  -8.750
  227    HB2  LYS 134          1HB       LYS 134  -6.607   1.737 -10.379
  228    HB3  LYS 134          2HB       LYS 134  -6.026   3.100  -9.428
  229    HG2  LYS 134          1HG       LYS 134  -4.553   2.729 -11.314
  230    HG3  LYS 134          2HG       LYS 134  -3.671   2.388  -9.832
  231    HD2  LYS 134          1HD       LYS 134  -4.040  -0.072 -10.213
  232    HD3  LYS 134          2HD       LYS 134  -4.922   0.314 -11.701
  233    HE2  LYS 134          1HE       LYS 134  -2.897   1.341 -12.650
  234    HE3  LYS 134          2HE       LYS 134  -2.026   1.086 -11.129
  235    HZ1  LYS 134          1HZ       LYS 134  -2.267  -1.310 -11.435
  236    HZ2  LYS 134          2HZ       LYS 134  -1.543  -0.668 -12.763
  237    HZ3  LYS 134          3HZ       LYS 134  -3.112  -1.102 -12.826
  238    H    VAL 135           H        VAL 135  -3.691   0.003  -8.190
  239    HA   VAL 135           HA       VAL 135  -2.579   1.549  -5.898
  240    HB   VAL 135           HB       VAL 135  -1.801  -1.169  -6.989
  241   HG11  VAL 135          1HG1      VAL 135  -0.883   0.212  -4.450
  242   HG12  VAL 135          2HG1      VAL 135  -0.452  -1.416  -4.964
  243   HG13  VAL 135          3HG1      VAL 135   0.117  -0.021  -5.892
  244   HG21  VAL 135          1HG2      VAL 135  -3.260  -0.439  -4.407
  245   HG22  VAL 135          2HG2      VAL 135  -4.021  -1.183  -5.822
  246   HG23  VAL 135          3HG2      VAL 135  -2.782  -2.071  -4.932
  247    H    ASP 136           H        ASP 136  -0.910   2.842  -6.212
  248    HA   ASP 136           HA       ASP 136   0.178   3.357  -8.877
  249    HB2  ASP 136          1HB       ASP 136  -0.306   5.219  -7.425
  250    HB3  ASP 136          2HB       ASP 136   0.653   4.529  -6.123
  251    H    ASP 137           H        ASP 137   1.490   2.136  -5.768
  252    HA   ASP 137           HA       ASP 137   3.597   0.588  -7.101
  253    HB2  ASP 137          1HB       ASP 137   4.393   3.045  -6.965
  254    HB3  ASP 137          2HB       ASP 137   4.341   2.874  -5.211
  255    H    ALA 138           H        ALA 138   4.846  -0.649  -5.487
  256    HA   ALA 138           HA       ALA 138   3.881  -0.747  -2.716
  257    HB1  ALA 138          1HB       ALA 138   3.728  -3.176  -4.563
  258    HB2  ALA 138          2HB       ALA 138   3.466  -3.194  -2.806
  259    HB3  ALA 138          3HB       ALA 138   2.350  -2.307  -3.860
  260    H    MET 139           H        MET 139   5.361  -1.797  -1.284
  261    HA   MET 139           HA       MET 139   7.861  -2.945  -2.321
  262    HB2  MET 139          1HB       MET 139   9.318  -1.407  -1.047
  263    HB3  MET 139          2HB       MET 139   8.527  -0.661  -2.431
  264    HG2  MET 139          1HG       MET 139   6.920   0.471  -0.978
  265    HG3  MET 139          2HG       MET 139   7.566  -0.360   0.437
  266    HE1  MET 139          1HE       MET 139   8.764   3.236   1.235
  267    HE2  MET 139          2HE       MET 139   7.195   2.670   0.618
  268    HE3  MET 139          3HE       MET 139   8.042   1.751   1.886
  269    H    LEU 140           H        LEU 140   8.686  -4.477  -0.984
  270    HA   LEU 140           HA       LEU 140   7.534  -4.727   1.766
  271    HB2  LEU 140          1HB       LEU 140   8.901  -6.923   0.205
  272    HB3  LEU 140          2HB       LEU 140   8.009  -7.048   1.719
  273    HG   LEU 140           HG       LEU 140   6.882  -6.502  -1.055
  274   HD11  LEU 140          1HD1      LEU 140   7.411  -8.858  -0.519
  275   HD12  LEU 140          2HD1      LEU 140   5.662  -8.598  -0.674
  276   HD13  LEU 140          3HD1      LEU 140   6.395  -8.748   0.935
  277   HD21  LEU 140          1HD2      LEU 140   5.405  -6.505   1.604
  278   HD22  LEU 140          2HD2      LEU 140   4.640  -6.540  -0.007
  279   HD23  LEU 140          3HD2      LEU 140   5.562  -5.137   0.485
  280    H    MET 141           H        MET 141   8.893  -4.967   3.557
  281    HA   MET 141           HA       MET 141  11.351  -3.444   3.171
  282    HB2  MET 141          1HB       MET 141  10.120  -4.531   5.719
  283    HB3  MET 141          2HB       MET 141  11.459  -3.383   5.604
  284    HG2  MET 141          1HG       MET 141   8.573  -2.930   4.773
  285    HG3  MET 141          2HG       MET 141   9.456  -2.229   6.114
  286    HE1  MET 141          1HE       MET 141   9.925  -2.147   1.976
  287    HE2  MET 141          2HE       MET 141   8.281  -1.858   2.617
  288    HE3  MET 141          3HE       MET 141   9.237  -0.523   1.930
  289    H    PHE 142           H        PHE 142  12.701  -4.839   1.988
  290    HA   PHE 142           HA       PHE 142  13.344  -7.416   2.839
  291    HB2  PHE 142          1HB       PHE 142  14.571  -5.687   0.785
  292    HB3  PHE 142          2HB       PHE 142  15.343  -7.191   1.265
  293    HD1  PHE 142          1HD       PHE 142  14.231  -9.383   0.984
  294    HD2  PHE 142          2HD       PHE 142  12.440  -5.743  -0.466
  295    HE1  PHE 142          1HE       PHE 142  12.629 -10.714  -0.366
  296    HE2  PHE 142          2HE       PHE 142  10.835  -7.073  -1.816
  297    HZ   PHE 142           HZ       PHE 142  10.921  -9.561  -1.764
  298    H    ASP 143           H        ASP 143  14.561  -8.439   4.184
  299    HA   ASP 143           HA       ASP 143  16.509  -7.017   5.884
  300    HB2  ASP 143          1HB       ASP 143  15.176  -8.638   7.002
  301    HB3  ASP 143          2HB       ASP 143  15.465  -9.851   5.758
  302    H    LYS 144           H        LYS 144  16.416  -9.466   3.366
  303    HA   LYS 144           HA       LYS 144  18.849  -8.451   2.123
  304    HB2  LYS 144          1HB       LYS 144  19.872 -10.059   3.624
  305    HB3  LYS 144          2HB       LYS 144  18.692 -11.289   3.209
  306    HG2  LYS 144          1HG       LYS 144  20.810 -11.784   2.159
  307    HG3  LYS 144          2HG       LYS 144  19.618 -11.429   0.911
  308    HD2  LYS 144          1HD       LYS 144  20.565  -9.171   0.600
  309    HD3  LYS 144          2HD       LYS 144  21.678  -9.430   1.962
  310    HE2  LYS 144          1HE       LYS 144  22.751 -11.295   0.754
  311    HE3  LYS 144          2HE       LYS 144  21.620 -11.105  -0.588
  312    HZ1  LYS 144          1HZ       LYS 144  23.583  -9.048   0.285
  313    HZ2  LYS 144          2HZ       LYS 144  22.540  -8.872  -0.963
  314    HZ3  LYS 144          3HZ       LYS 144  23.729  -9.985  -1.040
  315    H    THR 145           H        THR 145  18.372  -8.309   0.008
  316    HA   THR 145           HA       THR 145  15.789  -8.878  -0.997
  317    HB   THR 145           HB       THR 145  16.909  -8.311  -3.228
  318    HG1  THR 145          1HG       THR 145  19.036  -7.584  -3.089
  319   HG21  THR 145          1HG2      THR 145  17.454  -6.395  -0.910
  320   HG22  THR 145          2HG2      THR 145  15.908  -6.567  -1.771
  321   HG23  THR 145          3HG2      THR 145  17.335  -5.968  -2.632
  322    H    THR 146           H        THR 146  18.785 -10.762  -1.265
  323    HA   THR 146           HA       THR 146  17.735 -12.696  -3.157
  324    HB   THR 146           HB       THR 146  19.762 -13.862  -2.935
  325    HG1  THR 146          1HG       THR 146  21.183 -13.503  -1.275
  326   HG21  THR 146          1HG2      THR 146  20.529 -10.934  -2.516
  327   HG22  THR 146          2HG2      THR 146  20.012 -11.643  -4.060
  328   HG23  THR 146          3HG2      THR 146  21.499 -12.208  -3.282
  329    H    ASN 147           H        ASN 147  16.992 -12.271   0.072
  330    HA   ASN 147           HA       ASN 147  16.498 -15.173   0.537
  331    HB2  ASN 147          1HB       ASN 147  17.988 -13.156   2.175
  332    HB3  ASN 147          2HB       ASN 147  16.990 -14.323   3.023
  333   HD21  ASN 147          1HD2      ASN 147  19.628 -14.201   0.533
  334   HD22  ASN 147          2HD2      ASN 147  20.320 -15.712   1.098
  335    H    ARG 148           H        ARG 148  15.580 -12.089   2.199
  336    HA   ARG 148           HA       ARG 148  12.737 -12.738   2.131
  337    HB2  ARG 148          1HB       ARG 148  12.443 -13.277   4.494
  338    HB3  ARG 148          2HB       ARG 148  13.510 -14.440   3.731
  339    HG2  ARG 148          1HG       ARG 148  15.479 -13.060   4.703
  340    HG3  ARG 148          2HG       ARG 148  14.264 -12.171   5.624
  341    HD2  ARG 148          1HD       ARG 148  15.160 -13.906   7.045
  342    HD3  ARG 148          2HD       ARG 148  13.494 -14.314   6.648
  343    HE   ARG 148           HE       ARG 148  14.216 -16.200   5.506
  344   HH11  ARG 148          1HH1      ARG 148  17.089 -14.281   6.124
  345   HH12  ARG 148          2HH1      ARG 148  18.124 -15.441   5.338
  346   HH21  ARG 148          1HH2      ARG 148  15.613 -17.607   4.502
  347   HH22  ARG 148          2HH2      ARG 148  17.296 -17.188   4.349
  348    H    HIS 149           H        HIS 149  11.399 -11.353   3.321
  349    HA   HIS 149           HA       HIS 149  12.542  -8.713   4.112
  350    HB2  HIS 149          1HB       HIS 149  10.285  -7.796   3.654
  351    HB3  HIS 149          2HB       HIS 149  11.035  -8.489   2.224
  352    HD2  HIS 149          2HD       HIS 149   9.642 -10.228   0.914
  353    HE1  HIS 149          1HE       HIS 149   6.571 -10.962   3.775
  354    HE2  HIS 149          2HE       HIS 149   7.365 -11.438   1.387
  355    H    ARG 150           H        ARG 150  11.309  -7.576   5.770
  356    HA   ARG 150           HA       ARG 150  11.410  -9.092   8.218
  357    HB2  ARG 150          1HB       ARG 150  10.522  -6.246   7.618
  358    HB3  ARG 150          2HB       ARG 150  10.776  -6.905   9.242
  359    HG2  ARG 150          1HG       ARG 150  13.154  -7.240   8.818
  360    HG3  ARG 150          2HG       ARG 150  12.968  -6.715   7.144
  361    HD2  ARG 150          1HD       ARG 150  13.847  -4.858   8.372
  362    HD3  ARG 150          2HD       ARG 150  12.183  -4.479   7.937
  363    HE   ARG 150           HE       ARG 150  12.363  -5.674  10.576
  364   HH11  ARG 150          1HH1      ARG 150  13.155  -2.582   9.061
  365   HH12  ARG 150          2HH1      ARG 150  12.391  -1.693  10.370
  366   HH21  ARG 150          1HH2      ARG 150  11.696  -4.406  12.306
  367   HH22  ARG 150          2HH2      ARG 150  11.810  -2.662  12.187
  368    H    GLY 151           H        GLY 151   8.968  -9.503   6.176
  369    HA2  GLY 151          1HA       GLY 151   6.871 -10.418   6.499
  370    HA3  GLY 151          2HA       GLY 151   7.001 -10.158   8.238
  371    H    PHE 152           H        PHE 152   7.534  -7.324   6.246
  372    HA   PHE 152           HA       PHE 152   4.723  -6.574   6.156
  373    HB2  PHE 152          1HB       PHE 152   4.833  -4.641   7.556
  374    HB3  PHE 152          2HB       PHE 152   5.359  -6.009   8.502
  375    HD1  PHE 152          1HD       PHE 152   6.225  -2.756   7.151
  376    HD2  PHE 152          2HD       PHE 152   7.834  -6.265   9.066
  377    HE1  PHE 152          1HE       PHE 152   8.185  -1.445   7.895
  378    HE2  PHE 152          2HE       PHE 152   9.818  -4.943   9.797
  379    HZ   PHE 152           HZ       PHE 152   9.973  -2.548   9.254
  380    H    GLY 153           H        GLY 153   4.415  -4.444   5.130
  381    HA2  GLY 153          1HA       GLY 153   6.630  -3.189   3.683
  382    HA3  GLY 153          2HA       GLY 153   5.549  -4.144   2.667
  383    H    PHE 154           H        PHE 154   5.566  -1.847   1.805
  384    HA   PHE 154           HA       PHE 154   3.210  -0.378   2.845
  385    HB2  PHE 154          1HB       PHE 154   5.707   0.769   1.596
  386    HB3  PHE 154          2HB       PHE 154   4.224   1.672   1.860
  387    HD1  PHE 154          1HD       PHE 154   7.089   0.055   3.506
  388    HD2  PHE 154          2HD       PHE 154   3.465   2.292   4.124
  389    HE1  PHE 154          1HE       PHE 154   7.769   0.496   5.833
  390    HE2  PHE 154          2HE       PHE 154   4.176   2.792   6.454
  391    HZ   PHE 154           HZ       PHE 154   6.344   1.901   7.313
  392    H    VAL 155           H        VAL 155   1.734   0.506   1.467
  393    HA   VAL 155           HA       VAL 155   1.942  -0.138  -1.436
  394    HB   VAL 155           HB       VAL 155  -0.555  -0.730   0.164
  395   HG11  VAL 155          1HG1      VAL 155  -1.244  -1.922  -1.878
  396   HG12  VAL 155          2HG1      VAL 155  -0.976  -0.209  -2.187
  397   HG13  VAL 155          3HG1      VAL 155   0.253  -1.400  -2.683
  398   HG21  VAL 155          1HG2      VAL 155   1.127  -2.363   0.857
  399   HG22  VAL 155          2HG2      VAL 155  -0.073  -3.113  -0.181
  400   HG23  VAL 155          3HG2      VAL 155   1.524  -2.701  -0.846
  401    H    THR 156           H        THR 156   1.472   1.493  -2.702
  402    HA   THR 156           HA       THR 156   0.192   3.905  -1.561
  403    HB   THR 156           HB       THR 156   1.928   4.052  -3.989
  404    HG1  THR 156          1HG       THR 156   3.230   3.090  -2.497
  405   HG21  THR 156          1HG2      THR 156   1.294   6.005  -1.735
  406   HG22  THR 156          2HG2      THR 156   0.628   6.060  -3.383
  407   HG23  THR 156          3HG2      THR 156   2.358   6.321  -3.121
  408    H    PHE 157           H        PHE 157  -1.465   5.025  -2.558
  409    HA   PHE 157           HA       PHE 157  -2.875   3.442  -4.616
  410    HB2  PHE 157          1HB       PHE 157  -3.835   4.934  -2.202
  411    HB3  PHE 157          2HB       PHE 157  -4.918   4.419  -3.483
  412    HD1  PHE 157          1HD       PHE 157  -5.715   2.178  -3.628
  413    HD2  PHE 157          2HD       PHE 157  -2.447   3.119  -0.986
  414    HE1  PHE 157          1HE       PHE 157  -5.853  -0.098  -2.645
  415    HE2  PHE 157          2HE       PHE 157  -2.561   0.837  -0.048
  416    HZ   PHE 157           HZ       PHE 157  -4.269  -0.775  -0.850
  417    H    GLU 158           H        GLU 158  -4.319   4.310  -6.065
  418    HA   GLU 158           HA       GLU 158  -3.581   6.812  -7.327
  419    HB2  GLU 158          1HB       GLU 158  -4.514   4.933  -8.586
  420    HB3  GLU 158          2HB       GLU 158  -5.976   4.964  -7.608
  421    HG2  GLU 158          1HG       GLU 158  -6.465   5.888  -9.748
  422    HG3  GLU 158          2HG       GLU 158  -6.615   7.149  -8.541
  423    H    SER 159           H        SER 159  -6.071   5.935  -4.943
  424    HA   SER 159           HA       SER 159  -6.606   8.814  -4.455
  425    HB2  SER 159          1HB       SER 159  -8.366   8.108  -5.974
  426    HB3  SER 159          2HB       SER 159  -8.761   6.733  -4.922
  427    HG   SER 159           HG       SER 159 -10.055   8.736  -4.671
  428    H    GLU 160           H        GLU 160  -7.122   9.364  -2.395
  429    HA   GLU 160           HA       GLU 160  -6.454   7.538  -0.240
  430    HB2  GLU 160          1HB       GLU 160  -7.139   9.384   1.233
  431    HB3  GLU 160          2HB       GLU 160  -5.916   9.847   0.047
  432    HG2  GLU 160          1HG       GLU 160  -7.595  10.969  -1.331
  433    HG3  GLU 160          2HG       GLU 160  -8.890  10.433  -0.252
  434    H    ASP 161           H        ASP 161  -9.412   8.240  -1.975
  435    HA   ASP 161           HA       ASP 161 -11.244   7.267   0.032
  436    HB2  ASP 161          1HB       ASP 161 -11.451   7.446  -2.982
  437    HB3  ASP 161          2HB       ASP 161 -12.723   6.775  -1.973
  438    H    ILE 162           H        ILE 162  -9.129   5.563  -2.203
  439    HA   ILE 162           HA       ILE 162 -10.313   2.943  -1.601
  440    HB   ILE 162           HB       ILE 162  -7.523   3.429  -2.667
  441   HG12  ILE 162          1HG1      ILE 162  -8.837   4.600  -4.232
  442   HG13  ILE 162          2HG1      ILE 162  -8.406   3.042  -4.915
  443   HG21  ILE 162          1HG2      ILE 162  -7.921   1.161  -1.928
  444   HG22  ILE 162          2HG2      ILE 162  -9.459   1.074  -2.805
  445   HG23  ILE 162          3HG2      ILE 162  -7.921   1.163  -3.689
  446   HD11  ILE 162          1HD1      ILE 162 -10.707   3.562  -5.507
  447   HD12  ILE 162          2HD1      ILE 162 -10.733   2.208  -4.359
  448   HD13  ILE 162          3HD1      ILE 162 -11.141   3.847  -3.815
  449    H    VAL 163           H        VAL 163  -7.502   4.884  -0.462
  450    HA   VAL 163           HA       VAL 163  -6.424   2.961   1.307
  451    HB   VAL 163           HB       VAL 163  -6.518   6.006   1.543
  452   HG11  VAL 163          1HG1      VAL 163  -4.935   4.046   3.217
  453   HG12  VAL 163          2HG1      VAL 163  -4.583   5.784   3.108
  454   HG13  VAL 163          3HG1      VAL 163  -6.113   5.235   3.796
  455   HG21  VAL 163          1HG2      VAL 163  -5.318   5.191  -0.396
  456   HG22  VAL 163          2HG2      VAL 163  -4.157   5.771   0.811
  457   HG23  VAL 163          3HG2      VAL 163  -4.409   4.031   0.607
  458    H    GLU 164           H        GLU 164  -9.003   5.398   1.905
  459    HA   GLU 164           HA       GLU 164  -9.669   4.587   4.569
  460    HB2  GLU 164          1HB       GLU 164 -11.352   5.812   2.353
  461    HB3  GLU 164          2HB       GLU 164 -11.957   5.563   3.982
  462    HG2  GLU 164          1HG       GLU 164  -9.532   7.274   3.287
  463    HG3  GLU 164          2HG       GLU 164 -11.167   7.884   3.509
  464    H    LYS 165           H        LYS 165 -11.077   3.395   1.458
  465    HA   LYS 165           HA       LYS 165 -12.933   1.544   2.565
  466    HB2  LYS 165          1HB       LYS 165 -12.827   2.306   0.208
  467    HB3  LYS 165          2HB       LYS 165 -11.361   1.356  -0.036
  468    HG2  LYS 165          1HG       LYS 165 -12.646  -0.724   0.558
  469    HG3  LYS 165          2HG       LYS 165 -14.115   0.250   0.654
  470    HD2  LYS 165          1HD       LYS 165 -12.320  -0.143  -1.780
  471    HD3  LYS 165          2HD       LYS 165 -13.872  -0.928  -1.519
  472    HE2  LYS 165          1HE       LYS 165 -13.438   2.074  -1.895
  473    HE3  LYS 165          2HE       LYS 165 -13.967   0.951  -3.145
  474    HZ1  LYS 165          1HZ       LYS 165 -15.861   2.079  -2.164
  475    HZ2  LYS 165          2HZ       LYS 165 -15.490   1.560  -0.663
  476    HZ3  LYS 165          3HZ       LYS 165 -15.960   0.492  -1.810
  477    H    VAL 166           H        VAL 166  -9.586   0.979   1.557
  478    HA   VAL 166           HA       VAL 166  -9.405  -1.792   2.306
  479    HB   VAL 166           HB       VAL 166  -7.222   0.294   1.986
  480   HG11  VAL 166          1HG1      VAL 166  -6.356  -1.731   3.108
  481   HG12  VAL 166          2HG1      VAL 166  -7.071  -2.733   1.817
  482   HG13  VAL 166          3HG1      VAL 166  -5.757  -1.610   1.447
  483   HG21  VAL 166          1HG2      VAL 166  -7.010  -0.391  -0.300
  484   HG22  VAL 166          2HG2      VAL 166  -8.152  -1.736  -0.075
  485   HG23  VAL 166          3HG2      VAL 166  -8.721  -0.076  -0.082
  486    H    CYS 167           H        CYS 167  -8.457   1.212   4.058
  487    HA   CYS 167           HA       CYS 167  -7.539  -0.176   6.409
  488    HB2  CYS 167          1HB       CYS 167  -8.360   2.715   5.930
  489    HB3  CYS 167          2HB       CYS 167  -7.779   2.114   7.490
  490    HG   CYS 167           HG       CYS 167  -6.316   2.260   4.566
  491    H    GLU 168           H        GLU 168 -10.818   1.031   5.613
  492    HA   GLU 168           HA       GLU 168 -11.935   0.512   8.217
  493    HB2  GLU 168          1HB       GLU 168 -13.096   0.777   5.433
  494    HB3  GLU 168          2HB       GLU 168 -14.122   0.350   6.789
  495    HG2  GLU 168          1HG       GLU 168 -12.370   2.845   6.743
  496    HG3  GLU 168          2HG       GLU 168 -14.045   2.804   6.198
  497    H    ILE 169           H        ILE 169 -11.259  -1.669   5.520
  498    HA   ILE 169           HA       ILE 169 -12.669  -3.964   6.638
  499    HB   ILE 169           HB       ILE 169 -10.381  -3.728   4.662
  500   HG12  ILE 169          1HG1      ILE 169 -13.291  -4.516   4.136
  501   HG13  ILE 169          2HG1      ILE 169 -12.781  -2.836   4.095
  502   HG21  ILE 169          1HG2      ILE 169 -11.970  -6.209   5.434
  503   HG22  ILE 169          2HG2      ILE 169 -10.875  -6.097   4.041
  504   HG23  ILE 169          3HG2      ILE 169 -10.228  -5.933   5.659
  505   HD11  ILE 169          1HD1      ILE 169 -12.794  -3.674   1.849
  506   HD12  ILE 169          2HD1      ILE 169 -11.115  -3.360   2.326
  507   HD13  ILE 169          3HD1      ILE 169 -11.737  -5.027   2.283
  508    H    HIS 170           H        HIS 170  -9.454  -2.598   6.974
  509    HA   HIS 170           HA       HIS 170  -7.836  -2.678   8.516
  510    HB2  HIS 170          1HB       HIS 170  -9.760  -2.289  10.011
  511    HB3  HIS 170          2HB       HIS 170  -9.886  -4.015  10.301
  512    HD2  HIS 170          2HD       HIS 170  -6.287  -2.712  10.304
  513    HE1  HIS 170          1HE       HIS 170  -7.449  -3.060  14.389
  514    HE2  HIS 170          2HE       HIS 170  -5.480  -2.716  12.812
  515    H    PHE 171           H        PHE 171  -9.413  -5.884   8.662
  516    HA   PHE 171           HA       PHE 171  -6.723  -7.094   8.453
  517    HB2  PHE 171          1HB       PHE 171  -9.053  -8.126   9.978
  518    HB3  PHE 171          2HB       PHE 171  -7.814  -9.203   9.357
  519    HD1  PHE 171          1HD       PHE 171  -8.461  -6.451  11.750
  520    HD2  PHE 171          2HD       PHE 171  -5.502  -9.138  10.135
  521    HE1  PHE 171          1HE       PHE 171  -6.934  -5.908  13.634
  522    HE2  PHE 171          2HE       PHE 171  -3.986  -8.607  12.027
  523    HZ   PHE 171           HZ       PHE 171  -4.695  -6.987  13.775
  524    H    HIS 172           H        HIS 172  -6.050  -8.223   6.913
  525    HA   HIS 172           HA       HIS 172  -7.872  -8.950   4.641
  526    HB2  HIS 172          1HB       HIS 172  -5.240  -7.434   4.718
  527    HB3  HIS 172          2HB       HIS 172  -5.878  -8.140   3.251
  528    HD2  HIS 172          2HD       HIS 172  -6.748  -5.355   5.838
  529    HE1  HIS 172          1HE       HIS 172  -8.780  -4.407   2.236
  530    HE2  HIS 172          2HE       HIS 172  -8.163  -3.574   4.539
  531    H    GLU 173           H        GLU 173  -6.682 -10.436   3.027
  532    HA   GLU 173           HA       GLU 173  -4.789 -12.275   4.405
  533    HB2  GLU 173          1HB       GLU 173  -6.878 -13.327   4.704
  534    HB3  GLU 173          2HB       GLU 173  -7.355 -13.094   3.029
  535    HG2  GLU 173          1HG       GLU 173  -4.893 -14.739   3.773
  536    HG3  GLU 173          2HG       GLU 173  -6.502 -15.429   3.854
  537    H    ILE 174           H        ILE 174  -3.077 -12.876   3.303
  538    HA   ILE 174           HA       ILE 174  -3.033 -12.770   0.339
  539    HB   ILE 174           HB       ILE 174  -0.953 -11.366   2.064
  540   HG12  ILE 174          1HG1      ILE 174  -3.025 -10.204   0.151
  541   HG13  ILE 174          2HG1      ILE 174  -3.020 -10.031   1.907
  542   HG21  ILE 174          1HG2      ILE 174  -1.146 -11.640  -0.974
  543   HG22  ILE 174          2HG2      ILE 174   0.097 -10.739  -0.083
  544   HG23  ILE 174          3HG2      ILE 174   0.028 -12.480   0.065
  545   HD11  ILE 174          1HD1      ILE 174  -0.876  -8.778   1.773
  546   HD12  ILE 174          2HD1      ILE 174  -1.039  -8.785  -0.004
  547   HD13  ILE 174          3HD1      ILE 174  -2.258  -7.989   0.996
  548    H    ASN 175           H        ASN 175  -2.131 -14.574  -0.435
  549    HA   ASN 175           HA       ASN 175  -1.302 -16.686  -0.467
  550    HB2  ASN 175          1HB       ASN 175   0.997 -15.256   0.901
  551    HB3  ASN 175          2HB       ASN 175   1.113 -16.869   0.215
  552   HD21  ASN 175          1HD2      ASN 175   2.510 -14.387  -0.484
  553   HD22  ASN 175          2HD2      ASN 175   2.320 -14.264  -2.235
  554    H    ASN 176           H        ASN 176  -3.183 -16.515   1.470
  555    HA   ASN 176           HA       ASN 176  -4.143 -17.592   3.126
  556    HB2  ASN 176          1HB       ASN 176  -1.844 -19.568   3.028
  557    HB3  ASN 176          2HB       ASN 176  -3.357 -19.796   3.886
  558   HD21  ASN 176          1HD2      ASN 176  -1.828 -20.506   1.003
  559   HD22  ASN 176          2HD2      ASN 176  -3.274 -20.836   0.058
  560    H    LYS 177           H        LYS 177  -1.504 -15.758   3.763
  561    HA   LYS 177           HA       LYS 177  -1.763 -16.075   6.725
  562    HB2  LYS 177          1HB       LYS 177   0.121 -14.366   5.057
  563    HB3  LYS 177          2HB       LYS 177  -0.011 -14.259   6.811
  564    HG2  LYS 177          1HG       LYS 177   0.800 -16.745   5.275
  565    HG3  LYS 177          2HG       LYS 177   1.888 -15.598   6.083
  566    HD2  LYS 177          1HD       LYS 177   0.910 -16.166   8.269
  567    HD3  LYS 177          2HD       LYS 177  -0.157 -17.361   7.491
  568    HE2  LYS 177          1HE       LYS 177   1.773 -18.610   6.650
  569    HE3  LYS 177          2HE       LYS 177   2.881 -17.393   7.287
  570    HZ1  LYS 177          1HZ       LYS 177   2.142 -17.974   9.530
  571    HZ2  LYS 177          2HZ       LYS 177   2.721 -19.296   8.774
  572    HZ3  LYS 177          3HZ       LYS 177   1.109 -19.103   8.950
  573    H    MET 178           H        MET 178  -2.504 -14.532   8.005
  574    HA   MET 178           HA       MET 178  -4.295 -12.504   6.778
  575    HB2  MET 178          1HB       MET 178  -5.442 -13.835   8.335
  576    HB3  MET 178          2HB       MET 178  -4.191 -13.653   9.572
  577    HG2  MET 178          1HG       MET 178  -4.784 -11.485  10.089
  578    HG3  MET 178          2HG       MET 178  -5.513 -11.168   8.516
  579    HE1  MET 178          1HE       MET 178  -7.884 -11.327   7.874
  580    HE2  MET 178          2HE       MET 178  -7.660 -13.088   7.809
  581    HE3  MET 178          3HE       MET 178  -9.072 -12.402   8.643
  582    H    VAL 179           H        VAL 179  -3.991 -10.372   6.947
  583    HA   VAL 179           HA       VAL 179  -1.612  -9.341   8.408
  584    HB   VAL 179           HB       VAL 179  -0.976  -7.941   6.568
  585   HG11  VAL 179          1HG1      VAL 179  -1.284 -10.768   5.501
  586   HG12  VAL 179          2HG1      VAL 179  -0.030  -9.563   5.129
  587   HG13  VAL 179          3HG1      VAL 179  -0.117 -10.272   6.748
  588   HG21  VAL 179          1HG2      VAL 179  -1.922  -8.215   4.292
  589   HG22  VAL 179          2HG2      VAL 179  -3.230  -9.205   4.966
  590   HG23  VAL 179          3HG2      VAL 179  -3.062  -7.492   5.430
  591    H    GLU 180           H        GLU 180  -1.601  -7.244   9.018
  592    HA   GLU 180           HA       GLU 180  -4.288  -5.950   9.317
  593    HB2  GLU 180          1HB       GLU 180  -2.859  -6.371  11.362
  594    HB3  GLU 180          2HB       GLU 180  -1.683  -5.227  10.694
  595    HG2  GLU 180          1HG       GLU 180  -3.531  -3.495  10.627
  596    HG3  GLU 180          2HG       GLU 180  -4.596  -4.672  11.397
  597    H    CYS 181           H        CYS 181  -4.779  -4.228   8.091
  598    HA   CYS 181           HA       CYS 181  -2.610  -2.708   6.710
  599    HB2  CYS 181          1HB       CYS 181  -5.544  -2.973   5.980
  600    HB3  CYS 181          2HB       CYS 181  -4.346  -1.993   5.130
  601    HG   CYS 181           HG       CYS 181  -4.900  -4.281   3.855
  602    H    LYS 182           H        LYS 182  -2.256  -0.675   7.261
  603    HA   LYS 182           HA       LYS 182  -4.267   1.019   8.610
  604    HB2  LYS 182          1HB       LYS 182  -2.652   1.440  10.526
  605    HB3  LYS 182          2HB       LYS 182  -3.505  -0.105  10.507
  606    HG2  LYS 182          1HG       LYS 182  -1.404  -1.175   9.596
  607    HG3  LYS 182          2HG       LYS 182  -0.578   0.373   9.876
  608    HD2  LYS 182          1HD       LYS 182  -1.092   0.237  12.279
  609    HD3  LYS 182          2HD       LYS 182  -2.111  -1.186  12.001
  610    HE2  LYS 182          1HE       LYS 182  -0.045  -2.353  11.070
  611    HE3  LYS 182          2HE       LYS 182   0.913  -1.005  11.703
  612    HZ1  LYS 182          1HZ       LYS 182   0.765  -2.900  13.228
  613    HZ2  LYS 182          2HZ       LYS 182  -0.842  -2.820  13.289
  614    HZ3  LYS 182          3HZ       LYS 182   0.056  -1.582  13.932
  615    H    LYS 183           H        LYS 183  -3.661   3.278   8.743
  616    HA   LYS 183           HA       LYS 183  -2.396   4.163   6.350
  617    HB2  LYS 183          1HB       LYS 183  -3.112   5.691   8.877
  618    HB3  LYS 183          2HB       LYS 183  -2.474   6.448   7.411
  619    HG2  LYS 183          1HG       LYS 183  -4.365   5.544   6.088
  620    HG3  LYS 183          2HG       LYS 183  -5.049   4.822   7.558
  621    HD2  LYS 183          1HD       LYS 183  -5.244   7.066   8.585
  622    HD3  LYS 183          2HD       LYS 183  -4.528   7.801   7.133
  623    HE2  LYS 183          1HE       LYS 183  -6.397   6.937   5.761
  624    HE3  LYS 183          2HE       LYS 183  -7.115   6.182   7.190
  625    HZ1  LYS 183          1HZ       LYS 183  -6.695   9.106   6.851
  626    HZ2  LYS 183          2HZ       LYS 183  -7.396   8.393   8.150
  627    HZ3  LYS 183          3HZ       LYS 183  -8.126   8.333   6.685
  628    H    ALA 184           H        ALA 184  -0.426   4.817   5.753
  629    HA   ALA 184           HA       ALA 184   1.830   3.992   7.358
  630    HB1  ALA 184          1HB       ALA 184   1.789   3.798   4.908
  631    HB2  ALA 184          2HB       ALA 184   1.701   5.570   4.762
  632    HB3  ALA 184          3HB       ALA 184   3.148   4.808   5.456
  633    H    GLN 185           H        GLN 185   2.952   5.109   8.798
  634    HA   GLN 185           HA       GLN 185   2.771   8.087   8.922
  635    HB2  GLN 185          1HB       GLN 185   2.481   6.002  11.090
  636    HB3  GLN 185          2HB       GLN 185   2.833   7.689  11.466
  637    HG2  GLN 185          1HG       GLN 185   0.748   8.461  10.713
  638    HG3  GLN 185          2HG       GLN 185   0.455   7.056   9.699
  639   HE21  GLN 185          1HE2      GLN 185  -0.417   5.122  10.600
  640   HE22  GLN 185          2HE2      GLN 185  -0.990   5.087  12.267
  641    HA   PRO 186           HA       PRO 186   7.186   8.179   9.253
  642    HB2  PRO 186          1HB       PRO 186   6.919  10.219  11.450
  643    HB3  PRO 186          2HB       PRO 186   7.857  10.309   9.930
  644    HG2  PRO 186          1HG       PRO 186   5.514  11.654  10.186
  645    HG3  PRO 186          2HG       PRO 186   5.898  10.790   8.659
  646    HD2  PRO 186          1HD       PRO 186   4.163   9.841  10.962
  647    HD3  PRO 186          2HD       PRO 186   3.823   9.835   9.205
  648    H    LYS 187           H        LYS 187   8.792   7.092  10.391
  649    HA   LYS 187           HA       LYS 187   8.057   5.444  12.585
  650    HB2  LYS 187          1HB       LYS 187  10.302   4.617  12.519
  651    HB3  LYS 187          2HB       LYS 187   9.784   4.941  10.870
  652    HG2  LYS 187          1HG       LYS 187  11.007   7.279  11.247
  653    HG3  LYS 187          2HG       LYS 187  11.820   6.415  12.549
  654    HD2  LYS 187          1HD       LYS 187  11.851   5.862   9.564
  655    HD3  LYS 187          2HD       LYS 187  13.219   6.266  10.594
  656    HE2  LYS 187          1HE       LYS 187  11.626   3.663  10.642
  657    HE3  LYS 187          2HE       LYS 187  13.189   3.878   9.864
  658    HZ1  LYS 187          1HZ       LYS 187  13.140   2.863  12.147
  659    HZ2  LYS 187          2HZ       LYS 187  12.824   4.334  12.768
  660    HZ3  LYS 187          3HZ       LYS 187  14.234   4.092  11.960
  661    H    GLU 188           H        GLU 188   9.218   8.613  12.637
  662    HA   GLU 188           HA       GLU 188  10.245   8.798  15.318
  663    HB2  GLU 188          1HB       GLU 188   8.924  10.900  13.553
  664    HB3  GLU 188          2HB       GLU 188   9.783  11.222  15.070
  665    HG2  GLU 188          1HG       GLU 188  11.840  10.176  14.081
  666    HG3  GLU 188          2HG       GLU 188  10.993  10.034  12.538
  667    H    VAL 189           H        VAL 189   6.903   8.783  14.104
  668    HA   VAL 189           HA       VAL 189   5.835   9.554  16.718
  669    HB   VAL 189           HB       VAL 189   3.766   9.684  15.928
  670   HG11  VAL 189          1HG1      VAL 189   5.241  11.214  14.615
  671   HG12  VAL 189          2HG1      VAL 189   5.254  10.017  13.296
  672   HG13  VAL 189          3HG1      VAL 189   3.736  10.786  13.787
  673   HG21  VAL 189          1HG2      VAL 189   3.328   7.419  15.191
  674   HG22  VAL 189          2HG2      VAL 189   2.814   8.554  13.946
  675   HG23  VAL 189          3HG2      VAL 189   4.328   7.653  13.742
  676    H    MET 190           H        MET 190   6.668   6.594  15.179
  677    HA   MET 190           HA       MET 190   5.186   4.886  17.066
  678    HB2  MET 190          1HB       MET 190   7.185   4.226  14.868
  679    HB3  MET 190          2HB       MET 190   6.225   3.051  15.773
  680    HG2  MET 190          1HG       MET 190   5.134   5.217  13.935
  681    HG3  MET 190          2HG       MET 190   5.278   3.506  13.551
  682    HE1  MET 190          1HE       MET 190   2.619   5.567  13.476
  683    HE2  MET 190          2HE       MET 190   2.733   3.963  12.722
  684    HE3  MET 190          3HE       MET 190   1.390   4.333  13.826
  685    H    SER 191           H        SER 191   8.481   6.067  16.661
  686    HA   SER 191           HA       SER 191  10.407   5.834  17.796
  687    HB2  SER 191          1HB       SER 191   9.040   7.017  19.459
  688    HB3  SER 191          2HB       SER 191   8.628   5.477  20.225
  689    HG   SER 191           HG       SER 191  10.769   5.184  20.767
  690    HA   PRO 192           HA       PRO 192  10.045   1.137  17.900
  691    HB2  PRO 192          1HB       PRO 192  11.195   0.446  15.539
  692    HB3  PRO 192          2HB       PRO 192   9.516   1.061  15.627
  693    HG2  PRO 192          1HG       PRO 192  12.041   2.655  15.021
  694    HG3  PRO 192          2HG       PRO 192  10.526   2.592  14.061
  695    HD2  PRO 192          1HD       PRO 192  10.958   4.569  15.856
  696    HD3  PRO 192          2HD       PRO 192   9.340   3.837  15.630
  697    H    THR 193           H        THR 193  12.709   3.350  17.640
  698    HA   THR 193           HA       THR 193  14.845   1.726  17.251
  699    HB   THR 193           HB       THR 193  15.254   4.090  19.017
  700    HG1  THR 193          1HG       THR 193  14.959   5.420  17.246
  701   HG21  THR 193          1HG2      THR 193  17.232   2.890  18.144
  702   HG22  THR 193          2HG2      THR 193  17.108   4.509  17.443
  703   HG23  THR 193          3HG2      THR 193  16.629   3.092  16.481
  704    H    GLY 194           H        GLY 194  16.211   0.407  18.214
  705    HA2  GLY 194          1HA       GLY 194  15.639  -0.622  20.874
  706    HA3  GLY 194          2HA       GLY 194  16.906  -1.155  19.778
  707    H    SER 195           H        SER 195  17.417  -1.069  22.420
  708    HA   SER 195           HA       SER 195  18.719   1.314  23.373
  709    HB2  SER 195          1HB       SER 195  19.644  -0.195  25.097
  710    HB3  SER 195          2HB       SER 195  17.893  -0.379  24.899
  711    HG   SER 195           HG       SER 195  19.016  -2.394  25.015
  712    H    ALA 196           H        ALA 196  20.964   1.686  23.728
  713    HA   ALA 196           HA       ALA 196  22.641   1.277  21.479
  714    HB1  ALA 196          1HB       ALA 196  24.368   2.350  22.878
  715    HB2  ALA 196          2HB       ALA 196  22.817   3.204  22.993
  716    HB3  ALA 196          3HB       ALA 196  23.347   2.138  24.316
  717    H    ARG 197           H        ARG 197  24.154  -0.156  20.958
  718    HA   ARG 197           HA       ARG 197  25.055  -2.326  22.764
  719    HB2  ARG 197          1HB       ARG 197  24.069  -4.091  21.346
  720    HB3  ARG 197          2HB       ARG 197  22.872  -3.064  22.110
  721    HG2  ARG 197          1HG       ARG 197  22.694  -1.770  19.890
  722    HG3  ARG 197          2HG       ARG 197  23.731  -3.013  19.184
  723    HD2  ARG 197          1HD       ARG 197  21.421  -3.532  18.704
  724    HD3  ARG 197          2HD       ARG 197  22.057  -4.736  19.840
  725    HE   ARG 197           HE       ARG 197  20.716  -2.453  21.120
  726   HH11  ARG 197          1HH1      ARG 197  19.992  -5.536  19.622
  727   HH12  ARG 197          2HH1      ARG 197  18.595  -5.802  20.631
  728   HH21  ARG 197          1HH2      ARG 197  19.049  -2.957  22.517
  729   HH22  ARG 197          2HH2      ARG 197  18.051  -4.346  22.183
  730    H    GLY 198           H        GLY 198  26.469  -0.238  21.366
  731    HA2  GLY 198          1HA       GLY 198  28.663  -1.749  20.278
  732    HA3  GLY 198          2HA       GLY 198  27.766  -0.950  18.985
  733    H    ARG 199           H        ARG 199  30.077  -0.068  18.869
  734    HA   ARG 199           HA       ARG 199  30.167   2.646  20.026
  735    HB2  ARG 199          1HB       ARG 199  32.482   2.401  20.814
  736    HB3  ARG 199          2HB       ARG 199  31.374   1.400  21.732
  737    HG2  ARG 199          1HG       ARG 199  32.194  -0.607  20.862
  738    HG3  ARG 199          2HG       ARG 199  32.834   0.132  19.394
  739    HD2  ARG 199          1HD       ARG 199  33.988   0.637  22.159
  740    HD3  ARG 199          2HD       ARG 199  34.577  -0.610  21.042
  741    HE   ARG 199           HE       ARG 199  34.604   1.713  19.507
  742   HH11  ARG 199          1HH1      ARG 199  37.556   1.962  22.151
  743   HH12  ARG 199          2HH1      ARG 199  36.256   0.851  22.491
  744   HH21  ARG 199          1HH2      ARG 199  36.145   2.994  19.154
  745   HH22  ARG 199          2HH2      ARG 199  37.519   3.189  20.253
  746    H    SER 200           H        SER 200  31.852   3.982  19.115
  747    HA   SER 200           HA       SER 200  32.175   3.844  16.252
  748    HB2  SER 200          1HB       SER 200  33.621   5.520  18.346
  749    HB3  SER 200          2HB       SER 200  33.674   5.794  16.596
  750    HG   SER 200           HG       SER 200  31.459   6.225  16.598
  751    H5'    G 201           H5'        G 201   9.713 -13.949  10.066
  752   H5''    G 201           H5"        G 201  10.328 -12.934   8.751
  753    H4'    G 201           H4'        G 201   8.666 -11.198   9.311
  754    H3'    G 201           H3'        G 201   8.336 -12.257  11.788
  755    H2'    G 201           H2'        G 201   7.592 -14.383  10.962
  756   HO2'    G 201           HO2        G 201   5.552 -12.843  12.002
  757    H1'    G 201           H1'        G 201   5.733 -12.854   9.127
  758    H8     G 201          8H          G 201   4.213 -14.597   8.139
  759    H1     G 201          1H          G 201   8.767 -19.160   8.092
  760    H21    G 201          1H2         G 201  10.654 -18.306   8.983
  761    H22    G 201          2H2         G 201  10.670 -16.645   9.549
  762   HO5'    G 201           HO5        G 201  11.562 -12.693  10.710
  763    H5'    U 202           H5'        U 202   6.159  -8.379  10.055
  764   H5''    U 202           H5"        U 202   7.285  -8.093  11.384
  765    H4'    U 202           H4'        U 202   6.174  -6.019  10.719
  766    H3'    U 202           H3'        U 202   6.527  -6.888  13.331
  767    H2'    U 202           H2'        U 202   4.273  -7.618  13.546
  768   HO2'    U 202           HO2        U 202   4.676  -5.144  14.705
  769    H1'    U 202           H1'        U 202   3.506  -5.095  12.036
  770    H3     U 202          3H          U 202  -0.871  -5.748  12.926
  771    H5     U 202          5H          U 202   0.543  -9.672  12.430
  772    H6     U 202          6H          U 202   2.782  -8.768  11.997
  773    H5'    A 203           H5'        A 203   7.870  -3.358  11.559
  774   H5''    A 203           H5"        A 203   9.195  -3.049  12.690
  775    H4'    A 203           H4'        A 203   9.041  -1.298  11.026
  776    H3'    A 203           H3'        A 203   9.110  -0.762  13.810
  777    H2'    A 203           H2'        A 203   6.837  -0.099  13.898
  778   HO2'    A 203           HO2        A 203   8.502   2.081  13.266
  779    H1'    A 203           H1'        A 203   7.286   1.163  11.170
  780    H8     A 203          8H          A 203   4.514  -0.594  13.320
  781    H61    A 203          1H6         A 203   0.798   3.157   9.893
  782    H62    A 203          2H6         A 203   0.756   1.997  11.227
  783    H2     A 203          2H          A 203   4.834   3.741   8.575
  784    H5'    G 204           H5'        G 204  10.793   1.714   9.669
  785   H5''    G 204           H5"        G 204   9.374   0.651   9.746
  786    H4'    G 204           H4'        G 204  10.590  -0.899   8.134
  787    H3'    G 204           H3'        G 204  12.833   0.592   8.613
  788    H2'    G 204           H2'        G 204  11.884   2.617   7.674
  789   HO2'    G 204           HO2        G 204  13.820   1.546   6.292
  790    H1'    G 204           H1'        G 204  10.902   0.859   5.448
  791    H8     G 204          8H          G 204  10.283   2.528   3.641
  792    H1     G 204          1H          G 204   6.484   5.759   7.726
  793    H21    G 204          1H2         G 204   6.735   4.925   9.712
  794    H22    G 204          2H2         G 204   7.916   3.663  10.019
  795    H5'    U 205           H5'        U 205  14.263  -0.016   4.111
  796   H5''    U 205           H5"        U 205  12.645  -0.648   4.419
  797    H4'    U 205           H4'        U 205  13.432  -2.767   3.150
  798    H3'    U 205           H3'        U 205  15.898  -1.665   2.991
  799   HO3'    U 205           HO3        U 205  15.944  -2.713   0.794
  800    H2'    U 205           H2'        U 205  15.159   0.410   2.049
  801   HO2'    U 205           HO2        U 205  16.807  -0.343   0.627
  802    H1'    U 205           H1'        U 205  13.465  -1.118   0.069
  803    H3     U 205          3H          U 205  12.085   2.778  -1.799
  804    H5     U 205          5H          U 205  12.134   3.705   2.281
  805    H6     U 205          6H          U 205  12.934   1.446   2.751
  Start of MODEL    9
    1    H1   GLY 105          1H        GLY 105  -6.843  12.853   1.814
    2    H2   GLY 105          2H        GLY 105  -7.701  13.112   0.442
    3    H3   GLY 105          3H        GLY 105  -8.038  13.976   1.795
    4    HA2  GLY 105          1HA       GLY 105  -6.841  15.360   0.247
    5    HA3  GLY 105          2HA       GLY 105  -5.888  15.058   1.711
    6    H    SER 106           H        SER 106  -4.207  15.778   0.037
    7    HA   SER 106           HA       SER 106  -3.192  13.738  -1.804
    8    HB2  SER 106          1HB       SER 106  -1.294  15.304  -2.030
    9    HB3  SER 106          2HB       SER 106  -2.863  16.079  -2.312
   10    HG   SER 106           HG       SER 106  -1.497  17.339  -0.954
   11    H    HIS 107           H        HIS 107  -2.666  14.655   1.545
   12    HA   HIS 107           HA       HIS 107  -0.305  13.029   2.030
   13    HB2  HIS 107          1HB       HIS 107  -0.746  13.607   4.368
   14    HB3  HIS 107          2HB       HIS 107  -0.829  15.033   3.349
   15    HD2  HIS 107          2HD       HIS 107  -2.619  13.509   6.121
   16    HE1  HIS 107          1HE       HIS 107  -5.565  15.947   4.238
   17    HE2  HIS 107          2HE       HIS 107  -4.992  14.631   6.339
   18    H    MET 108           H        MET 108  -0.278  11.251   3.569
   19    HA   MET 108           HA       MET 108  -0.770   9.146   4.179
   20    HB2  MET 108          1HB       MET 108  -3.131  10.779   5.046
   21    HB3  MET 108          2HB       MET 108  -3.183   9.041   5.296
   22    HG2  MET 108          1HG       MET 108  -2.301  10.004   7.267
   23    HG3  MET 108          2HG       MET 108  -1.032   9.085   6.471
   24    HE1  MET 108          1HE       MET 108   1.092  11.769   8.244
   25    HE2  MET 108          2HE       MET 108  -0.308  10.850   8.839
   26    HE3  MET 108          3HE       MET 108   0.921  10.047   7.833
   27    H    LYS 109           H        LYS 109  -1.441   9.632   1.287
   28    HA   LYS 109           HA       LYS 109  -3.370   7.568   0.622
   29    HB2  LYS 109          1HB       LYS 109  -1.247   8.929  -1.067
   30    HB3  LYS 109          2HB       LYS 109  -2.410   7.741  -1.664
   31    HG2  LYS 109          1HG       LYS 109  -4.271   9.254  -0.795
   32    HG3  LYS 109          2HG       LYS 109  -3.026  10.511  -0.614
   33    HD2  LYS 109          1HD       LYS 109  -2.388  10.115  -3.026
   34    HD3  LYS 109          2HD       LYS 109  -3.725   8.955  -3.147
   35    HE2  LYS 109          1HE       LYS 109  -5.344  10.757  -2.617
   36    HE3  LYS 109          2HE       LYS 109  -4.024  11.910  -2.449
   37    HZ1  LYS 109          1HZ       LYS 109  -5.053  12.012  -4.671
   38    HZ2  LYS 109          2HZ       LYS 109  -4.664  10.450  -4.974
   39    HZ3  LYS 109          3HZ       LYS 109  -3.488  11.569  -4.797
   40    H    LYS 110           H        LYS 110  -1.548   6.520   2.542
   41    HA   LYS 110           HA       LYS 110  -0.313   4.267   1.075
   42    HB2  LYS 110          1HB       LYS 110   1.362   6.129   1.170
   43    HB3  LYS 110          2HB       LYS 110   1.297   6.067   2.929
   44    HG2  LYS 110          1HG       LYS 110   2.191   3.751   2.888
   45    HG3  LYS 110          2HG       LYS 110   2.161   3.767   1.112
   46    HD2  LYS 110          1HD       LYS 110   3.751   5.679   1.098
   47    HD3  LYS 110          2HD       LYS 110   3.795   5.651   2.874
   48    HE2  LYS 110          1HE       LYS 110   4.680   3.332   2.799
   49    HE3  LYS 110          2HE       LYS 110   4.666   3.380   1.026
   50    HZ1  LYS 110          1HZ       LYS 110   6.241   5.184   2.783
   51    HZ2  LYS 110          2HZ       LYS 110   6.289   5.190   1.138
   52    HZ3  LYS 110          3HZ       LYS 110   6.865   3.909   1.988
   53    H    ILE 111           H        ILE 111  -0.430   2.403   2.128
   54    HA   ILE 111           HA       ILE 111  -1.195   2.414   5.025
   55    HB   ILE 111           HB       ILE 111  -2.291   0.336   4.792
   56   HG12  ILE 111          1HG1      ILE 111  -1.293   0.270   1.945
   57   HG13  ILE 111          2HG1      ILE 111  -0.924  -0.849   3.240
   58   HG21  ILE 111          1HG2      ILE 111  -3.519   2.396   4.266
   59   HG22  ILE 111          2HG2      ILE 111  -3.263   2.105   2.522
   60   HG23  ILE 111          3HG2      ILE 111  -4.217   0.968   3.505
   61   HD11  ILE 111          1HD1      ILE 111  -3.290  -1.622   3.264
   62   HD12  ILE 111          2HD1      ILE 111  -3.609  -0.584   1.852
   63   HD13  ILE 111          3HD1      ILE 111  -2.454  -1.919   1.727
   64    H    PHE 112           H        PHE 112  -0.377   0.965   6.330
   65    HA   PHE 112           HA       PHE 112   2.234  -0.362   5.807
   66    HB2  PHE 112          1HB       PHE 112   1.979   1.189   7.751
   67    HB3  PHE 112          2HB       PHE 112   0.595   0.277   8.309
   68    HD1  PHE 112          1HD       PHE 112   0.922  -2.079   9.244
   69    HD2  PHE 112          2HD       PHE 112   4.202   0.482   8.147
   70    HE1  PHE 112          1HE       PHE 112   2.481  -3.491  10.573
   71    HE2  PHE 112          2HE       PHE 112   5.744  -0.888   9.453
   72    HZ   PHE 112           HZ       PHE 112   4.899  -2.903  10.694
   73    H    VAL 113           H        VAL 113   2.206  -2.599   5.695
   74    HA   VAL 113           HA       VAL 113  -0.261  -4.077   6.477
   75    HB   VAL 113           HB       VAL 113   1.442  -4.796   4.085
   76   HG11  VAL 113          1HG1      VAL 113  -1.234  -5.835   5.115
   77   HG12  VAL 113          2HG1      VAL 113  -0.441  -6.330   3.600
   78   HG13  VAL 113          3HG1      VAL 113   0.314  -6.704   5.152
   79   HG21  VAL 113          1HG2      VAL 113  -0.574  -4.104   2.750
   80   HG22  VAL 113          2HG2      VAL 113  -1.217  -3.328   4.218
   81   HG23  VAL 113          3HG2      VAL 113   0.313  -2.774   3.494
   82    H    GLY 114           H        GLY 114   0.122  -5.386   8.104
   83    HA2  GLY 114          1HA       GLY 114   2.921  -6.359   8.608
   84    HA3  GLY 114          2HA       GLY 114   1.767  -5.915   9.850
   85    H    GLY 115           H        GLY 115   3.301  -8.392   9.357
   86    HA2  GLY 115          1HA       GLY 115   2.899 -10.577  10.022
   87    HA3  GLY 115          2HA       GLY 115   1.159 -10.368   9.805
   88    H    LEU 116           H        LEU 116   3.342  -9.482   7.197
   89    HA   LEU 116           HA       LEU 116   1.988 -11.216   5.300
   90    HB2  LEU 116          1HB       LEU 116   4.381  -9.354   5.215
   91    HB3  LEU 116          2HB       LEU 116   3.994 -10.366   3.829
   92    HG   LEU 116           HG       LEU 116   1.879  -8.549   5.027
   93   HD11  LEU 116          1HD1      LEU 116   3.803  -7.111   4.518
   94   HD12  LEU 116          2HD1      LEU 116   2.519  -6.863   3.325
   95   HD13  LEU 116          3HD1      LEU 116   3.941  -7.837   2.901
   96   HD21  LEU 116          1HD2      LEU 116   1.236 -10.314   3.316
   97   HD22  LEU 116          2HD2      LEU 116   2.365  -9.558   2.183
   98   HD23  LEU 116          3HD2      LEU 116   0.955  -8.651   2.770
   99    H    SER 117           H        SER 117   2.537 -13.181   4.501
  100    HA   SER 117           HA       SER 117   4.525 -14.809   5.783
  101    HB2  SER 117          1HB       SER 117   2.595 -15.871   4.790
  102    HB3  SER 117          2HB       SER 117   2.993 -15.196   3.200
  103    HG   SER 117           HG       SER 117   4.215 -17.304   4.603
  104    H    VAL 118           H        VAL 118   6.594 -15.417   5.166
  105    HA   VAL 118           HA       VAL 118   8.108 -13.795   3.317
  106    HB   VAL 118           HB       VAL 118   9.953 -15.260   3.664
  107   HG11  VAL 118          1HG1      VAL 118   8.489 -14.938   6.307
  108   HG12  VAL 118          2HG1      VAL 118  10.234 -15.080   6.055
  109   HG13  VAL 118          3HG1      VAL 118   9.373 -13.649   5.464
  110   HG21  VAL 118          1HG2      VAL 118   9.816 -17.297   5.045
  111   HG22  VAL 118          2HG2      VAL 118   8.048 -17.151   5.104
  112   HG23  VAL 118          3HG2      VAL 118   8.874 -17.465   3.560
  113    H    ASN 119           H        ASN 119   5.948 -16.397   2.676
  114    HA   ASN 119           HA       ASN 119   7.112 -17.171   0.098
  115    HB2  ASN 119          1HB       ASN 119   5.654 -18.677   1.430
  116    HB3  ASN 119          2HB       ASN 119   4.327 -17.518   1.299
  117   HD21  ASN 119          1HD2      ASN 119   6.395 -19.736  -0.594
  118   HD22  ASN 119          2HD2      ASN 119   5.237 -19.894  -1.907
  119    H    THR 120           H        THR 120   4.904 -14.672   1.281
  120    HA   THR 120           HA       THR 120   3.792 -13.946  -1.262
  121    HB   THR 120           HB       THR 120   3.862 -12.371   1.319
  122    HG1  THR 120          1HG       THR 120   1.963 -13.401   1.763
  123   HG21  THR 120          1HG2      THR 120   1.791 -11.341   0.531
  124   HG22  THR 120          2HG2      THR 120   1.918 -12.218  -1.009
  125   HG23  THR 120          3HG2      THR 120   3.123 -10.990  -0.574
  126    H    THR 121           H        THR 121   4.511 -12.766  -2.824
  127    HA   THR 121           HA       THR 121   6.955 -11.177  -2.513
  128    HB   THR 121           HB       THR 121   7.311 -11.187  -4.727
  129    HG1  THR 121          1HG       THR 121   5.625 -11.623  -6.243
  130   HG21  THR 121          1HG2      THR 121   7.265 -13.543  -3.885
  131   HG22  THR 121          2HG2      THR 121   6.962 -13.385  -5.626
  132   HG23  THR 121          3HG2      THR 121   5.606 -13.695  -4.516
  133    H    VAL 122           H        VAL 122   7.200  -9.084  -3.668
  134    HA   VAL 122           HA       VAL 122   5.273  -7.165  -2.708
  135    HB   VAL 122           HB       VAL 122   7.730  -6.772  -3.071
  136   HG11  VAL 122          1HG1      VAL 122   6.912  -6.217  -5.962
  137   HG12  VAL 122          2HG1      VAL 122   8.503  -5.965  -5.227
  138   HG13  VAL 122          3HG1      VAL 122   7.886  -7.611  -5.439
  139   HG21  VAL 122          1HG2      VAL 122   7.422  -4.425  -3.626
  140   HG22  VAL 122          2HG2      VAL 122   5.806  -4.751  -4.274
  141   HG23  VAL 122          3HG2      VAL 122   6.130  -4.987  -2.542
  142    H    GLU 123           H        GLU 123   5.573  -8.879  -5.754
  143    HA   GLU 123           HA       GLU 123   3.584  -7.278  -7.180
  144    HB2  GLU 123          1HB       GLU 123   4.694 -10.057  -7.746
  145    HB3  GLU 123          2HB       GLU 123   3.692  -9.121  -8.843
  146    HG2  GLU 123          1HG       GLU 123   6.475  -8.323  -7.866
  147    HG3  GLU 123          2HG       GLU 123   6.111  -9.080  -9.404
  148    H    ASP 124           H        ASP 124   3.554 -10.294  -5.234
  149    HA   ASP 124           HA       ASP 124   0.773 -10.906  -5.572
  150    HB2  ASP 124          1HB       ASP 124   2.535 -11.311  -3.135
  151    HB3  ASP 124          2HB       ASP 124   0.911 -11.941  -3.319
  152    H    VAL 125           H        VAL 125   2.395  -8.852  -3.106
  153    HA   VAL 125           HA       VAL 125   0.025  -7.975  -1.777
  154    HB   VAL 125           HB       VAL 125   2.753  -6.667  -2.124
  155   HG11  VAL 125          1HG1      VAL 125   0.522  -5.844  -0.229
  156   HG12  VAL 125          2HG1      VAL 125   2.189  -5.235  -0.199
  157   HG13  VAL 125          3HG1      VAL 125   1.157  -4.881  -1.585
  158   HG21  VAL 125          1HG2      VAL 125   1.435  -8.200   0.167
  159   HG22  VAL 125          2HG2      VAL 125   2.772  -8.769  -0.848
  160   HG23  VAL 125          3HG2      VAL 125   3.020  -7.411   0.252
  161    H    LYS 126           H        LYS 126   1.808  -6.427  -4.520
  162    HA   LYS 126           HA       LYS 126   0.042  -4.236  -4.853
  163    HB2  LYS 126          1HB       LYS 126   2.278  -4.435  -5.854
  164    HB3  LYS 126          2HB       LYS 126   1.709  -5.708  -6.938
  165    HG2  LYS 126          1HG       LYS 126   0.236  -4.160  -8.092
  166    HG3  LYS 126          2HG       LYS 126   0.560  -2.885  -6.898
  167    HD2  LYS 126          1HD       LYS 126   2.967  -2.910  -7.543
  168    HD3  LYS 126          2HD       LYS 126   2.621  -4.111  -8.789
  169    HE2  LYS 126          1HE       LYS 126   1.443  -1.293  -8.653
  170    HE3  LYS 126          2HE       LYS 126   2.828  -1.772  -9.639
  171    HZ1  LYS 126          1HZ       LYS 126   0.871  -1.812 -10.995
  172    HZ2  LYS 126          2HZ       LYS 126   0.032  -2.740  -9.956
  173    HZ3  LYS 126          3HZ       LYS 126   1.311  -3.370 -10.778
  174    H    HIS 127           H        HIS 127  -0.111  -7.430  -6.522
  175    HA   HIS 127           HA       HIS 127  -2.497  -6.963  -7.974
  176    HB2  HIS 127          1HB       HIS 127  -0.814  -8.795  -8.281
  177    HB3  HIS 127          2HB       HIS 127  -1.436  -9.581  -6.831
  178    HD2  HIS 127          2HD       HIS 127  -1.951  -9.269 -10.501
  179    HE1  HIS 127          1HE       HIS 127  -5.352 -11.449  -9.112
  180    HE2  HIS 127          2HE       HIS 127  -4.058 -10.723 -11.185
  181    H    TYR 128           H        TYR 128  -2.129  -8.447  -4.691
  182    HA   TYR 128           HA       TYR 128  -4.918  -8.801  -4.331
  183    HB2  TYR 128          1HB       TYR 128  -2.554  -9.035  -2.540
  184    HB3  TYR 128          2HB       TYR 128  -4.147  -8.975  -1.851
  185    HD1  TYR 128          1HD       TYR 128  -2.351 -10.832  -4.633
  186    HD2  TYR 128          2HD       TYR 128  -5.299 -10.953  -1.487
  187    HE1  TYR 128          1HE       TYR 128  -2.557 -13.282  -4.927
  188    HE2  TYR 128          2HE       TYR 128  -5.513 -13.413  -1.791
  189    HH   TYR 128           HH       TYR 128  -3.582 -15.208  -4.222
  190    H    PHE 129           H        PHE 129  -3.124  -5.861  -3.850
  191    HA   PHE 129           HA       PHE 129  -5.497  -4.720  -2.519
  192    HB2  PHE 129          1HB       PHE 129  -2.736  -3.620  -2.811
  193    HB3  PHE 129          2HB       PHE 129  -4.109  -2.649  -2.284
  194    HD1  PHE 129          1HD       PHE 129  -5.602  -3.639  -0.324
  195    HD2  PHE 129          2HD       PHE 129  -1.566  -4.873  -1.175
  196    HE1  PHE 129          1HE       PHE 129  -5.449  -4.716   1.912
  197    HE2  PHE 129          2HE       PHE 129  -1.411  -5.926   1.065
  198    HZ   PHE 129           HZ       PHE 129  -3.368  -5.901   2.581
  199    H    GLU 130           H        GLU 130  -4.225  -4.702  -5.717
  200    HA   GLU 130           HA       GLU 130  -5.578  -2.412  -6.709
  201    HB2  GLU 130          1HB       GLU 130  -4.577  -4.969  -7.952
  202    HB3  GLU 130          2HB       GLU 130  -5.483  -3.799  -8.923
  203    HG2  GLU 130          1HG       GLU 130  -3.923  -2.029  -8.454
  204    HG3  GLU 130          2HG       GLU 130  -3.036  -3.022  -7.305
  205    H    GLN 131           H        GLN 131  -7.025  -5.426  -5.728
  206    HA   GLN 131           HA       GLN 131  -9.393  -5.310  -7.328
  207    HB2  GLN 131          1HB       GLN 131 -10.366  -6.816  -5.730
  208    HB3  GLN 131          2HB       GLN 131  -8.696  -7.293  -6.044
  209    HG2  GLN 131          1HG       GLN 131  -8.026  -6.203  -3.883
  210    HG3  GLN 131          2HG       GLN 131  -9.722  -5.839  -3.565
  211   HE21  GLN 131          1HE2      GLN 131  -7.449  -7.903  -2.552
  212   HE22  GLN 131          2HE2      GLN 131  -8.458  -9.324  -2.263
  213    H    PHE 132           H        PHE 132  -8.486  -3.491  -4.432
  214    HA   PHE 132           HA       PHE 132 -11.206  -2.541  -3.913
  215    HB2  PHE 132          1HB       PHE 132  -8.512  -1.740  -2.739
  216    HB3  PHE 132          2HB       PHE 132 -10.084  -1.255  -2.125
  217    HD1  PHE 132          1HD       PHE 132 -11.787  -3.303  -1.656
  218    HD2  PHE 132          2HD       PHE 132  -7.500  -3.651  -1.845
  219    HE1  PHE 132          1HE       PHE 132 -11.898  -5.438  -0.391
  220    HE2  PHE 132          2HE       PHE 132  -7.604  -5.747  -0.532
  221    HZ   PHE 132           HZ       PHE 132  -9.807  -6.660   0.186
  222    H    GLY 133           H        GLY 133  -8.468  -1.386  -5.697
  223    HA2  GLY 133          1HA       GLY 133  -9.567   0.543  -7.295
  224    HA3  GLY 133          2HA       GLY 133  -9.175   1.424  -5.814
  225    H    LYS 134           H        LYS 134  -7.809   2.329  -7.888
  226    HA   LYS 134           HA       LYS 134  -5.577   0.791  -8.734
  227    HB2  LYS 134          1HB       LYS 134  -6.531   2.549 -10.111
  228    HB3  LYS 134          2HB       LYS 134  -6.079   3.772  -8.934
  229    HG2  LYS 134          1HG       LYS 134  -4.543   3.823 -10.783
  230    HG3  LYS 134          2HG       LYS 134  -3.669   3.306  -9.352
  231    HD2  LYS 134          1HD       LYS 134  -3.646   0.984 -10.152
  232    HD3  LYS 134          2HD       LYS 134  -4.784   1.379 -11.442
  233    HE2  LYS 134          1HE       LYS 134  -2.513   1.120 -12.305
  234    HE3  LYS 134          2HE       LYS 134  -3.135   2.745 -12.587
  235    HZ1  LYS 134          1HZ       LYS 134  -0.805   2.674 -11.752
  236    HZ2  LYS 134          2HZ       LYS 134  -1.326   2.065 -10.320
  237    HZ3  LYS 134          3HZ       LYS 134  -1.778   3.564 -10.793
  238    H    VAL 135           H        VAL 135  -3.626   0.577  -8.160
  239    HA   VAL 135           HA       VAL 135  -2.570   1.730  -5.601
  240    HB   VAL 135           HB       VAL 135  -2.025  -0.856  -7.098
  241   HG11  VAL 135          1HG1      VAL 135  -0.501   0.244  -4.713
  242   HG12  VAL 135          2HG1      VAL 135  -0.435  -1.434  -5.271
  243   HG13  VAL 135          3HG1      VAL 135   0.157  -0.142  -6.318
  244   HG21  VAL 135          1HG2      VAL 135  -2.785  -1.894  -4.996
  245   HG22  VAL 135          2HG2      VAL 135  -2.997  -0.289  -4.260
  246   HG23  VAL 135          3HG2      VAL 135  -4.029  -0.793  -5.612
  247    H    ASP 136           H        ASP 136  -0.764   2.914  -5.668
  248    HA   ASP 136           HA       ASP 136   0.346   3.750  -8.271
  249    HB2  ASP 136          1HB       ASP 136  -0.203   5.519  -6.800
  250    HB3  ASP 136          2HB       ASP 136   0.627   4.759  -5.446
  251    H    ASP 137           H        ASP 137   1.535   2.173  -5.281
  252    HA   ASP 137           HA       ASP 137   3.612   0.728  -6.717
  253    HB2  ASP 137          1HB       ASP 137   4.541   3.125  -6.332
  254    HB3  ASP 137          2HB       ASP 137   4.479   2.769  -4.609
  255    H    ALA 138           H        ALA 138   4.831  -0.671  -5.170
  256    HA   ALA 138           HA       ALA 138   3.740  -1.006  -2.454
  257    HB1  ALA 138          1HB       ALA 138   3.367  -3.416  -2.748
  258    HB2  ALA 138          2HB       ALA 138   2.336  -2.496  -3.861
  259    HB3  ALA 138          3HB       ALA 138   3.808  -3.296  -4.462
  260    H    MET 139           H        MET 139   5.148  -2.161  -1.035
  261    HA   MET 139           HA       MET 139   7.827  -2.987  -1.950
  262    HB2  MET 139          1HB       MET 139   9.005  -1.368  -0.528
  263    HB3  MET 139          2HB       MET 139   8.114  -0.589  -1.836
  264    HG2  MET 139          1HG       MET 139   6.241  -0.141  -0.191
  265    HG3  MET 139          2HG       MET 139   7.309  -0.712   1.092
  266    HE1  MET 139          1HE       MET 139  10.091   2.013   1.188
  267    HE2  MET 139          2HE       MET 139   9.420   0.527   1.906
  268    HE3  MET 139          3HE       MET 139  10.151   0.484   0.287
  269    H    LEU 140           H        LEU 140   9.048  -4.113  -0.388
  270    HA   LEU 140           HA       LEU 140   7.662  -4.878   2.154
  271    HB2  LEU 140          1HB       LEU 140   9.442  -6.641   0.435
  272    HB3  LEU 140          2HB       LEU 140   8.684  -7.095   1.960
  273    HG   LEU 140           HG       LEU 140   7.154  -6.433  -0.601
  274   HD11  LEU 140          1HD1      LEU 140   7.817  -9.091   0.715
  275   HD12  LEU 140          2HD1      LEU 140   8.457  -8.496  -0.834
  276   HD13  LEU 140          3HD1      LEU 140   6.730  -8.871  -0.662
  277   HD21  LEU 140          1HD2      LEU 140   5.268  -7.515   0.604
  278   HD22  LEU 140          2HD2      LEU 140   5.782  -6.015   1.382
  279   HD23  LEU 140          3HD2      LEU 140   6.261  -7.585   2.077
  280    H    MET 141           H        MET 141   8.958  -5.022   4.007
  281    HA   MET 141           HA       MET 141  11.585  -3.638   3.760
  282    HB2  MET 141          1HB       MET 141  10.063  -4.247   6.304
  283    HB3  MET 141          2HB       MET 141  11.424  -3.149   6.077
  284    HG2  MET 141          1HG       MET 141   8.536  -2.806   5.346
  285    HG3  MET 141          2HG       MET 141   9.600  -1.729   6.234
  286    HE1  MET 141          1HE       MET 141  11.597   0.103   3.513
  287    HE2  MET 141          2HE       MET 141  11.730  -0.732   5.080
  288    HE3  MET 141          3HE       MET 141  12.105  -1.594   3.579
  289    H    PHE 142           H        PHE 142  13.483  -4.651   4.041
  290    HA   PHE 142           HA       PHE 142  13.290  -7.505   4.274
  291    HB2  PHE 142          1HB       PHE 142  15.381  -5.790   3.115
  292    HB3  PHE 142          2HB       PHE 142  15.729  -7.465   3.519
  293    HD1  PHE 142          1HD       PHE 142  14.716  -9.325   2.331
  294    HD2  PHE 142          2HD       PHE 142  13.543  -5.270   1.448
  295    HE1  PHE 142          1HE       PHE 142  13.475 -10.118   0.334
  296    HE2  PHE 142          2HE       PHE 142  12.300  -6.066  -0.544
  297    HZ   PHE 142           HZ       PHE 142  12.261  -8.492  -1.105
  298    H    ASP 143           H        ASP 143  14.376  -9.075   5.339
  299    HA   ASP 143           HA       ASP 143  15.520  -8.261   7.990
  300    HB2  ASP 143          1HB       ASP 143  13.678  -9.889   8.103
  301    HB3  ASP 143          2HB       ASP 143  14.520 -10.940   6.966
  302    H    LYS 144           H        LYS 144  15.992 -10.513   5.286
  303    HA   LYS 144           HA       LYS 144  18.893  -9.868   5.110
  304    HB2  LYS 144          1HB       LYS 144  17.665 -12.661   5.060
  305    HB3  LYS 144          2HB       LYS 144  19.313 -12.304   4.564
  306    HG2  LYS 144          1HG       LYS 144  18.155 -11.938   7.366
  307    HG3  LYS 144          2HG       LYS 144  19.142 -13.286   6.833
  308    HD2  LYS 144          1HD       LYS 144  20.087 -10.389   6.992
  309    HD3  LYS 144          2HD       LYS 144  20.416 -11.662   8.169
  310    HE2  LYS 144          1HE       LYS 144  21.581 -12.987   6.402
  311    HE3  LYS 144          2HE       LYS 144  21.305 -11.674   5.250
  312    HZ1  LYS 144          1HZ       LYS 144  22.631 -10.219   6.695
  313    HZ2  LYS 144          2HZ       LYS 144  23.510 -11.519   6.248
  314    HZ3  LYS 144          3HZ       LYS 144  22.889 -11.438   7.753
  315    H    THR 145           H        THR 145  18.893  -8.776   3.222
  316    HA   THR 145           HA       THR 145  16.842  -8.813   1.400
  317    HB   THR 145           HB       THR 145  19.472  -7.893   0.378
  318    HG1  THR 145          1HG       THR 145  19.385  -6.113   1.735
  319   HG21  THR 145          1HG2      THR 145  18.153  -5.914  -0.249
  320   HG22  THR 145          2HG2      THR 145  16.728  -6.573   0.585
  321   HG23  THR 145          3HG2      THR 145  17.375  -7.381  -0.858
  322    H    THR 146           H        THR 146  19.579 -10.908   1.265
  323    HA   THR 146           HA       THR 146  18.960 -11.917  -1.407
  324    HB   THR 146           HB       THR 146  20.823 -13.299  -1.250
  325    HG1  THR 146          1HG       THR 146  21.875 -13.711   0.681
  326   HG21  THR 146          1HG2      THR 146  22.672 -11.871  -0.669
  327   HG22  THR 146          2HG2      THR 146  21.668 -10.871   0.398
  328   HG23  THR 146          3HG2      THR 146  21.405 -10.847  -1.362
  329    H    ASN 147           H        ASN 147  17.461 -12.475   1.541
  330    HA   ASN 147           HA       ASN 147  16.669 -15.247   0.730
  331    HB2  ASN 147          1HB       ASN 147  18.509 -15.353   2.339
  332    HB3  ASN 147          2HB       ASN 147  17.609 -14.349   3.472
  333   HD21  ASN 147          1HD2      ASN 147  17.713 -17.547   1.910
  334   HD22  ASN 147          2HD2      ASN 147  16.667 -18.309   3.099
  335    H    ARG 148           H        ARG 148  15.650 -12.607   3.070
  336    HA   ARG 148           HA       ARG 148  12.842 -13.203   2.451
  337    HB2  ARG 148          1HB       ARG 148  12.203 -13.988   4.654
  338    HB3  ARG 148          2HB       ARG 148  13.439 -15.057   3.998
  339    HG2  ARG 148          1HG       ARG 148  15.162 -13.760   5.371
  340    HG3  ARG 148          2HG       ARG 148  13.801 -12.892   6.103
  341    HD2  ARG 148          1HD       ARG 148  12.875 -15.057   6.908
  342    HD3  ARG 148          2HD       ARG 148  14.301 -15.879   6.241
  343    HE   ARG 148           HE       ARG 148  14.646 -13.621   8.186
  344   HH11  ARG 148          1HH1      ARG 148  15.156 -17.065   7.675
  345   HH12  ARG 148          2HH1      ARG 148  16.221 -17.157   9.054
  346   HH21  ARG 148          1HH2      ARG 148  15.923 -13.767   9.740
  347   HH22  ARG 148          2HH2      ARG 148  16.662 -15.288  10.255
  348    H    HIS 149           H        HIS 149  11.348 -11.811   3.293
  349    HA   HIS 149           HA       HIS 149  12.351  -9.219   4.260
  350    HB2  HIS 149          1HB       HIS 149  10.234  -8.319   3.707
  351    HB3  HIS 149          2HB       HIS 149  10.761  -9.316   2.367
  352    HD2  HIS 149          2HD       HIS 149   9.093 -11.209   1.595
  353    HE1  HIS 149          1HE       HIS 149   6.196 -10.738   4.674
  354    HE2  HIS 149          2HE       HIS 149   6.697 -11.896   2.473
  355    H    ARG 150           H        ARG 150  11.173  -8.111   6.059
  356    HA   ARG 150           HA       ARG 150  11.382  -9.768   8.435
  357    HB2  ARG 150          1HB       ARG 150  12.630  -7.728   8.183
  358    HB3  ARG 150          2HB       ARG 150  11.179  -6.790   7.838
  359    HG2  ARG 150          1HG       ARG 150  10.439  -6.849  10.011
  360    HG3  ARG 150          2HG       ARG 150  11.513  -8.186  10.482
  361    HD2  ARG 150          1HD       ARG 150  13.380  -6.836  10.704
  362    HD3  ARG 150          2HD       ARG 150  12.816  -5.678   9.510
  363    HE   ARG 150           HE       ARG 150  12.435  -4.379  11.315
  364   HH11  ARG 150          1HH1      ARG 150  10.675  -7.344  12.206
  365   HH12  ARG 150          2HH1      ARG 150   9.678  -6.358  13.279
  366   HH21  ARG 150          1HH2      ARG 150  11.214  -3.435  12.861
  367   HH22  ARG 150          2HH2      ARG 150   9.993  -4.446  13.641
  368    H    GLY 151           H        GLY 151   8.818  -9.617   6.546
  369    HA2  GLY 151          1HA       GLY 151   6.742 -10.513   7.072
  370    HA3  GLY 151          2HA       GLY 151   6.989 -10.164   8.778
  371    H    PHE 152           H        PHE 152   7.509  -7.414   6.688
  372    HA   PHE 152           HA       PHE 152   4.702  -6.624   6.635
  373    HB2  PHE 152          1HB       PHE 152   4.841  -4.699   8.007
  374    HB3  PHE 152          2HB       PHE 152   5.496  -5.994   8.970
  375    HD1  PHE 152          1HD       PHE 152   8.087  -6.154   9.198
  376    HD2  PHE 152          2HD       PHE 152   6.046  -2.728   7.556
  377    HE1  PHE 152          1HE       PHE 152  10.095  -4.729   9.608
  378    HE2  PHE 152          2HE       PHE 152   8.026  -1.314   8.037
  379    HZ   PHE 152           HZ       PHE 152  10.066  -2.341   9.036
  380    H    GLY 153           H        GLY 153   4.414  -4.566   5.513
  381    HA2  GLY 153          1HA       GLY 153   6.607  -3.330   4.023
  382    HA3  GLY 153          2HA       GLY 153   5.553  -4.353   3.040
  383    H    PHE 154           H        PHE 154   5.365  -2.145   2.014
  384    HA   PHE 154           HA       PHE 154   3.003  -0.718   3.128
  385    HB2  PHE 154          1HB       PHE 154   5.418   0.579   1.843
  386    HB3  PHE 154          2HB       PHE 154   3.919   1.384   2.252
  387    HD1  PHE 154          1HD       PHE 154   3.417   2.075   4.505
  388    HD2  PHE 154          2HD       PHE 154   6.928  -0.280   3.658
  389    HE1  PHE 154          1HE       PHE 154   4.306   2.578   6.764
  390    HE2  PHE 154          2HE       PHE 154   7.766   0.144   5.937
  391    HZ   PHE 154           HZ       PHE 154   6.481   1.597   7.498
  392    H    VAL 155           H        VAL 155   1.599   0.311   1.721
  393    HA   VAL 155           HA       VAL 155   1.963  -0.106  -1.186
  394    HB   VAL 155           HB       VAL 155  -0.737  -0.677   0.025
  395   HG11  VAL 155          1HG1      VAL 155  -1.165  -1.699  -2.174
  396   HG12  VAL 155          2HG1      VAL 155  -0.755   0.009  -2.325
  397   HG13  VAL 155          3HG1      VAL 155   0.463  -1.229  -2.713
  398   HG21  VAL 155          1HG2      VAL 155  -0.309  -3.065  -0.436
  399   HG22  VAL 155          2HG2      VAL 155   1.398  -2.682  -0.750
  400   HG23  VAL 155          3HG2      VAL 155   0.694  -2.445   0.869
  401    H    THR 156           H        THR 156   1.565   1.594  -2.369
  402    HA   THR 156           HA       THR 156   0.302   3.974  -1.134
  403    HB   THR 156           HB       THR 156   2.045   4.171  -3.556
  404    HG1  THR 156          1HG       THR 156   3.328   3.182  -2.067
  405   HG21  THR 156          1HG2      THR 156   0.769   6.192  -2.932
  406   HG22  THR 156          2HG2      THR 156   2.496   6.418  -2.636
  407   HG23  THR 156          3HG2      THR 156   1.408   6.092  -1.273
  408    H    PHE 157           H        PHE 157  -1.255   5.260  -2.241
  409    HA   PHE 157           HA       PHE 157  -2.742   3.705  -4.286
  410    HB2  PHE 157          1HB       PHE 157  -3.703   5.063  -1.788
  411    HB3  PHE 157          2HB       PHE 157  -4.780   4.597  -3.091
  412    HD1  PHE 157          1HD       PHE 157  -5.506   2.339  -3.396
  413    HD2  PHE 157          2HD       PHE 157  -2.367   3.232  -0.589
  414    HE1  PHE 157          1HE       PHE 157  -5.627   0.017  -2.523
  415    HE2  PHE 157          2HE       PHE 157  -2.480   0.920   0.263
  416    HZ   PHE 157           HZ       PHE 157  -4.103  -0.702  -0.693
  417    H    GLU 158           H        GLU 158  -4.184   4.660  -5.685
  418    HA   GLU 158           HA       GLU 158  -3.400   7.227  -6.788
  419    HB2  GLU 158          1HB       GLU 158  -4.321   5.417  -8.158
  420    HB3  GLU 158          2HB       GLU 158  -5.812   5.436  -7.222
  421    HG2  GLU 158          1HG       GLU 158  -6.219   6.471  -9.327
  422    HG3  GLU 158          2HG       GLU 158  -6.369   7.682  -8.068
  423    H    SER 159           H        SER 159  -5.956   6.218  -4.535
  424    HA   SER 159           HA       SER 159  -6.519   9.066  -3.891
  425    HB2  SER 159          1HB       SER 159  -8.244   8.394  -5.485
  426    HB3  SER 159          2HB       SER 159  -8.643   6.981  -4.484
  427    HG   SER 159           HG       SER 159  -9.952   8.973  -4.188
  428    H    GLU 160           H        GLU 160  -7.077   9.477  -1.781
  429    HA   GLU 160           HA       GLU 160  -6.392   7.469   0.208
  430    HB2  GLU 160          1HB       GLU 160  -6.238  10.147   0.285
  431    HB3  GLU 160          2HB       GLU 160  -7.884   9.978   0.921
  432    HG2  GLU 160          1HG       GLU 160  -6.840   8.203   2.527
  433    HG3  GLU 160          2HG       GLU 160  -5.279   8.821   1.985
  434    H    ASP 161           H        ASP 161  -9.326   8.321  -1.495
  435    HA   ASP 161           HA       ASP 161 -11.211   7.196   0.374
  436    HB2  ASP 161          1HB       ASP 161 -11.331   7.566  -2.626
  437    HB3  ASP 161          2HB       ASP 161 -12.629   6.844  -1.691
  438    H    ILE 162           H        ILE 162  -9.008   5.654  -1.902
  439    HA   ILE 162           HA       ILE 162 -10.193   2.993  -1.494
  440    HB   ILE 162           HB       ILE 162  -7.382   3.572  -2.466
  441   HG12  ILE 162          1HG1      ILE 162  -8.674   4.769  -4.022
  442   HG13  ILE 162          2HG1      ILE 162  -8.243   3.228  -4.748
  443   HG21  ILE 162          1HG2      ILE 162  -7.718   1.338  -3.589
  444   HG22  ILE 162          2HG2      ILE 162  -7.736   1.267  -1.830
  445   HG23  ILE 162          3HG2      ILE 162  -9.263   1.182  -2.727
  446   HD11  ILE 162          1HD1      ILE 162 -10.578   2.391  -4.192
  447   HD12  ILE 162          2HD1      ILE 162 -10.980   4.033  -3.658
  448   HD13  ILE 162          3HD1      ILE 162 -10.533   3.740  -5.346
  449    H    VAL 163           H        VAL 163  -7.431   4.878  -0.162
  450    HA   VAL 163           HA       VAL 163  -6.412   2.863   1.544
  451    HB   VAL 163           HB       VAL 163  -6.517   5.889   1.937
  452   HG11  VAL 163          1HG1      VAL 163  -4.967   3.843   3.531
  453   HG12  VAL 163          2HG1      VAL 163  -4.653   5.591   3.556
  454   HG13  VAL 163          3HG1      VAL 163  -6.191   4.960   4.149
  455   HG21  VAL 163          1HG2      VAL 163  -4.136   5.703   1.275
  456   HG22  VAL 163          2HG2      VAL 163  -4.372   3.978   0.962
  457   HG23  VAL 163          3HG2      VAL 163  -5.249   5.191  -0.007
  458    H    GLU 164           H        GLU 164  -9.018   5.266   2.155
  459    HA   GLU 164           HA       GLU 164  -9.788   4.341   4.752
  460    HB2  GLU 164          1HB       GLU 164 -11.368   5.681   2.529
  461    HB3  GLU 164          2HB       GLU 164 -12.049   5.352   4.114
  462    HG2  GLU 164          1HG       GLU 164  -9.577   7.072   3.622
  463    HG3  GLU 164          2HG       GLU 164 -11.214   7.688   3.801
  464    H    LYS 165           H        LYS 165 -11.067   3.301   1.535
  465    HA   LYS 165           HA       LYS 165 -12.960   1.398   2.476
  466    HB2  LYS 165          1HB       LYS 165 -12.726   2.308   0.150
  467    HB3  LYS 165          2HB       LYS 165 -11.296   1.297  -0.073
  468    HG2  LYS 165          1HG       LYS 165 -12.788  -0.725   0.455
  469    HG3  LYS 165          2HG       LYS 165 -14.164   0.379   0.352
  470    HD2  LYS 165          1HD       LYS 165 -12.142  -0.261  -1.835
  471    HD3  LYS 165          2HD       LYS 165 -13.810  -0.838  -1.747
  472    HE2  LYS 165          1HE       LYS 165 -14.617   1.516  -1.959
  473    HE3  LYS 165          2HE       LYS 165 -12.941   2.071  -2.079
  474    HZ1  LYS 165          1HZ       LYS 165 -12.711   0.685  -4.095
  475    HZ2  LYS 165          2HZ       LYS 165 -13.895   1.804  -4.281
  476    HZ3  LYS 165          3HZ       LYS 165 -14.284   0.246  -4.001
  477    H    VAL 166           H        VAL 166  -9.567   0.890   1.573
  478    HA   VAL 166           HA       VAL 166  -9.413  -1.923   2.176
  479    HB   VAL 166           HB       VAL 166  -7.227   0.184   2.062
  480   HG11  VAL 166          1HG1      VAL 166  -7.048  -2.838   1.805
  481   HG12  VAL 166          2HG1      VAL 166  -5.722  -1.701   1.524
  482   HG13  VAL 166          3HG1      VAL 166  -6.399  -1.869   3.148
  483   HG21  VAL 166          1HG2      VAL 166  -8.012  -1.760  -0.131
  484   HG22  VAL 166          2HG2      VAL 166  -8.613  -0.109  -0.101
  485   HG23  VAL 166          3HG2      VAL 166  -6.886  -0.389  -0.235
  486    H    CYS 167           H        CYS 167  -8.499   0.990   4.096
  487    HA   CYS 167           HA       CYS 167  -7.581  -0.524   6.359
  488    HB2  CYS 167          1HB       CYS 167  -6.861   1.781   5.773
  489    HB3  CYS 167          2HB       CYS 167  -8.482   2.381   6.168
  490    HG   CYS 167           HG       CYS 167  -6.363   0.756   8.149
  491    H    GLU 168           H        GLU 168 -10.878   0.768   5.608
  492    HA   GLU 168           HA       GLU 168 -12.066   0.228   8.104
  493    HB2  GLU 168          1HB       GLU 168 -13.011   1.645   6.387
  494    HB3  GLU 168          2HB       GLU 168 -13.128   0.286   5.246
  495    HG2  GLU 168          1HG       GLU 168 -14.748  -0.819   6.640
  496    HG3  GLU 168          2HG       GLU 168 -14.526   0.396   7.913
  497    H    ILE 169           H        ILE 169 -11.335  -1.963   5.389
  498    HA   ILE 169           HA       ILE 169 -12.754  -4.269   6.441
  499    HB   ILE 169           HB       ILE 169 -10.444  -3.997   4.498
  500   HG12  ILE 169          1HG1      ILE 169 -13.344  -4.758   3.906
  501   HG13  ILE 169          2HG1      ILE 169 -12.834  -3.078   3.938
  502   HG21  ILE 169          1HG2      ILE 169 -10.309  -6.236   5.424
  503   HG22  ILE 169          2HG2      ILE 169 -12.052  -6.490   5.185
  504   HG23  ILE 169          3HG2      ILE 169 -10.951  -6.345   3.799
  505   HD11  ILE 169          1HD1      ILE 169 -11.749  -5.194   2.059
  506   HD12  ILE 169          2HD1      ILE 169 -12.814  -3.836   1.661
  507   HD13  ILE 169          3HD1      ILE 169 -11.147  -3.523   2.177
  508    H    HIS 170           H        HIS 170  -9.564  -2.912   6.925
  509    HA   HIS 170           HA       HIS 170  -7.988  -3.061   8.505
  510    HB2  HIS 170          1HB       HIS 170  -9.911  -2.686   9.959
  511    HB3  HIS 170          2HB       HIS 170 -10.149  -4.416  10.137
  512    HD2  HIS 170          2HD       HIS 170  -6.504  -3.234  10.379
  513    HE1  HIS 170          1HE       HIS 170  -7.837  -3.929  14.366
  514    HE2  HIS 170          2HE       HIS 170  -5.800  -3.479  12.902
  515    H    PHE 171           H        PHE 171  -9.548  -6.281   8.631
  516    HA   PHE 171           HA       PHE 171  -6.856  -7.481   8.361
  517    HB2  PHE 171          1HB       PHE 171  -9.218  -8.576   9.795
  518    HB3  PHE 171          2HB       PHE 171  -7.983  -9.629   9.126
  519    HD1  PHE 171          1HD       PHE 171  -5.683  -9.648   9.950
  520    HD2  PHE 171          2HD       PHE 171  -8.643  -7.036  11.683
  521    HE1  PHE 171          1HE       PHE 171  -4.211  -9.288  11.918
  522    HE2  PHE 171          2HE       PHE 171  -7.163  -6.668  13.645
  523    HZ   PHE 171           HZ       PHE 171  -4.946  -7.796  13.766
  524    H    HIS 172           H        HIS 172  -6.185  -8.400   6.671
  525    HA   HIS 172           HA       HIS 172  -8.090  -9.093   4.453
  526    HB2  HIS 172          1HB       HIS 172  -5.373  -7.725   4.401
  527    HB3  HIS 172          2HB       HIS 172  -6.154  -8.386   2.972
  528    HD2  HIS 172          2HD       HIS 172  -6.807  -5.614   5.651
  529    HE1  HIS 172          1HE       HIS 172  -8.864  -4.495   2.109
  530    HE2  HIS 172          2HE       HIS 172  -8.195  -3.756   4.429
  531    H    GLU 173           H        GLU 173  -7.050 -10.613   2.826
  532    HA   GLU 173           HA       GLU 173  -5.130 -12.508   4.076
  533    HB2  GLU 173          1HB       GLU 173  -7.160 -13.613   4.369
  534    HB3  GLU 173          2HB       GLU 173  -7.764 -13.195   2.774
  535    HG2  GLU 173          1HG       GLU 173  -5.289 -14.941   3.137
  536    HG3  GLU 173          2HG       GLU 173  -6.904 -15.613   3.258
  537    H    ILE 174           H        ILE 174  -3.484 -13.160   2.879
  538    HA   ILE 174           HA       ILE 174  -3.511 -12.893  -0.064
  539    HB   ILE 174           HB       ILE 174  -1.225 -11.782   1.612
  540   HG12  ILE 174          1HG1      ILE 174  -3.379 -10.263   0.093
  541   HG13  ILE 174          2HG1      ILE 174  -3.106 -10.258   1.836
  542   HG21  ILE 174          1HG2      ILE 174  -1.736 -11.782  -1.399
  543   HG22  ILE 174          2HG2      ILE 174  -0.355 -11.021  -0.596
  544   HG23  ILE 174          3HG2      ILE 174  -0.529 -12.765  -0.546
  545   HD11  ILE 174          1HD1      ILE 174  -2.264  -8.223   1.007
  546   HD12  ILE 174          2HD1      ILE 174  -0.860  -9.215   1.439
  547   HD13  ILE 174          3HD1      ILE 174  -1.330  -9.010  -0.269
  548    H    ASN 175           H        ASN 175  -2.688 -14.724  -0.959
  549    HA   ASN 175           HA       ASN 175  -1.971 -16.873  -1.083
  550    HB2  ASN 175          1HB       ASN 175   0.343 -15.754   0.540
  551    HB3  ASN 175          2HB       ASN 175   0.365 -17.304  -0.287
  552   HD21  ASN 175          1HD2      ASN 175   1.821 -14.624  -0.609
  553   HD22  ASN 175          2HD2      ASN 175   1.868 -14.488  -2.372
  554    H    ASN 176           H        ASN 176  -3.928 -16.552   0.860
  555    HA   ASN 176           HA       ASN 176  -5.016 -17.520   2.511
  556    HB2  ASN 176          1HB       ASN 176  -3.039 -19.811   2.297
  557    HB3  ASN 176          2HB       ASN 176  -4.553 -19.842   3.184
  558   HD21  ASN 176          1HD2      ASN 176  -3.194 -20.639   0.230
  559   HD22  ASN 176          2HD2      ASN 176  -4.695 -20.726  -0.683
  560    H    LYS 177           H        LYS 177  -2.149 -16.100   3.156
  561    HA   LYS 177           HA       LYS 177  -2.273 -16.554   6.091
  562    HB2  LYS 177          1HB       LYS 177  -0.043 -16.454   5.060
  563    HB3  LYS 177          2HB       LYS 177  -0.396 -14.867   4.382
  564    HG2  LYS 177          1HG       LYS 177   1.042 -14.709   6.351
  565    HG3  LYS 177          2HG       LYS 177  -0.488 -13.876   6.624
  566    HD2  LYS 177          1HD       LYS 177  -1.308 -15.747   8.006
  567    HD3  LYS 177          2HD       LYS 177   0.081 -16.732   7.544
  568    HE2  LYS 177          1HE       LYS 177   0.340 -15.904   9.798
  569    HE3  LYS 177          2HE       LYS 177   1.594 -15.245   8.744
  570    HZ1  LYS 177          1HZ       LYS 177   0.542 -13.645  10.308
  571    HZ2  LYS 177          2HZ       LYS 177  -0.849 -13.692   9.412
  572    HZ3  LYS 177          3HZ       LYS 177   0.543 -13.156   8.745
  573    H    MET 178           H        MET 178  -3.215 -15.122   7.483
  574    HA   MET 178           HA       MET 178  -4.709 -12.852   6.369
  575    HB2  MET 178          1HB       MET 178  -5.964 -14.234   7.817
  576    HB3  MET 178          2HB       MET 178  -4.736 -14.185   9.086
  577    HG2  MET 178          1HG       MET 178  -5.212 -11.984   9.679
  578    HG3  MET 178          2HG       MET 178  -5.979 -11.604   8.138
  579    HE1  MET 178          1HE       MET 178  -8.187 -13.530   7.471
  580    HE2  MET 178          2HE       MET 178  -9.557 -12.823   8.352
  581    HE3  MET 178          3HE       MET 178  -8.377 -11.765   7.547
  582    H    VAL 179           H        VAL 179  -4.274 -10.768   6.746
  583    HA   VAL 179           HA       VAL 179  -1.874 -10.008   8.313
  584    HB   VAL 179           HB       VAL 179  -1.091  -8.552   6.524
  585   HG11  VAL 179          1HG1      VAL 179  -0.301 -10.897   6.696
  586   HG12  VAL 179          2HG1      VAL 179  -1.467 -11.365   5.434
  587   HG13  VAL 179          3HG1      VAL 179  -0.175 -10.206   5.070
  588   HG21  VAL 179          1HG2      VAL 179  -3.283  -9.731   4.771
  589   HG22  VAL 179          2HG2      VAL 179  -3.152  -8.038   5.307
  590   HG23  VAL 179          3HG2      VAL 179  -1.939  -8.717   4.217
  591    H    GLU 180           H        GLU 180  -1.745  -7.759   8.853
  592    HA   GLU 180           HA       GLU 180  -4.453  -6.486   9.163
  593    HB2  GLU 180          1HB       GLU 180  -3.093  -7.091  11.233
  594    HB3  GLU 180          2HB       GLU 180  -1.936  -5.855  10.719
  595    HG2  GLU 180          1HG       GLU 180  -3.883  -4.201  10.694
  596    HG3  GLU 180          2HG       GLU 180  -4.889  -5.471  11.390
  597    H    CYS 181           H        CYS 181  -4.884  -4.600   8.162
  598    HA   CYS 181           HA       CYS 181  -2.654  -3.015   6.954
  599    HB2  CYS 181          1HB       CYS 181  -5.564  -3.220   6.121
  600    HB3  CYS 181          2HB       CYS 181  -4.343  -2.198   5.353
  601    HG   CYS 181           HG       CYS 181  -2.860  -3.979   4.399
  602    H    LYS 182           H        LYS 182  -2.379  -0.955   7.511
  603    HA   LYS 182           HA       LYS 182  -4.421   0.640   8.954
  604    HB2  LYS 182          1HB       LYS 182  -2.943   1.068  10.863
  605    HB3  LYS 182          2HB       LYS 182  -3.309  -0.649  10.714
  606    HG2  LYS 182          1HG       LYS 182  -1.032  -0.849   9.486
  607    HG3  LYS 182          2HG       LYS 182  -0.723   0.792  10.071
  608    HD2  LYS 182          1HD       LYS 182   0.344  -0.774  11.547
  609    HD3  LYS 182          2HD       LYS 182  -1.015  -0.048  12.423
  610    HE2  LYS 182          1HE       LYS 182  -2.389  -2.027  12.041
  611    HE3  LYS 182          2HE       LYS 182  -1.180  -2.726  10.957
  612    HZ1  LYS 182          1HZ       LYS 182   0.278  -3.077  12.804
  613    HZ2  LYS 182          2HZ       LYS 182  -1.179  -3.653  13.233
  614    HZ3  LYS 182          3HZ       LYS 182  -0.677  -2.214  13.840
  615    H    LYS 183           H        LYS 183  -3.774   2.990   9.068
  616    HA   LYS 183           HA       LYS 183  -2.454   3.816   6.627
  617    HB2  LYS 183          1HB       LYS 183  -3.268   5.445   9.060
  618    HB3  LYS 183          2HB       LYS 183  -2.510   6.121   7.614
  619    HG2  LYS 183          1HG       LYS 183  -4.388   5.071   6.241
  620    HG3  LYS 183          2HG       LYS 183  -5.208   4.731   7.777
  621    HD2  LYS 183          1HD       LYS 183  -5.096   7.191   8.316
  622    HD3  LYS 183          2HD       LYS 183  -4.358   7.473   6.724
  623    HE2  LYS 183          1HE       LYS 183  -6.387   6.452   5.650
  624    HE3  LYS 183          2HE       LYS 183  -7.110   6.275   7.255
  625    HZ1  LYS 183          1HZ       LYS 183  -6.866   8.765   7.442
  626    HZ2  LYS 183          2HZ       LYS 183  -7.951   8.253   6.333
  627    HZ3  LYS 183          3HZ       LYS 183  -6.497   8.816   5.833
  628    H    ALA 184           H        ALA 184  -0.474   4.571   6.151
  629    HA   ALA 184           HA       ALA 184   1.716   3.714   7.862
  630    HB1  ALA 184          1HB       ALA 184   1.790   3.494   5.415
  631    HB2  ALA 184          2HB       ALA 184   1.686   5.260   5.238
  632    HB3  ALA 184          3HB       ALA 184   3.113   4.530   5.997
  633    H    GLN 185           H        GLN 185   2.886   4.898   9.287
  634    HA   GLN 185           HA       GLN 185   2.385   7.689   9.816
  635    HB2  GLN 185          1HB       GLN 185   4.642   5.829  10.639
  636    HB3  GLN 185          2HB       GLN 185   4.560   7.507  11.163
  637    HG2  GLN 185          1HG       GLN 185   2.371   5.447  11.664
  638    HG3  GLN 185          2HG       GLN 185   3.645   5.856  12.810
  639   HE21  GLN 185          1HE2      GLN 185   1.286   6.131  13.922
  640   HE22  GLN 185          2HE2      GLN 185   0.768   7.811  13.945
  641    HA   PRO 186           HA       PRO 186   4.227   9.519   6.502
  642    HB2  PRO 186          1HB       PRO 186   5.082  11.997   7.353
  643    HB3  PRO 186          2HB       PRO 186   3.375  11.488   7.231
  644    HG2  PRO 186          1HG       PRO 186   5.137  11.537   9.690
  645    HG3  PRO 186          2HG       PRO 186   3.446  12.099   9.522
  646    HD2  PRO 186          1HD       PRO 186   4.129   9.658  10.559
  647    HD3  PRO 186          2HD       PRO 186   2.617   9.885   9.651
  648    H    LYS 187           H        LYS 187   6.678   9.576   9.120
  649    HA   LYS 187           HA       LYS 187   8.852   9.134   7.164
  650    HB2  LYS 187          1HB       LYS 187  10.061  11.188   7.777
  651    HB3  LYS 187          2HB       LYS 187   8.556  11.505   6.937
  652    HG2  LYS 187          1HG       LYS 187   7.425  12.126   9.015
  653    HG3  LYS 187          2HG       LYS 187   8.852  11.726   9.972
  654    HD2  LYS 187          1HD       LYS 187   8.725  13.894   7.829
  655    HD3  LYS 187          2HD       LYS 187   8.550  14.163   9.570
  656    HE2  LYS 187          1HE       LYS 187  10.831  13.235   9.946
  657    HE3  LYS 187          2HE       LYS 187  11.025  13.012   8.204
  658    HZ1  LYS 187          1HZ       LYS 187  10.609  15.631   9.543
  659    HZ2  LYS 187          2HZ       LYS 187  10.783  15.421   7.931
  660    HZ3  LYS 187          3HZ       LYS 187  12.025  15.094   8.936
  661    H    GLU 188           H        GLU 188   8.193   7.317   9.011
  662    HA   GLU 188           HA       GLU 188   8.848   6.101  10.844
  663    HB2  GLU 188          1HB       GLU 188  10.875   6.041   9.339
  664    HB3  GLU 188          2HB       GLU 188  11.584   7.296  10.359
  665    HG2  GLU 188          1HG       GLU 188  11.177   5.627  12.333
  666    HG3  GLU 188          2HG       GLU 188  10.897   4.430  11.077
  667    H    VAL 189           H        VAL 189   7.452   8.141  11.608
  668    HA   VAL 189           HA       VAL 189   8.659  10.137  13.162
  669    HB   VAL 189           HB       VAL 189   6.417  10.047  11.900
  670   HG11  VAL 189          1HG1      VAL 189   5.408   8.235  13.320
  671   HG12  VAL 189          2HG1      VAL 189   5.349   9.384  14.674
  672   HG13  VAL 189          3HG1      VAL 189   4.427   9.710  13.199
  673   HG21  VAL 189          1HG2      VAL 189   6.550  11.598  14.505
  674   HG22  VAL 189          2HG2      VAL 189   7.319  12.063  12.971
  675   HG23  VAL 189          3HG2      VAL 189   5.555  11.958  13.084
  676    H    MET 190           H        MET 190   8.616   7.086  14.219
  677    HA   MET 190           HA       MET 190   7.587   7.182  16.871
  678    HB2  MET 190          1HB       MET 190   9.839   5.434  15.803
  679    HB3  MET 190          2HB       MET 190   8.841   5.126  17.227
  680    HG2  MET 190          1HG       MET 190   7.947   5.124  14.321
  681    HG3  MET 190          2HG       MET 190   8.100   3.741  15.395
  682    HE1  MET 190          1HE       MET 190   5.600   4.285  13.569
  683    HE2  MET 190          2HE       MET 190   5.750   2.891  14.665
  684    HE3  MET 190          3HE       MET 190   4.273   3.882  14.684
  685    H    SER 191           H        SER 191  10.757   8.062  15.572
  686    HA   SER 191           HA       SER 191  11.200   9.866  17.738
  687    HB2  SER 191          1HB       SER 191  12.078   7.999  18.974
  688    HB3  SER 191          2HB       SER 191  13.026   7.444  17.581
  689    HG   SER 191           HG       SER 191  14.133   8.722  19.315
  690    HA   PRO 192           HA       PRO 192  13.585  11.648  14.289
  691    HB2  PRO 192          1HB       PRO 192  14.769  13.759  15.553
  692    HB3  PRO 192          2HB       PRO 192  13.022  13.725  15.167
  693    HG2  PRO 192          1HG       PRO 192  14.355  12.990  17.799
  694    HG3  PRO 192          2HG       PRO 192  12.979  14.112  17.534
  695    HD2  PRO 192          1HD       PRO 192  12.590  11.529  18.260
  696    HD3  PRO 192          2HD       PRO 192  11.489  12.328  17.097
  697    H    THR 193           H        THR 193  14.851  10.299  17.210
  698    HA   THR 193           HA       THR 193  17.530  10.012  16.012
  699    HB   THR 193           HB       THR 193  17.379   9.906  18.957
  700    HG1  THR 193          1HG       THR 193  17.687  12.158  19.014
  701   HG21  THR 193          1HG2      THR 193  19.534   9.493  17.779
  702   HG22  THR 193          2HG2      THR 193  19.600  10.963  18.756
  703   HG23  THR 193          3HG2      THR 193  19.401  11.080  16.994
  704    H    GLY 194           H        GLY 194  15.218   8.218  15.778
  705    HA2  GLY 194          1HA       GLY 194  15.101   5.986  15.230
  706    HA3  GLY 194          2HA       GLY 194  16.740   5.757  15.836
  707    H    SER 195           H        SER 195  15.788   6.871  18.554
  708    HA   SER 195           HA       SER 195  13.780   4.967  19.528
  709    HB2  SER 195          1HB       SER 195  15.190   3.967  21.228
  710    HB3  SER 195          2HB       SER 195  15.888   3.646  19.634
  711    HG   SER 195           HG       SER 195  17.478   4.320  21.116
  712    H    ALA 196           H        ALA 196  13.096   5.470  21.754
  713    HA   ALA 196           HA       ALA 196  12.978   8.289  22.266
  714    HB1  ALA 196          1HB       ALA 196  11.182   6.732  22.887
  715    HB2  ALA 196          2HB       ALA 196  12.262   5.920  24.047
  716    HB3  ALA 196          3HB       ALA 196  11.778   7.609  24.310
  717    H    ARG 197           H        ARG 197  14.188   9.605  23.491
  718    HA   ARG 197           HA       ARG 197  16.733   8.750  24.654
  719    HB2  ARG 197          1HB       ARG 197  15.270  11.383  24.354
  720    HB3  ARG 197          2HB       ARG 197  16.569  11.248  25.521
  721    HG2  ARG 197          1HG       ARG 197  17.456  12.158  23.536
  722    HG3  ARG 197          2HG       ARG 197  18.166  10.576  23.792
  723    HD2  ARG 197          1HD       ARG 197  15.801  10.955  21.915
  724    HD3  ARG 197          2HD       ARG 197  17.420  11.380  21.393
  725    HE   ARG 197           HE       ARG 197  16.320   8.722  21.585
  726   HH11  ARG 197          1HH1      ARG 197  19.401  10.401  21.762
  727   HH12  ARG 197          2HH1      ARG 197  20.287   8.989  21.261
  728   HH21  ARG 197          1HH2      ARG 197  17.533   6.951  20.986
  729   HH22  ARG 197          2HH2      ARG 197  19.250   7.118  20.816
  730    H    GLY 198           H        GLY 198  17.406   9.067  26.830
  731    HA2  GLY 198          1HA       GLY 198  15.608   9.517  29.021
  732    HA3  GLY 198          2HA       GLY 198  15.858   7.785  28.794
  733    H    ARG 199           H        ARG 199  16.579   8.624  31.134
  734    HA   ARG 199           HA       ARG 199  19.294   9.629  31.415
  735    HB2  ARG 199          1HB       ARG 199  17.431   8.257  33.397
  736    HB3  ARG 199          2HB       ARG 199  18.994   8.971  33.812
  737    HG2  ARG 199          1HG       ARG 199  18.207  11.188  32.994
  738    HG3  ARG 199          2HG       ARG 199  16.609  10.501  32.675
  739    HD2  ARG 199          1HD       ARG 199  17.984  10.597  35.393
  740    HD3  ARG 199          2HD       ARG 199  16.759  11.732  34.851
  741    HE   ARG 199           HE       ARG 199  16.367   8.955  35.743
  742   HH11  ARG 199          1HH1      ARG 199  14.784  11.661  34.170
  743   HH12  ARG 199          2HH1      ARG 199  13.193  11.050  34.529
  744   HH21  ARG 199          1HH2      ARG 199  14.314   8.228  36.143
  745   HH22  ARG 199          2HH2      ARG 199  12.941   9.158  35.615
  746    H    SER 200           H        SER 200  21.081   8.571  32.333
  747    HA   SER 200           HA       SER 200  21.733   5.975  31.212
  748    HB2  SER 200          1HB       SER 200  23.904   6.330  32.371
  749    HB3  SER 200          2HB       SER 200  23.438   7.647  31.284
  750    HG   SER 200           HG       SER 200  24.199   8.412  33.347
  751    H5'    G 201           H5'        G 201   2.991 -15.351  13.293
  752   H5''    G 201           H5"        G 201   2.452 -13.671  13.359
  753    H4'    G 201           H4'        G 201   4.906 -13.861  13.429
  754    H3'    G 201           H3'        G 201   3.566 -11.984  11.910
  755    H2'    G 201           H2'        G 201   3.592 -13.307   9.886
  756   HO2'    G 201           HO2        G 201   5.807 -11.553  10.039
  757    H1'    G 201           H1'        G 201   6.483 -13.888  10.554
  758    H8     G 201          8H          G 201   7.134 -14.428   8.139
  759    H1     G 201          1H          G 201   2.654 -19.046   7.758
  760    H21    G 201          1H2         G 201   1.385 -18.972   9.621
  761    H22    G 201          2H2         G 201   1.685 -17.733  10.825
  762   HO5'    G 201           HO5        G 201   2.686 -15.274  11.007
  763    H5'    U 202           H5'        U 202   5.743  -9.327  10.820
  764   H5''    U 202           H5"        U 202   6.985  -8.892  11.999
  765    H4'    U 202           H4'        U 202   6.176  -6.888  10.965
  766    H3'    U 202           H3'        U 202   6.339  -7.197  13.694
  767    H2'    U 202           H2'        U 202   4.049  -7.672  14.029
  768   HO2'    U 202           HO2        U 202   4.703  -5.222  14.783
  769    H1'    U 202           H1'        U 202   3.331  -5.521  12.034
  770    H3     U 202          3H          U 202  -1.069  -6.314  12.871
  771    H5     U 202          5H          U 202   0.568 -10.172  12.822
  772    H6     U 202          6H          U 202   2.777  -9.188  12.458
  773    H5'    A 203           H5'        A 203   7.170  -3.255  11.249
  774   H5''    A 203           H5"        A 203   8.731  -3.490  12.012
  775    H4'    A 203           H4'        A 203   8.871  -1.415  10.968
  776    H3'    A 203           H3'        A 203   9.199  -1.461  13.750
  777    H2'    A 203           H2'        A 203   6.990  -0.646  14.148
  778   HO2'    A 203           HO2        A 203   8.876   1.452  14.066
  779    H1'    A 203           H1'        A 203   7.496   1.262  11.829
  780    H8     A 203          8H          A 203   4.777  -0.151  14.167
  781    H61    A 203          1H6         A 203   0.881   3.110  10.457
  782    H62    A 203          2H6         A 203   0.937   2.185  11.958
  783    H2     A 203          2H          A 203   4.838   3.394   8.792
  784    H5'    G 204           H5'        G 204  10.745   1.610  10.082
  785   H5''    G 204           H5"        G 204   9.357   0.533   9.831
  786    H4'    G 204           H4'        G 204  10.945  -0.570   8.016
  787    H3'    G 204           H3'        G 204  12.663   1.526   8.784
  788    H2'    G 204           H2'        G 204  11.184   3.166   7.795
  789   HO2'    G 204           HO2        G 204  13.350   2.579   6.235
  790    H1'    G 204           H1'        G 204  10.854   1.068   5.655
  791    H8     G 204          8H          G 204   9.956   2.179   3.600
  792    H1     G 204          1H          G 204   5.969   5.962   6.948
  793    H21    G 204          1H2         G 204   6.178   5.451   9.108
  794    H22    G 204          2H2         G 204   7.328   4.216   9.609
  795    H5'    U 205           H5'        U 205  13.686  -2.261   6.552
  796   H5''    U 205           H5"        U 205  15.307  -2.273   7.258
  797    H4'    U 205           H4'        U 205  15.095  -4.034   5.616
  798    H3'    U 205           H3'        U 205  17.245  -2.313   5.660
  799   HO3'    U 205           HO3        U 205  18.044  -3.877   3.965
  800    H2'    U 205           H2'        U 205  16.467  -0.890   3.953
  801   HO2'    U 205           HO2        U 205  17.679  -1.332   2.074
  802    H1'    U 205           H1'        U 205  15.559  -3.346   2.429
  803    H3     U 205          3H          U 205  13.509  -1.174  -0.959
  804    H5     U 205          5H          U 205  13.468   1.695   2.089
  805    H6     U 205          6H          U 205  14.526   0.083   3.578
  Start of MODEL   10
    1    H1   GLY 105          1H        GLY 105   1.722  16.004  -8.153
    2    H2   GLY 105          2H        GLY 105   1.328  16.289  -6.588
    3    H3   GLY 105          3H        GLY 105   0.184  15.771  -7.637
    4    HA2  GLY 105          1HA       GLY 105   1.306  13.653  -7.913
    5    HA3  GLY 105          2HA       GLY 105   2.532  14.216  -6.763
    6    H    SER 106           H        SER 106   1.919  12.232  -5.612
    7    HA   SER 106           HA       SER 106  -0.263  12.692  -3.642
    8    HB2  SER 106          1HB       SER 106   0.151  10.122  -5.219
    9    HB3  SER 106          2HB       SER 106  -0.844  10.265  -3.763
   10    HG   SER 106           HG       SER 106  -1.203  11.670  -6.216
   11    H    HIS 107           H        HIS 107   0.106  11.813  -1.607
   12    HA   HIS 107           HA       HIS 107   2.564  10.244  -1.057
   13    HB2  HIS 107          1HB       HIS 107   3.371  12.554  -1.098
   14    HB3  HIS 107          2HB       HIS 107   2.129  13.044   0.048
   15    HD2  HIS 107          2HD       HIS 107   5.650  11.844  -0.092
   16    HE1  HIS 107          1HE       HIS 107   4.524  11.501   4.010
   17    HE2  HIS 107          2HE       HIS 107   6.483  11.462   2.380
   18    H    MET 108           H        MET 108  -0.063  12.067   0.619
   19    HA   MET 108           HA       MET 108  -0.087  10.364   2.905
   20    HB2  MET 108          1HB       MET 108  -2.165  12.296   1.805
   21    HB3  MET 108          2HB       MET 108  -2.291  11.515   3.377
   22    HG2  MET 108          1HG       MET 108  -0.061  13.383   2.497
   23    HG3  MET 108          2HG       MET 108  -1.398  13.794   3.559
   24    HE1  MET 108          1HE       MET 108  -1.598  11.252   5.574
   25    HE2  MET 108          2HE       MET 108  -0.564  11.881   6.871
   26    HE3  MET 108          3HE       MET 108  -1.690  12.970   6.033
   27    H    LYS 109           H        LYS 109  -1.286   9.623  -0.159
   28    HA   LYS 109           HA       LYS 109  -3.542   7.942   0.599
   29    HB2  LYS 109          1HB       LYS 109  -2.015   8.122  -2.031
   30    HB3  LYS 109          2HB       LYS 109  -3.560   7.303  -1.782
   31    HG2  LYS 109          1HG       LYS 109  -4.660   9.449  -1.278
   32    HG3  LYS 109          2HG       LYS 109  -3.117  10.303  -1.518
   33    HD2  LYS 109          1HD       LYS 109  -2.990   9.336  -3.828
   34    HD3  LYS 109          2HD       LYS 109  -4.599   8.637  -3.603
   35    HE2  LYS 109          1HE       LYS 109  -5.621  10.815  -3.472
   36    HE3  LYS 109          2HE       LYS 109  -4.052  11.614  -3.293
   37    HZ1  LYS 109          1HZ       LYS 109  -4.919  11.771  -5.583
   38    HZ2  LYS 109          2HZ       LYS 109  -4.847  10.135  -5.749
   39    HZ3  LYS 109          3HZ       LYS 109  -3.474  11.005  -5.514
   40    H    LYS 110           H        LYS 110  -1.504   7.109   2.175
   41    HA   LYS 110           HA       LYS 110  -0.412   4.590   0.941
   42    HB2  LYS 110          1HB       LYS 110   1.153   6.522   1.039
   43    HB3  LYS 110          2HB       LYS 110   0.973   6.550   2.791
   44    HG2  LYS 110          1HG       LYS 110   1.956   4.213   2.860
   45    HG3  LYS 110          2HG       LYS 110   2.201   4.320   1.104
   46    HD2  LYS 110          1HD       LYS 110   3.575   6.378   1.436
   47    HD3  LYS 110          2HD       LYS 110   3.316   6.260   3.187
   48    HE2  LYS 110          1HE       LYS 110   4.424   3.991   3.126
   49    HE3  LYS 110          2HE       LYS 110   4.815   4.282   1.420
   50    HZ1  LYS 110          1HZ       LYS 110   6.049   6.283   2.158
   51    HZ2  LYS 110          2HZ       LYS 110   6.646   4.947   2.907
   52    HZ3  LYS 110          3HZ       LYS 110   5.682   5.945   3.730
   53    H    ILE 111           H        ILE 111  -0.368   2.757   2.053
   54    HA   ILE 111           HA       ILE 111  -1.117   2.773   4.949
   55    HB   ILE 111           HB       ILE 111  -2.276   0.727   4.780
   56   HG12  ILE 111          1HG1      ILE 111  -1.388   0.595   1.895
   57   HG13  ILE 111          2HG1      ILE 111  -0.988  -0.518   3.193
   58   HG21  ILE 111          1HG2      ILE 111  -4.229   1.344   3.581
   59   HG22  ILE 111          2HG2      ILE 111  -3.494   2.826   4.193
   60   HG23  ILE 111          3HG2      ILE 111  -3.314   2.395   2.470
   61   HD11  ILE 111          1HD1      ILE 111  -3.730  -0.225   1.924
   62   HD12  ILE 111          2HD1      ILE 111  -2.589  -1.565   1.736
   63   HD13  ILE 111          3HD1      ILE 111  -3.342  -1.266   3.311
   64    H    PHE 112           H        PHE 112  -0.239   1.366   6.241
   65    HA   PHE 112           HA       PHE 112   2.288  -0.045   5.628
   66    HB2  PHE 112          1HB       PHE 112   2.229   1.362   7.623
   67    HB3  PHE 112          2HB       PHE 112   0.732   0.618   8.170
   68    HD1  PHE 112          1HD       PHE 112   0.715  -1.684   9.118
   69    HD2  PHE 112          2HD       PHE 112   4.382   0.228   7.916
   70    HE1  PHE 112          1HE       PHE 112   2.013  -3.325  10.444
   71    HE2  PHE 112          2HE       PHE 112   5.670  -1.403   9.246
   72    HZ   PHE 112           HZ       PHE 112   4.504  -3.190  10.514
   73    H    VAL 113           H        VAL 113   2.325  -2.272   5.569
   74    HA   VAL 113           HA       VAL 113  -0.135  -3.812   6.274
   75    HB   VAL 113           HB       VAL 113   1.679  -4.428   3.923
   76   HG11  VAL 113          1HG1      VAL 113   0.672  -6.435   4.929
   77   HG12  VAL 113          2HG1      VAL 113  -0.935  -5.676   4.867
   78   HG13  VAL 113          3HG1      VAL 113  -0.075  -6.086   3.366
   79   HG21  VAL 113          1HG2      VAL 113   0.390  -2.471   3.346
   80   HG22  VAL 113          2HG2      VAL 113  -0.311  -3.866   2.523
   81   HG23  VAL 113          3HG2      VAL 113  -1.108  -3.206   3.970
   82    H    GLY 114           H        GLY 114   0.319  -5.060   7.988
   83    HA2  GLY 114          1HA       GLY 114   3.142  -6.037   8.392
   84    HA3  GLY 114          2HA       GLY 114   2.121  -5.438   9.682
   85    H    GLY 115           H        GLY 115   3.514  -8.016   9.258
   86    HA2  GLY 115          1HA       GLY 115   3.039 -10.093  10.226
   87    HA3  GLY 115          2HA       GLY 115   1.304  -9.856  10.002
   88    H    LEU 116           H        LEU 116   3.480  -9.264   7.313
   89    HA   LEU 116           HA       LEU 116   2.045 -10.974   5.521
   90    HB2  LEU 116          1HB       LEU 116   4.736  -9.574   5.400
   91    HB3  LEU 116          2HB       LEU 116   4.159 -10.546   4.057
   92    HG   LEU 116           HG       LEU 116   2.436  -8.298   5.156
   93   HD11  LEU 116          1HD1      LEU 116   4.649  -7.347   4.594
   94   HD12  LEU 116          2HD1      LEU 116   3.408  -6.830   3.440
   95   HD13  LEU 116          3HD1      LEU 116   4.572  -8.106   2.996
   96   HD21  LEU 116          1HD2      LEU 116   1.490 -10.003   3.492
   97   HD22  LEU 116          2HD2      LEU 116   2.721  -9.460   2.345
   98   HD23  LEU 116          3HD2      LEU 116   1.482  -8.326   2.917
   99    H    SER 117           H        SER 117   2.470 -12.953   4.616
  100    HA   SER 117           HA       SER 117   4.070 -14.879   6.061
  101    HB2  SER 117          1HB       SER 117   2.071 -15.433   4.584
  102    HB3  SER 117          2HB       SER 117   3.125 -15.138   3.192
  103    HG   SER 117           HG       SER 117   3.189 -17.323   3.754
  104    H    VAL 118           H        VAL 118   6.127 -15.646   5.641
  105    HA   VAL 118           HA       VAL 118   7.980 -14.064   4.064
  106    HB   VAL 118           HB       VAL 118   9.643 -15.730   4.590
  107   HG11  VAL 118          1HG1      VAL 118   9.038 -14.075   6.322
  108   HG12  VAL 118          2HG1      VAL 118   7.873 -15.215   7.018
  109   HG13  VAL 118          3HG1      VAL 118   9.604 -15.601   7.023
  110   HG21  VAL 118          1HG2      VAL 118   7.353 -17.400   5.706
  111   HG22  VAL 118          2HG2      VAL 118   8.388 -17.810   4.322
  112   HG23  VAL 118          3HG2      VAL 118   9.079 -17.739   5.947
  113    H    ASN 119           H        ASN 119   5.734 -16.498   3.155
  114    HA   ASN 119           HA       ASN 119   7.032 -17.311   0.665
  115    HB2  ASN 119          1HB       ASN 119   5.342 -18.701   1.825
  116    HB3  ASN 119          2HB       ASN 119   4.142 -17.417   1.650
  117   HD21  ASN 119          1HD2      ASN 119   6.126 -19.755  -0.198
  118   HD22  ASN 119          2HD2      ASN 119   5.033 -19.775  -1.575
  119    H    THR 120           H        THR 120   5.019 -14.595   1.700
  120    HA   THR 120           HA       THR 120   4.111 -13.804  -0.890
  121    HB   THR 120           HB       THR 120   4.237 -12.128   1.625
  122    HG1  THR 120          1HG       THR 120   2.247 -12.978   2.076
  123   HG21  THR 120          1HG2      THR 120   3.600 -10.780  -0.306
  124   HG22  THR 120          2HG2      THR 120   2.187 -11.070   0.717
  125   HG23  THR 120          3HG2      THR 120   2.387 -11.990  -0.783
  126    H    THR 121           H        THR 121   4.749 -12.427  -2.341
  127    HA   THR 121           HA       THR 121   7.102 -10.700  -1.784
  128    HB   THR 121           HB       THR 121   7.623 -12.586  -3.345
  129    HG1  THR 121          1HG       THR 121   8.885 -11.197  -4.543
  130   HG21  THR 121          1HG2      THR 121   6.097 -10.859  -5.358
  131   HG22  THR 121          2HG2      THR 121   5.564 -12.452  -4.778
  132   HG23  THR 121          3HG2      THR 121   7.066 -12.304  -5.699
  133    H    VAL 122           H        VAL 122   7.288  -8.789  -3.215
  134    HA   VAL 122           HA       VAL 122   5.199  -7.058  -2.530
  135    HB   VAL 122           HB       VAL 122   7.605  -6.504  -2.973
  136   HG11  VAL 122          1HG1      VAL 122   8.327  -5.815  -5.170
  137   HG12  VAL 122          2HG1      VAL 122   7.809  -7.503  -5.263
  138   HG13  VAL 122          3HG1      VAL 122   6.757  -6.207  -5.886
  139   HG21  VAL 122          1HG2      VAL 122   5.543  -4.703  -4.292
  140   HG22  VAL 122          2HG2      VAL 122   5.917  -4.771  -2.555
  141   HG23  VAL 122          3HG2      VAL 122   7.147  -4.232  -3.721
  142    H    GLU 123           H        GLU 123   5.605  -8.720  -5.628
  143    HA   GLU 123           HA       GLU 123   3.550  -7.242  -7.005
  144    HB2  GLU 123          1HB       GLU 123   4.667 -10.036  -7.509
  145    HB3  GLU 123          2HB       GLU 123   3.663  -9.142  -8.641
  146    HG2  GLU 123          1HG       GLU 123   6.437  -8.304  -7.680
  147    HG3  GLU 123          2HG       GLU 123   6.070  -9.094  -9.205
  148    H    ASP 124           H        ASP 124   3.393 -10.064  -4.852
  149    HA   ASP 124           HA       ASP 124   0.681 -10.890  -5.515
  150    HB2  ASP 124          1HB       ASP 124   2.078 -11.083  -2.818
  151    HB3  ASP 124          2HB       ASP 124   0.703 -12.023  -3.363
  152    H    VAL 125           H        VAL 125   2.169  -8.720  -3.115
  153    HA   VAL 125           HA       VAL 125  -0.244  -7.863  -1.817
  154    HB   VAL 125           HB       VAL 125   2.490  -6.527  -1.975
  155   HG11  VAL 125          1HG1      VAL 125   1.867  -5.395   0.111
  156   HG12  VAL 125          2HG1      VAL 125   0.780  -4.933  -1.200
  157   HG13  VAL 125          3HG1      VAL 125   0.246  -6.112   0.024
  158   HG21  VAL 125          1HG2      VAL 125   1.270  -8.501   0.003
  159   HG22  VAL 125          2HG2      VAL 125   2.703  -8.741  -1.019
  160   HG23  VAL 125          3HG2      VAL 125   2.750  -7.588   0.315
  161    H    LYS 126           H        LYS 126   1.710  -6.328  -4.427
  162    HA   LYS 126           HA       LYS 126   0.003  -4.091  -4.866
  163    HB2  LYS 126          1HB       LYS 126   2.287  -4.306  -5.744
  164    HB3  LYS 126          2HB       LYS 126   1.779  -5.604  -6.829
  165    HG2  LYS 126          1HG       LYS 126   0.355  -4.080  -8.086
  166    HG3  LYS 126          2HG       LYS 126   0.633  -2.780  -6.909
  167    HD2  LYS 126          1HD       LYS 126   3.066  -2.824  -7.454
  168    HD3  LYS 126          2HD       LYS 126   2.766  -4.056  -8.683
  169    HE2  LYS 126          1HE       LYS 126   1.604  -1.228  -8.662
  170    HE3  LYS 126          2HE       LYS 126   3.011  -1.749  -9.592
  171    HZ1  LYS 126          1HZ       LYS 126   1.105  -1.811 -11.010
  172    HZ2  LYS 126          2HZ       LYS 126   0.211  -2.681  -9.967
  173    HZ3  LYS 126          3HZ       LYS 126   1.503  -3.368 -10.723
  174    H    HIS 127           H        HIS 127  -0.068  -7.283  -6.583
  175    HA   HIS 127           HA       HIS 127  -2.369  -6.783  -8.139
  176    HB2  HIS 127          1HB       HIS 127  -0.739  -8.671  -8.357
  177    HB3  HIS 127          2HB       HIS 127  -1.442  -9.420  -6.923
  178    HD2  HIS 127          2HD       HIS 127  -1.733  -9.248 -10.590
  179    HE1  HIS 127          1HE       HIS 127  -5.346 -11.155  -9.349
  180    HE2  HIS 127          2HE       HIS 127  -3.871 -10.617 -11.355
  181    H    TYR 128           H        TYR 128  -2.188  -8.187  -4.813
  182    HA   TYR 128           HA       TYR 128  -4.988  -8.605  -4.607
  183    HB2  TYR 128          1HB       TYR 128  -3.514  -9.840  -3.228
  184    HB3  TYR 128          2HB       TYR 128  -2.844  -8.379  -2.514
  185    HD1  TYR 128          1HD       TYR 128  -3.995  -7.167  -0.719
  186    HD2  TYR 128          2HD       TYR 128  -5.805 -10.585  -2.636
  187    HE1  TYR 128          1HE       TYR 128  -5.679  -7.308   1.104
  188    HE2  TYR 128          2HE       TYR 128  -7.474 -10.732  -0.802
  189    HH   TYR 128           HH       TYR 128  -8.282  -9.778   1.108
  190    H    PHE 129           H        PHE 129  -3.084  -5.751  -3.557
  191    HA   PHE 129           HA       PHE 129  -5.477  -4.465  -2.612
  192    HB2  PHE 129          1HB       PHE 129  -2.676  -3.461  -2.859
  193    HB3  PHE 129          2HB       PHE 129  -4.021  -2.417  -2.409
  194    HD1  PHE 129          1HD       PHE 129  -1.604  -4.686  -1.125
  195    HD2  PHE 129          2HD       PHE 129  -5.629  -3.299  -0.486
  196    HE1  PHE 129          1HE       PHE 129  -1.603  -5.713   1.142
  197    HE2  PHE 129          2HE       PHE 129  -5.629  -4.376   1.756
  198    HZ   PHE 129           HZ       PHE 129  -3.638  -5.622   2.537
  199    H    GLU 130           H        GLU 130  -4.044  -4.425  -5.775
  200    HA   GLU 130           HA       GLU 130  -5.523  -2.274  -6.894
  201    HB2  GLU 130          1HB       GLU 130  -4.413  -4.838  -8.030
  202    HB3  GLU 130          2HB       GLU 130  -5.331  -3.711  -9.039
  203    HG2  GLU 130          1HG       GLU 130  -3.804  -1.903  -8.596
  204    HG3  GLU 130          2HG       GLU 130  -2.917  -2.863  -7.419
  205    H    GLN 131           H        GLN 131  -6.730  -5.364  -5.822
  206    HA   GLN 131           HA       GLN 131  -9.072  -5.493  -7.495
  207    HB2  GLN 131          1HB       GLN 131  -8.676  -6.725  -4.727
  208    HB3  GLN 131          2HB       GLN 131  -9.824  -7.211  -5.989
  209    HG2  GLN 131          1HG       GLN 131  -7.732  -7.504  -7.488
  210    HG3  GLN 131          2HG       GLN 131  -6.796  -7.448  -6.013
  211   HE21  GLN 131          1HE2      GLN 131  -6.134  -9.643  -6.956
  212   HE22  GLN 131          2HE2      GLN 131  -7.109 -11.008  -6.423
  213    H    PHE 132           H        PHE 132  -8.425  -3.998  -4.371
  214    HA   PHE 132           HA       PHE 132 -11.151  -3.035  -3.944
  215    HB2  PHE 132          1HB       PHE 132  -8.533  -2.027  -2.756
  216    HB3  PHE 132          2HB       PHE 132 -10.149  -1.578  -2.233
  217    HD1  PHE 132          1HD       PHE 132  -7.465  -3.829  -1.745
  218    HD2  PHE 132          2HD       PHE 132 -11.762  -3.605  -1.561
  219    HE1  PHE 132          1HE       PHE 132  -7.498  -5.793  -0.244
  220    HE2  PHE 132          2HE       PHE 132 -11.800  -5.622  -0.113
  221    HZ   PHE 132           HZ       PHE 132  -9.665  -6.715   0.565
  222    H    GLY 133           H        GLY 133  -8.259  -1.652  -5.420
  223    HA2  GLY 133          1HA       GLY 133  -9.448  -0.101  -7.377
  224    HA3  GLY 133          2HA       GLY 133  -9.297   0.980  -5.990
  225    H    LYS 134           H        LYS 134  -7.908   1.575  -8.281
  226    HA   LYS 134           HA       LYS 134  -5.531   0.268  -8.796
  227    HB2  LYS 134          1HB       LYS 134  -6.601   1.812 -10.344
  228    HB3  LYS 134          2HB       LYS 134  -6.231   3.175  -9.299
  229    HG2  LYS 134          1HG       LYS 134  -4.716   3.143 -11.166
  230    HG3  LYS 134          2HG       LYS 134  -3.801   2.843  -9.697
  231    HD2  LYS 134          1HD       LYS 134  -3.611   0.457 -10.250
  232    HD3  LYS 134          2HD       LYS 134  -4.774   0.631 -11.564
  233    HE2  LYS 134          1HE       LYS 134  -2.486   0.446 -12.406
  234    HE3  LYS 134          2HE       LYS 134  -3.228   1.981 -12.860
  235    HZ1  LYS 134          1HZ       LYS 134  -1.378   1.693 -10.542
  236    HZ2  LYS 134          2HZ       LYS 134  -1.937   3.091 -11.179
  237    HZ3  LYS 134          3HZ       LYS 134  -0.900   2.173 -12.037
  238    H    VAL 135           H        VAL 135  -3.555   0.273  -8.247
  239    HA   VAL 135           HA       VAL 135  -2.595   1.704  -5.801
  240    HB   VAL 135           HB       VAL 135  -1.824  -0.912  -7.128
  241   HG11  VAL 135          1HG1      VAL 135  -0.236  -1.282  -5.273
  242   HG12  VAL 135          2HG1      VAL 135   0.269   0.029  -6.342
  243   HG13  VAL 135          3HG1      VAL 135  -0.454   0.395  -4.760
  244   HG21  VAL 135          1HG2      VAL 135  -3.869  -0.918  -5.682
  245   HG22  VAL 135          2HG2      VAL 135  -2.561  -1.890  -4.990
  246   HG23  VAL 135          3HG2      VAL 135  -2.906  -0.269  -4.343
  247    H    ASP 136           H        ASP 136  -0.891   3.011  -5.942
  248    HA   ASP 136           HA       ASP 136   0.225   3.776  -8.557
  249    HB2  ASP 136          1HB       ASP 136  -0.425   5.563  -7.114
  250    HB3  ASP 136          2HB       ASP 136   0.455   4.876  -5.753
  251    H    ASP 137           H        ASP 137   1.405   2.347  -5.484
  252    HA   ASP 137           HA       ASP 137   3.597   0.972  -6.837
  253    HB2  ASP 137          1HB       ASP 137   4.390   3.409  -6.464
  254    HB3  ASP 137          2HB       ASP 137   4.269   3.093  -4.737
  255    H    ALA 138           H        ALA 138   4.760  -0.434  -5.329
  256    HA   ALA 138           HA       ALA 138   3.769  -0.722  -2.576
  257    HB1  ALA 138          1HB       ALA 138   3.381  -3.142  -2.817
  258    HB2  ALA 138          2HB       ALA 138   2.310  -2.239  -3.906
  259    HB3  ALA 138          3HB       ALA 138   3.759  -3.050  -4.547
  260    H    MET 139           H        MET 139   5.286  -1.700  -1.169
  261    HA   MET 139           HA       MET 139   7.815  -2.796  -2.203
  262    HB2  MET 139          1HB       MET 139   9.241  -1.175  -1.013
  263    HB3  MET 139          2HB       MET 139   8.371  -0.483  -2.376
  264    HG2  MET 139          1HG       MET 139   6.714   0.524  -0.819
  265    HG3  MET 139          2HG       MET 139   7.606  -0.154   0.547
  266    HE1  MET 139          1HE       MET 139   8.448   3.573   1.053
  267    HE2  MET 139          2HE       MET 139   6.898   2.808   0.632
  268    HE3  MET 139          3HE       MET 139   7.974   2.045   1.830
  269    H    LEU 140           H        LEU 140   8.613  -4.343  -0.877
  270    HA   LEU 140           HA       LEU 140   7.613  -4.476   1.941
  271    HB2  LEU 140          1HB       LEU 140   8.873  -6.750   0.401
  272    HB3  LEU 140          2HB       LEU 140   8.067  -6.807   1.968
  273    HG   LEU 140           HG       LEU 140   6.781  -6.368  -0.756
  274   HD11  LEU 140          1HD1      LEU 140   5.596  -8.454  -0.206
  275   HD12  LEU 140          2HD1      LEU 140   6.449  -8.542   1.349
  276   HD13  LEU 140          3HD1      LEU 140   7.355  -8.697  -0.171
  277   HD21  LEU 140          1HD2      LEU 140   4.606  -6.399   0.481
  278   HD22  LEU 140          2HD2      LEU 140   5.544  -4.944   0.761
  279   HD23  LEU 140          3HD2      LEU 140   5.515  -6.213   2.002
  280    H    MET 141           H        MET 141   9.052  -4.608   3.657
  281    HA   MET 141           HA       MET 141  11.578  -3.245   3.041
  282    HB2  MET 141          1HB       MET 141  10.241  -3.897   5.679
  283    HB3  MET 141          2HB       MET 141  11.722  -2.955   5.490
  284    HG2  MET 141          1HG       MET 141   8.960  -2.222   4.437
  285    HG3  MET 141          2HG       MET 141   9.838  -1.499   5.772
  286    HE1  MET 141          1HE       MET 141  10.058  -0.196   1.445
  287    HE2  MET 141          2HE       MET 141  10.379  -1.915   1.690
  288    HE3  MET 141          3HE       MET 141   8.833  -1.216   2.238
  289    H    PHE 142           H        PHE 142  12.758  -4.822   1.997
  290    HA   PHE 142           HA       PHE 142  13.642  -7.224   3.260
  291    HB2  PHE 142          1HB       PHE 142  14.434  -5.836   0.763
  292    HB3  PHE 142          2HB       PHE 142  15.447  -7.104   1.419
  293    HD1  PHE 142          1HD       PHE 142  11.948  -6.425   0.255
  294    HD2  PHE 142          2HD       PHE 142  14.957  -9.389   1.104
  295    HE1  PHE 142          1HE       PHE 142  10.512  -8.174  -0.767
  296    HE2  PHE 142          2HE       PHE 142  13.531 -11.131   0.050
  297    HZ   PHE 142           HZ       PHE 142  11.299 -10.530  -0.865
  298    H    ASP 143           H        ASP 143  15.282  -7.917   4.379
  299    HA   ASP 143           HA       ASP 143  17.338  -5.952   5.257
  300    HB2  ASP 143          1HB       ASP 143  16.427  -8.543   6.475
  301    HB3  ASP 143          2HB       ASP 143  17.977  -7.803   6.870
  302    H    LYS 144           H        LYS 144  19.259  -5.897   4.348
  303    HA   LYS 144           HA       LYS 144  19.887  -7.551   2.150
  304    HB2  LYS 144          1HB       LYS 144  21.994  -6.380   2.039
  305    HB3  LYS 144          2HB       LYS 144  20.680  -5.261   2.384
  306    HG2  LYS 144          1HG       LYS 144  21.344  -5.279   4.814
  307    HG3  LYS 144          2HG       LYS 144  22.724  -6.305   4.403
  308    HD2  LYS 144          1HD       LYS 144  22.217  -3.504   3.310
  309    HD3  LYS 144          2HD       LYS 144  23.314  -3.911   4.638
  310    HE2  LYS 144          1HE       LYS 144  24.636  -5.361   3.099
  311    HE3  LYS 144          2HE       LYS 144  23.569  -4.906   1.763
  312    HZ1  LYS 144          1HZ       LYS 144  25.572  -3.540   1.794
  313    HZ2  LYS 144          2HZ       LYS 144  25.264  -3.014   3.306
  314    HZ3  LYS 144          3HZ       LYS 144  24.274  -2.592   2.075
  315    H    THR 145           H        THR 145  21.016  -7.918   5.493
  316    HA   THR 145           HA       THR 145  22.706 -10.170   4.872
  317    HB   THR 145           HB       THR 145  21.704  -9.765   7.649
  318    HG1  THR 145          1HG       THR 145  23.215  -8.140   7.937
  319   HG21  THR 145          1HG2      THR 145  23.329 -11.571   7.141
  320   HG22  THR 145          2HG2      THR 145  24.030 -10.335   8.198
  321   HG23  THR 145          3HG2      THR 145  24.451 -10.365   6.469
  322    H    THR 146           H        THR 146  19.489 -10.003   6.434
  323    HA   THR 146           HA       THR 146  19.155 -12.773   6.603
  324    HB   THR 146           HB       THR 146  16.715 -11.085   6.511
  325    HG1  THR 146          1HG       THR 146  17.218 -10.205   8.513
  326   HG21  THR 146          1HG2      THR 146  17.843 -12.993   8.601
  327   HG22  THR 146          2HG2      THR 146  16.697 -13.461   7.328
  328   HG23  THR 146          3HG2      THR 146  16.205 -12.299   8.572
  329    H    ASN 147           H        ASN 147  18.561 -10.778   3.851
  330    HA   ASN 147           HA       ASN 147  17.787 -11.156   1.788
  331    HB2  ASN 147          1HB       ASN 147  18.790 -13.945   2.407
  332    HB3  ASN 147          2HB       ASN 147  18.120 -13.514   0.840
  333   HD21  ASN 147          1HD2      ASN 147  20.814 -12.748   3.084
  334   HD22  ASN 147          2HD2      ASN 147  21.776 -12.006   1.823
  335    H    ARG 148           H        ARG 148  15.882 -10.986   3.775
  336    HA   ARG 148           HA       ARG 148  13.504 -11.835   2.293
  337    HB2  ARG 148          1HB       ARG 148  12.364 -12.770   4.275
  338    HB3  ARG 148          2HB       ARG 148  13.696 -13.775   3.728
  339    HG2  ARG 148          1HG       ARG 148  15.065 -13.237   5.552
  340    HG3  ARG 148          2HG       ARG 148  14.169 -11.774   5.970
  341    HD2  ARG 148          1HD       ARG 148  12.974 -14.563   6.198
  342    HD3  ARG 148          2HD       ARG 148  13.860 -13.759   7.507
  343    HE   ARG 148           HE       ARG 148  11.763 -12.052   6.449
  344   HH11  ARG 148          1HH1      ARG 148  12.240 -14.646   8.807
  345   HH12  ARG 148          2HH1      ARG 148  10.907 -14.037   9.782
  346   HH21  ARG 148          1HH2      ARG 148  10.113 -11.469   7.705
  347   HH22  ARG 148          2HH2      ARG 148   9.783 -12.384   9.200
  348    H    HIS 149           H        HIS 149  11.533 -10.757   3.153
  349    HA   HIS 149           HA       HIS 149  12.121  -8.074   4.203
  350    HB2  HIS 149          1HB       HIS 149   9.768  -7.598   3.903
  351    HB3  HIS 149          2HB       HIS 149  10.497  -8.224   2.434
  352    HD2  HIS 149          2HD       HIS 149   9.271 -10.177   1.278
  353    HE1  HIS 149          1HE       HIS 149   6.531 -11.205   4.371
  354    HE2  HIS 149          2HE       HIS 149   7.194 -11.635   1.938
  355    H    ARG 150           H        ARG 150  11.264  -7.162   6.042
  356    HA   ARG 150           HA       ARG 150  11.492  -8.807   8.392
  357    HB2  ARG 150          1HB       ARG 150  10.724  -5.899   7.968
  358    HB3  ARG 150          2HB       ARG 150  10.984  -6.628   9.564
  359    HG2  ARG 150          1HG       ARG 150  13.313  -7.326   8.468
  360    HG3  ARG 150          2HG       ARG 150  12.991  -5.932   7.440
  361    HD2  ARG 150          1HD       ARG 150  12.963  -5.894  10.498
  362    HD3  ARG 150          2HD       ARG 150  14.359  -5.487   9.530
  363    HE   ARG 150           HE       ARG 150  12.133  -3.771  10.108
  364   HH11  ARG 150          1HH1      ARG 150  14.724  -4.221   7.677
  365   HH12  ARG 150          2HH1      ARG 150  14.653  -2.477   7.355
  366   HH21  ARG 150          1HH2      ARG 150  12.431  -1.609   9.673
  367   HH22  ARG 150          2HH2      ARG 150  13.514  -1.186   8.340
  368    H    GLY 151           H        GLY 151   8.977  -9.207   6.581
  369    HA2  GLY 151          1HA       GLY 151   6.894 -10.119   7.070
  370    HA3  GLY 151          2HA       GLY 151   7.092  -9.700   8.773
  371    H    PHE 152           H        PHE 152   7.648  -7.015   6.625
  372    HA   PHE 152           HA       PHE 152   4.837  -6.203   6.551
  373    HB2  PHE 152          1HB       PHE 152   5.055  -4.225   7.843
  374    HB3  PHE 152          2HB       PHE 152   5.661  -5.521   8.840
  375    HD1  PHE 152          1HD       PHE 152   8.152  -5.694   9.297
  376    HD2  PHE 152          2HD       PHE 152   6.436  -2.412   7.087
  377    HE1  PHE 152          1HE       PHE 152  10.236  -4.371   9.632
  378    HE2  PHE 152          2HE       PHE 152   8.496  -1.092   7.445
  379    HZ   PHE 152           HZ       PHE 152  10.417  -2.094   8.666
  380    H    GLY 153           H        GLY 153   4.548  -4.160   5.401
  381    HA2  GLY 153          1HA       GLY 153   6.707  -2.902   3.916
  382    HA3  GLY 153          2HA       GLY 153   5.697  -3.942   2.908
  383    H    PHE 154           H        PHE 154   5.456  -1.808   1.874
  384    HA   PHE 154           HA       PHE 154   3.140  -0.290   2.942
  385    HB2  PHE 154          1HB       PHE 154   5.636   0.786   1.613
  386    HB3  PHE 154          2HB       PHE 154   4.180   1.732   1.900
  387    HD1  PHE 154          1HD       PHE 154   3.385   2.201   4.225
  388    HD2  PHE 154          2HD       PHE 154   7.143   0.237   3.443
  389    HE1  PHE 154          1HE       PHE 154   4.088   2.610   6.557
  390    HE2  PHE 154          2HE       PHE 154   7.834   0.617   5.783
  391    HZ   PHE 154           HZ       PHE 154   6.307   1.806   7.358
  392    H    VAL 155           H        VAL 155   1.665   0.613   1.582
  393    HA   VAL 155           HA       VAL 155   1.924   0.151  -1.331
  394    HB   VAL 155           HB       VAL 155  -0.693  -0.459   0.042
  395   HG11  VAL 155          1HG1      VAL 155  -0.880   0.213  -2.313
  396   HG12  VAL 155          2HG1      VAL 155   0.338  -1.004  -2.766
  397   HG13  VAL 155          3HG1      VAL 155  -1.243  -1.502  -2.124
  398   HG21  VAL 155          1HG2      VAL 155  -0.277  -2.834  -0.411
  399   HG22  VAL 155          2HG2      VAL 155   1.389  -2.456  -0.905
  400   HG23  VAL 155          3HG2      VAL 155   0.856  -2.200   0.774
  401    H    THR 156           H        THR 156   1.394   1.816  -2.538
  402    HA   THR 156           HA       THR 156  -0.036   4.110  -1.314
  403    HB   THR 156           HB       THR 156   1.796   4.517  -3.638
  404    HG1  THR 156          1HG       THR 156   3.077   3.601  -2.082
  405   HG21  THR 156          1HG2      THR 156   0.849   6.314  -1.362
  406   HG22  THR 156          2HG2      THR 156   0.302   6.386  -3.054
  407   HG23  THR 156          3HG2      THR 156   1.977   6.780  -2.650
  408    H    PHE 157           H        PHE 157  -1.699   5.151  -2.365
  409    HA   PHE 157           HA       PHE 157  -2.933   3.542  -4.515
  410    HB2  PHE 157          1HB       PHE 157  -4.102   4.976  -2.151
  411    HB3  PHE 157          2HB       PHE 157  -5.071   4.364  -3.479
  412    HD1  PHE 157          1HD       PHE 157  -2.649   3.295  -0.828
  413    HD2  PHE 157          2HD       PHE 157  -5.695   2.067  -3.616
  414    HE1  PHE 157          1HE       PHE 157  -2.666   1.046   0.179
  415    HE2  PHE 157          2HE       PHE 157  -5.758  -0.173  -2.549
  416    HZ   PHE 157           HZ       PHE 157  -4.227  -0.699  -0.661
  417    H    GLU 158           H        GLU 158  -4.327   4.379  -6.037
  418    HA   GLU 158           HA       GLU 158  -3.508   6.922  -7.194
  419    HB2  GLU 158          1HB       GLU 158  -4.118   4.962  -8.501
  420    HB3  GLU 158          2HB       GLU 158  -5.768   5.010  -7.907
  421    HG2  GLU 158          1HG       GLU 158  -4.506   7.363  -9.382
  422    HG3  GLU 158          2HG       GLU 158  -5.142   5.979 -10.257
  423    H    SER 159           H        SER 159  -6.301   5.891  -5.235
  424    HA   SER 159           HA       SER 159  -7.038   8.755  -4.852
  425    HB2  SER 159          1HB       SER 159  -8.653   7.892  -6.403
  426    HB3  SER 159          2HB       SER 159  -8.949   6.468  -5.386
  427    HG   SER 159           HG       SER 159 -10.485   8.266  -5.177
  428    H    GLU 160           H        GLU 160  -7.642   9.368  -2.861
  429    HA   GLU 160           HA       GLU 160  -6.800   7.816  -0.578
  430    HB2  GLU 160          1HB       GLU 160  -6.813  10.355  -0.900
  431    HB3  GLU 160          2HB       GLU 160  -8.559  10.298  -0.617
  432    HG2  GLU 160          1HG       GLU 160  -8.145   9.293   1.619
  433    HG3  GLU 160          2HG       GLU 160  -6.405   9.292   1.293
  434    H    ASP 161           H        ASP 161  -9.874   8.141  -2.291
  435    HA   ASP 161           HA       ASP 161 -11.577   7.100  -0.222
  436    HB2  ASP 161          1HB       ASP 161 -11.846   7.144  -3.235
  437    HB3  ASP 161          2HB       ASP 161 -13.050   6.424  -2.177
  438    H    ILE 162           H        ILE 162  -9.426   5.437  -2.474
  439    HA   ILE 162           HA       ILE 162 -10.427   2.782  -1.785
  440    HB   ILE 162           HB       ILE 162  -7.649   3.408  -2.814
  441   HG12  ILE 162          1HG1      ILE 162  -9.019   4.444  -4.431
  442   HG13  ILE 162          2HG1      ILE 162  -8.483   2.896  -5.064
  443   HG21  ILE 162          1HG2      ILE 162  -7.903   1.143  -2.012
  444   HG22  ILE 162          2HG2      ILE 162  -9.424   0.924  -2.896
  445   HG23  ILE 162          3HG2      ILE 162  -7.885   1.089  -3.768
  446   HD11  ILE 162          1HD1      ILE 162 -11.271   3.568  -4.015
  447   HD12  ILE 162          2HD1      ILE 162 -10.800   3.242  -5.690
  448   HD13  ILE 162          3HD1      ILE 162 -10.761   1.935  -4.489
  449    H    VAL 163           H        VAL 163  -7.818   4.937  -0.573
  450    HA   VAL 163           HA       VAL 163  -6.666   3.064   1.217
  451    HB   VAL 163           HB       VAL 163  -6.895   6.087   1.599
  452   HG11  VAL 163          1HG1      VAL 163  -4.844   5.853   2.969
  453   HG12  VAL 163          2HG1      VAL 163  -6.221   5.026   3.702
  454   HG13  VAL 163          3HG1      VAL 163  -4.986   4.088   2.844
  455   HG21  VAL 163          1HG2      VAL 163  -4.722   4.395   0.310
  456   HG22  VAL 163          2HG2      VAL 163  -5.814   5.513  -0.542
  457   HG23  VAL 163          3HG2      VAL 163  -4.646   6.137   0.617
  458    H    GLU 164           H        GLU 164  -9.428   5.331   1.729
  459    HA   GLU 164           HA       GLU 164 -10.021   4.481   4.417
  460    HB2  GLU 164          1HB       GLU 164 -11.910   5.534   2.272
  461    HB3  GLU 164          2HB       GLU 164 -12.285   5.408   3.983
  462    HG2  GLU 164          1HG       GLU 164 -10.172   7.217   2.747
  463    HG3  GLU 164          2HG       GLU 164 -11.771   7.703   3.283
  464    H    LYS 165           H        LYS 165 -11.325   3.304   1.281
  465    HA   LYS 165           HA       LYS 165 -13.146   1.357   2.237
  466    HB2  LYS 165          1HB       LYS 165 -12.972   2.209  -0.067
  467    HB3  LYS 165          2HB       LYS 165 -11.413   1.428  -0.266
  468    HG2  LYS 165          1HG       LYS 165 -12.463  -0.802  -0.087
  469    HG3  LYS 165          2HG       LYS 165 -14.054  -0.024   0.100
  470    HD2  LYS 165          1HD       LYS 165 -13.752   1.090  -2.109
  471    HD3  LYS 165          2HD       LYS 165 -12.166   0.315  -2.286
  472    HE2  LYS 165          1HE       LYS 165 -13.257  -1.917  -2.220
  473    HE3  LYS 165          2HE       LYS 165 -14.837  -1.141  -2.056
  474    HZ1  LYS 165          1HZ       LYS 165 -13.005  -0.784  -4.381
  475    HZ2  LYS 165          2HZ       LYS 165 -14.486  -0.102  -4.230
  476    HZ3  LYS 165          3HZ       LYS 165 -14.351  -1.721  -4.378
  477    H    VAL 166           H        VAL 166  -9.737   0.970   1.424
  478    HA   VAL 166           HA       VAL 166  -9.456  -1.818   2.150
  479    HB   VAL 166           HB       VAL 166  -7.388   0.398   1.900
  480   HG11  VAL 166          1HG1      VAL 166  -6.441  -1.510   3.141
  481   HG12  VAL 166          2HG1      VAL 166  -7.064  -2.620   1.898
  482   HG13  VAL 166          3HG1      VAL 166  -5.787  -1.459   1.497
  483   HG21  VAL 166          1HG2      VAL 166  -7.020  -0.325  -0.338
  484   HG22  VAL 166          2HG2      VAL 166  -8.045  -1.767  -0.131
  485   HG23  VAL 166          3HG2      VAL 166  -8.763  -0.164  -0.220
  486    H    CYS 167           H        CYS 167  -8.617   1.231   3.919
  487    HA   CYS 167           HA       CYS 167  -7.685  -0.129   6.260
  488    HB2  CYS 167          1HB       CYS 167  -8.635   2.726   5.814
  489    HB3  CYS 167          2HB       CYS 167  -8.024   2.133   7.369
  490    HG   CYS 167           HG       CYS 167  -6.575   2.371   4.442
  491    H    GLU 168           H        GLU 168 -11.041   0.876   5.461
  492    HA   GLU 168           HA       GLU 168 -12.191   0.448   7.993
  493    HB2  GLU 168          1HB       GLU 168 -13.217   1.650   6.156
  494    HB3  GLU 168          2HB       GLU 168 -13.241   0.193   5.140
  495    HG2  GLU 168          1HG       GLU 168 -14.799  -0.886   6.623
  496    HG3  GLU 168          2HG       GLU 168 -14.664   0.446   7.787
  497    H    ILE 169           H        ILE 169 -11.246  -1.888   5.498
  498    HA   ILE 169           HA       ILE 169 -12.589  -4.187   6.673
  499    HB   ILE 169           HB       ILE 169 -10.323  -3.898   4.681
  500   HG12  ILE 169          1HG1      ILE 169 -13.187  -4.838   4.183
  501   HG13  ILE 169          2HG1      ILE 169 -12.761  -3.133   4.121
  502   HG21  ILE 169          1HG2      ILE 169 -10.707  -6.300   4.103
  503   HG22  ILE 169          2HG2      ILE 169 -10.044  -6.076   5.707
  504   HG23  ILE 169          3HG2      ILE 169 -11.773  -6.442   5.517
  505   HD11  ILE 169          1HD1      ILE 169 -11.091  -3.575   2.350
  506   HD12  ILE 169          2HD1      ILE 169 -11.597  -5.283   2.328
  507   HD13  ILE 169          3HD1      ILE 169 -12.746  -4.009   1.886
  508    H    HIS 170           H        HIS 170  -9.476  -2.651   7.101
  509    HA   HIS 170           HA       HIS 170  -7.832  -2.729   8.614
  510    HB2  HIS 170          1HB       HIS 170  -9.710  -2.383  10.131
  511    HB3  HIS 170          2HB       HIS 170  -9.882  -4.116  10.358
  512    HD2  HIS 170          2HD       HIS 170  -6.302  -2.671  10.430
  513    HE1  HIS 170          1HE       HIS 170  -7.389  -3.518  14.463
  514    HE2  HIS 170          2HE       HIS 170  -5.468  -2.869  12.923
  515    H    PHE 171           H        PHE 171  -9.271  -6.002   8.890
  516    HA   PHE 171           HA       PHE 171  -6.552  -7.097   8.525
  517    HB2  PHE 171          1HB       PHE 171  -8.753  -8.244  10.124
  518    HB3  PHE 171          2HB       PHE 171  -7.594  -9.302   9.337
  519    HD1  PHE 171          1HD       PHE 171  -5.335  -9.528  10.056
  520    HD2  PHE 171          2HD       PHE 171  -7.878  -6.505  11.797
  521    HE1  PHE 171          1HE       PHE 171  -3.645  -9.124  11.837
  522    HE2  PHE 171          2HE       PHE 171  -6.188  -6.114  13.577
  523    HZ   PHE 171           HZ       PHE 171  -4.073  -7.425  13.599
  524    H    HIS 172           H        HIS 172  -5.885  -7.950   6.846
  525    HA   HIS 172           HA       HIS 172  -7.770  -8.744   4.650
  526    HB2  HIS 172          1HB       HIS 172  -5.100  -7.300   4.645
  527    HB3  HIS 172          2HB       HIS 172  -5.809  -8.009   3.208
  528    HD2  HIS 172          2HD       HIS 172  -6.566  -5.205   5.812
  529    HE1  HIS 172          1HE       HIS 172  -8.811  -4.321   2.316
  530    HE2  HIS 172          2HE       HIS 172  -8.096  -3.457   4.581
  531    H    GLU 173           H        GLU 173  -6.605 -10.228   2.996
  532    HA   GLU 173           HA       GLU 173  -4.946 -12.264   4.408
  533    HB2  GLU 173          1HB       GLU 173  -7.315 -12.869   4.686
  534    HB3  GLU 173          2HB       GLU 173  -7.519 -12.860   2.926
  535    HG2  GLU 173          1HG       GLU 173  -5.780 -14.673   2.762
  536    HG3  GLU 173          2HG       GLU 173  -5.680 -14.690   4.526
  537    H    ILE 174           H        ILE 174  -3.264 -12.897   3.285
  538    HA   ILE 174           HA       ILE 174  -3.237 -12.833   0.311
  539    HB   ILE 174           HB       ILE 174  -1.074 -11.556   2.031
  540   HG12  ILE 174          1HG1      ILE 174  -3.212 -10.204   0.340
  541   HG13  ILE 174          2HG1      ILE 174  -3.059 -10.130   2.096
  542   HG21  ILE 174          1HG2      ILE 174  -1.448 -11.643  -1.003
  543   HG22  ILE 174          2HG2      ILE 174  -0.123 -10.840  -0.142
  544   HG23  ILE 174          3HG2      ILE 174  -0.252 -12.585  -0.082
  545   HD11  ILE 174          1HD1      ILE 174  -1.209  -8.851   0.075
  546   HD12  ILE 174          2HD1      ILE 174  -2.255  -8.078   1.270
  547   HD13  ILE 174          3HD1      ILE 174  -0.835  -8.990   1.816
  548    H    ASN 175           H        ASN 175  -2.268 -14.610  -0.514
  549    HA   ASN 175           HA       ASN 175  -1.525 -16.754  -0.564
  550    HB2  ASN 175          1HB       ASN 175   0.727 -15.477   1.018
  551    HB3  ASN 175          2HB       ASN 175   0.821 -17.070   0.276
  552   HD21  ASN 175          1HD2      ASN 175   2.086 -14.284  -0.213
  553   HD22  ASN 175          2HD2      ASN 175   2.109 -14.229  -1.978
  554    H    ASN 176           H        ASN 176  -3.557 -16.726   1.101
  555    HA   ASN 176           HA       ASN 176  -4.665 -17.827   2.717
  556    HB2  ASN 176          1HB       ASN 176  -3.743 -19.691   1.310
  557    HB3  ASN 176          2HB       ASN 176  -2.436 -19.875   2.479
  558   HD21  ASN 176          1HD2      ASN 176  -2.946 -21.942   3.226
  559   HD22  ASN 176          2HD2      ASN 176  -4.477 -22.317   4.007
  560    H    LYS 177           H        LYS 177  -2.810 -15.815   3.685
  561    HA   LYS 177           HA       LYS 177  -2.873 -16.517   6.559
  562    HB2  LYS 177          1HB       LYS 177  -0.597 -17.060   5.528
  563    HB3  LYS 177          2HB       LYS 177  -0.381 -15.330   5.264
  564    HG2  LYS 177          1HG       LYS 177  -0.540 -14.905   7.682
  565    HG3  LYS 177          2HG       LYS 177  -0.932 -16.604   7.996
  566    HD2  LYS 177          1HD       LYS 177   1.665 -15.587   6.791
  567    HD3  LYS 177          2HD       LYS 177   1.428 -15.968   8.496
  568    HE2  LYS 177          1HE       LYS 177   1.128 -18.295   8.089
  569    HE3  LYS 177          2HE       LYS 177   0.884 -18.068   6.359
  570    HZ1  LYS 177          1HZ       LYS 177   3.194 -17.514   6.092
  571    HZ2  LYS 177          2HZ       LYS 177   3.117 -18.923   6.914
  572    HZ3  LYS 177          3HZ       LYS 177   3.477 -17.528   7.695
  573    H    MET 178           H        MET 178  -2.647 -14.509   7.939
  574    HA   MET 178           HA       MET 178  -4.127 -12.345   6.513
  575    HB2  MET 178          1HB       MET 178  -4.475 -13.320   9.355
  576    HB3  MET 178          2HB       MET 178  -5.149 -11.810   8.725
  577    HG2  MET 178          1HG       MET 178  -6.165 -13.198   6.832
  578    HG3  MET 178          2HG       MET 178  -5.769 -14.622   7.804
  579    HE1  MET 178          1HE       MET 178  -7.351 -11.060   8.003
  580    HE2  MET 178          2HE       MET 178  -8.375 -12.002   6.906
  581    HE3  MET 178          3HE       MET 178  -9.029 -11.442   8.460
  582    H    VAL 179           H        VAL 179  -3.926 -10.231   6.983
  583    HA   VAL 179           HA       VAL 179  -1.494  -9.347   8.444
  584    HB   VAL 179           HB       VAL 179  -0.868  -7.850   6.618
  585   HG11  VAL 179          1HG1      VAL 179  -1.058 -10.699   5.578
  586   HG12  VAL 179          2HG1      VAL 179   0.142  -9.447   5.187
  587   HG13  VAL 179          3HG1      VAL 179   0.084 -10.133   6.819
  588   HG21  VAL 179          1HG2      VAL 179  -3.027  -9.217   4.958
  589   HG22  VAL 179          2HG2      VAL 179  -2.954  -7.499   5.423
  590   HG23  VAL 179          3HG2      VAL 179  -1.749  -8.170   4.321
  591    H    GLU 180           H        GLU 180  -1.495  -7.263   9.183
  592    HA   GLU 180           HA       GLU 180  -4.166  -5.950   9.448
  593    HB2  GLU 180          1HB       GLU 180  -2.696  -6.326  11.480
  594    HB3  GLU 180          2HB       GLU 180  -1.545  -5.176  10.780
  595    HG2  GLU 180          1HG       GLU 180  -3.414  -3.469  10.700
  596    HG3  GLU 180          2HG       GLU 180  -4.468  -4.651  11.476
  597    H    CYS 181           H        CYS 181  -4.681  -4.195   8.247
  598    HA   CYS 181           HA       CYS 181  -2.506  -2.657   6.894
  599    HB2  CYS 181          1HB       CYS 181  -5.377  -3.024   5.990
  600    HB3  CYS 181          2HB       CYS 181  -4.157  -2.006   5.223
  601    HG   CYS 181           HG       CYS 181  -4.056  -5.262   5.802
  602    H    LYS 182           H        LYS 182  -2.270  -0.588   7.347
  603    HA   LYS 182           HA       LYS 182  -4.355   1.035   8.663
  604    HB2  LYS 182          1HB       LYS 182  -2.754   1.559  10.578
  605    HB3  LYS 182          2HB       LYS 182  -3.590   0.004  10.603
  606    HG2  LYS 182          1HG       LYS 182  -1.464  -1.062   9.732
  607    HG3  LYS 182          2HG       LYS 182  -0.666   0.510   9.960
  608    HD2  LYS 182          1HD       LYS 182  -1.205   0.438  12.373
  609    HD3  LYS 182          2HD       LYS 182  -2.150  -1.042  12.127
  610    HE2  LYS 182          1HE       LYS 182  -0.020  -2.120  11.222
  611    HE3  LYS 182          2HE       LYS 182   0.865  -0.712  11.828
  612    HZ1  LYS 182          1HZ       LYS 182  -0.788  -2.599  13.433
  613    HZ2  LYS 182          2HZ       LYS 182   0.008  -1.289  14.070
  614    HZ3  LYS 182          3HZ       LYS 182   0.824  -2.562  13.400
  615    H    LYS 183           H        LYS 183  -3.880   3.286   8.767
  616    HA   LYS 183           HA       LYS 183  -2.565   4.225   6.410
  617    HB2  LYS 183          1HB       LYS 183  -3.567   5.738   8.848
  618    HB3  LYS 183          2HB       LYS 183  -3.000   6.508   7.356
  619    HG2  LYS 183          1HG       LYS 183  -4.730   5.392   6.037
  620    HG3  LYS 183          2HG       LYS 183  -5.269   4.470   7.448
  621    HD2  LYS 183          1HD       LYS 183  -5.899   6.590   8.593
  622    HD3  LYS 183          2HD       LYS 183  -5.468   7.487   7.115
  623    HE2  LYS 183          1HE       LYS 183  -7.121   6.187   5.823
  624    HE3  LYS 183          2HE       LYS 183  -7.493   5.200   7.240
  625    HZ1  LYS 183          1HZ       LYS 183  -9.131   6.942   6.906
  626    HZ2  LYS 183          2HZ       LYS 183  -8.013   8.114   7.007
  627    HZ3  LYS 183          3HZ       LYS 183  -8.355   7.202   8.332
  628    H    ALA 184           H        ALA 184  -0.595   4.958   5.937
  629    HA   ALA 184           HA       ALA 184   1.501   4.060   7.665
  630    HB1  ALA 184          1HB       ALA 184   2.998   4.797   5.857
  631    HB2  ALA 184          2HB       ALA 184   1.625   3.861   5.241
  632    HB3  ALA 184          3HB       ALA 184   1.639   5.634   5.072
  633    H    GLN 185           H        GLN 185   2.703   5.033   9.101
  634    HA   GLN 185           HA       GLN 185   2.858   8.008   9.324
  635    HB2  GLN 185          1HB       GLN 185   2.378   5.875  11.417
  636    HB3  GLN 185          2HB       GLN 185   2.916   7.497  11.853
  637    HG2  GLN 185          1HG       GLN 185   0.897   8.504  11.254
  638    HG3  GLN 185          2HG       GLN 185   0.462   7.246  10.106
  639   HE21  GLN 185          1HE2      GLN 185  -0.611   5.326  10.814
  640   HE22  GLN 185          2HE2      GLN 185  -1.169   5.178  12.481
  641    HA   PRO 186           HA       PRO 186   7.187   7.394   9.264
  642    HB2  PRO 186          1HB       PRO 186   8.213   9.539  10.626
  643    HB3  PRO 186          2HB       PRO 186   7.370   9.677   9.054
  644    HG2  PRO 186          1HG       PRO 186   6.209  10.081  11.826
  645    HG3  PRO 186          2HG       PRO 186   6.065  11.160  10.403
  646    HD2  PRO 186          1HD       PRO 186   4.111   9.386  11.064
  647    HD3  PRO 186          2HD       PRO 186   4.522   9.712   9.352
  648    H    LYS 187           H        LYS 187   8.783   6.278  10.271
  649    HA   LYS 187           HA       LYS 187   8.447   5.086  12.811
  650    HB2  LYS 187          1HB       LYS 187  10.767   4.292  12.558
  651    HB3  LYS 187          2HB       LYS 187   9.794   4.030  11.120
  652    HG2  LYS 187          1HG       LYS 187  10.847   6.047  10.060
  653    HG3  LYS 187          2HG       LYS 187  11.846   6.248  11.515
  654    HD2  LYS 187          1HD       LYS 187  12.880   4.034  11.127
  655    HD3  LYS 187          2HD       LYS 187  11.803   3.758   9.757
  656    HE2  LYS 187          1HE       LYS 187  13.950   4.395   8.896
  657    HE3  LYS 187          2HE       LYS 187  12.796   5.685   8.554
  658    HZ1  LYS 187          1HZ       LYS 187  13.734   6.957  10.417
  659    HZ2  LYS 187          2HZ       LYS 187  14.927   6.533   9.396
  660    HZ3  LYS 187          3HZ       LYS 187  14.746   5.725  10.802
  661    H    GLU 188           H        GLU 188   9.729   8.117  12.073
  662    HA   GLU 188           HA       GLU 188  11.350   8.642  14.375
  663    HB2  GLU 188          1HB       GLU 188   9.748  10.673  12.772
  664    HB3  GLU 188          2HB       GLU 188  11.209  10.967  13.710
  665    HG2  GLU 188          1HG       GLU 188  10.940   9.439  11.091
  666    HG3  GLU 188          2HG       GLU 188  11.755  10.970  11.358
  667    H    VAL 189           H        VAL 189   7.834   8.761  13.977
  668    HA   VAL 189           HA       VAL 189   7.564   9.770  16.765
  669    HB   VAL 189           HB       VAL 189   5.381  10.361  16.451
  670   HG11  VAL 189          1HG1      VAL 189   6.745  11.090  13.824
  671   HG12  VAL 189          2HG1      VAL 189   5.408  11.949  14.614
  672   HG13  VAL 189          3HG1      VAL 189   7.002  11.896  15.385
  673   HG21  VAL 189          1HG2      VAL 189   4.464   8.437  15.249
  674   HG22  VAL 189          2HG2      VAL 189   4.028   9.944  14.442
  675   HG23  VAL 189          3HG2      VAL 189   5.317   8.932  13.771
  676    H    MET 190           H        MET 190   7.178   6.839  14.921
  677    HA   MET 190           HA       MET 190   5.718   5.392  16.982
  678    HB2  MET 190          1HB       MET 190   7.382   4.472  14.614
  679    HB3  MET 190          2HB       MET 190   6.478   3.378  15.660
  680    HG2  MET 190          1HG       MET 190   5.212   5.656  14.086
  681    HG3  MET 190          2HG       MET 190   5.289   3.982  13.544
  682    HE1  MET 190          1HE       MET 190   2.681   4.130  13.137
  683    HE2  MET 190          2HE       MET 190   1.489   4.496  14.404
  684    HE3  MET 190          3HE       MET 190   2.588   5.768  13.831
  685    H    SER 191           H        SER 191   9.125   6.046  16.424
  686    HA   SER 191           HA       SER 191  11.030   5.534  17.494
  687    HB2  SER 191          1HB       SER 191   9.881   6.881  19.202
  688    HB3  SER 191          2HB       SER 191   9.296   5.402  19.978
  689    HG   SER 191           HG       SER 191  11.393   4.830  20.452
  690    HA   PRO 192           HA       PRO 192  10.095   0.916  17.633
  691    HB2  PRO 192          1HB       PRO 192  10.993   0.083  15.214
  692    HB3  PRO 192          2HB       PRO 192   9.418   0.914  15.389
  693    HG2  PRO 192          1HG       PRO 192  12.095   2.176  14.659
  694    HG3  PRO 192          2HG       PRO 192  10.548   2.279  13.755
  695    HD2  PRO 192          1HD       PRO 192  11.283   4.206  15.511
  696    HD3  PRO 192          2HD       PRO 192   9.578   3.675  15.360
  697    H    THR 193           H        THR 193  12.833   2.840  17.751
  698    HA   THR 193           HA       THR 193  14.915   0.979  17.245
  699    HB   THR 193           HB       THR 193  16.450   2.553  17.837
  700    HG1  THR 193          1HG       THR 193  16.035   4.241  19.247
  701   HG21  THR 193          1HG2      THR 193  14.947   3.393  15.985
  702   HG22  THR 193          2HG2      THR 193  15.780   4.663  16.892
  703   HG23  THR 193          3HG2      THR 193  14.062   4.350  17.200
  704    H    GLY 194           H        GLY 194  12.955   1.108  20.016
  705    HA2  GLY 194          1HA       GLY 194  14.838  -0.109  21.896
  706    HA3  GLY 194          2HA       GLY 194  13.104   0.095  22.105
  707    H    SER 195           H        SER 195  13.755  -2.111  23.105
  708    HA   SER 195           HA       SER 195  14.159  -4.402  21.456
  709    HB2  SER 195          1HB       SER 195  13.025  -4.176  24.270
  710    HB3  SER 195          2HB       SER 195  13.604  -5.670  23.507
  711    HG   SER 195           HG       SER 195  15.221  -4.696  24.805
  712    H    ALA 196           H        ALA 196  11.342  -2.601  21.557
  713    HA   ALA 196           HA       ALA 196   9.322  -4.623  21.725
  714    HB1  ALA 196          1HB       ALA 196   9.007  -2.240  22.304
  715    HB2  ALA 196          2HB       ALA 196   9.240  -1.790  20.597
  716    HB3  ALA 196          3HB       ALA 196   7.839  -2.768  21.082
  717    H    ARG 197           H        ARG 197  11.463  -4.170  19.164
  718    HA   ARG 197           HA       ARG 197   9.858  -4.339  16.826
  719    HB2  ARG 197          1HB       ARG 197  12.670  -5.370  17.394
  720    HB3  ARG 197          2HB       ARG 197  11.913  -5.403  15.797
  721    HG2  ARG 197          1HG       ARG 197  11.595  -2.934  15.904
  722    HG3  ARG 197          2HG       ARG 197  12.486  -2.904  17.438
  723    HD2  ARG 197          1HD       ARG 197  14.489  -3.763  16.390
  724    HD3  ARG 197          2HD       ARG 197  13.648  -4.090  14.876
  725    HE   ARG 197           HE       ARG 197  14.682  -1.527  15.813
  726   HH11  ARG 197          1HH1      ARG 197  12.313  -2.919  13.645
  727   HH12  ARG 197          2HH1      ARG 197  12.273  -1.507  12.615
  728   HH21  ARG 197          1HH2      ARG 197  13.389   0.290  13.178
  729   HH22  ARG 197          2HH2      ARG 197  14.575   0.256  14.465
  730    H    GLY 198           H        GLY 198   9.247  -5.914  15.457
  731    HA2  GLY 198          1HA       GLY 198   8.686  -8.625  16.522
  732    HA3  GLY 198          2HA       GLY 198   8.133  -7.924  15.005
  733    H    ARG 199           H        ARG 199   9.249  -8.287  13.205
  734    HA   ARG 199           HA       ARG 199  10.494  -9.314  11.675
  735    HB2  ARG 199          1HB       ARG 199  12.211  -7.662  12.681
  736    HB3  ARG 199          2HB       ARG 199  12.962  -9.086  13.411
  737    HG2  ARG 199          1HG       ARG 199  13.069 -10.084  11.023
  738    HG3  ARG 199          2HG       ARG 199  12.444  -8.544  10.459
  739    HD2  ARG 199          1HD       ARG 199  14.747  -8.479  10.112
  740    HD3  ARG 199          2HD       ARG 199  14.475  -7.426  11.510
  741    HE   ARG 199           HE       ARG 199  15.054  -9.762  12.743
  742   HH11  ARG 199          1HH1      ARG 199  16.785  -8.207  10.078
  743   HH12  ARG 199          2HH1      ARG 199  18.263  -9.050  10.471
  744   HH21  ARG 199          1HH2      ARG 199  17.000 -10.732  13.185
  745   HH22  ARG 199          2HH2      ARG 199  18.388 -10.394  12.193
  746    H    SER 200           H        SER 200   9.033 -11.011  13.298
  747    HA   SER 200           HA       SER 200  10.466 -13.496  13.817
  748    HB2  SER 200          1HB       SER 200   7.563 -12.846  13.249
  749    HB3  SER 200          2HB       SER 200   8.147 -14.505  13.477
  750    HG   SER 200           HG       SER 200   7.460 -13.554  15.484
  751    H5'    G 201           H5'        G 201   3.306 -14.367  13.605
  752   H5''    G 201           H5"        G 201   2.899 -12.650  13.676
  753    H4'    G 201           H4'        G 201   5.281 -12.913  13.520
  754    H3'    G 201           H3'        G 201   3.905 -11.204  11.822
  755    H2'    G 201           H2'        G 201   3.865 -12.803  10.041
  756   HO2'    G 201           HO2        G 201   5.202 -11.972   8.428
  757    H1'    G 201           H1'        G 201   6.794 -13.299  10.712
  758    H8     G 201          8H          G 201   3.900 -14.446   8.522
  759    H1     G 201          1H          G 201   8.615 -18.812   9.061
  760    H21    G 201          1H2         G 201  10.250 -17.914  10.386
  761    H22    G 201          2H2         G 201  10.003 -16.294  11.059
  762   HO5'    G 201           HO5        G 201   1.505 -13.875  12.258
  763    H5'    U 202           H5'        U 202   6.082  -8.434  10.694
  764   H5''    U 202           H5"        U 202   7.360  -8.089  11.865
  765    H4'    U 202           H4'        U 202   6.581  -6.007  10.944
  766    H3'    U 202           H3'        U 202   6.817  -6.464  13.651
  767    H2'    U 202           H2'        U 202   4.535  -6.860  14.054
  768   HO2'    U 202           HO2        U 202   5.274  -4.414  14.819
  769    H1'    U 202           H1'        U 202   3.771  -4.642  12.155
  770    H3     U 202          3H          U 202  -0.587  -5.419  13.119
  771    H5     U 202          5H          U 202   0.975  -9.295  12.746
  772    H6     U 202          6H          U 202   3.184  -8.327  12.359
  773    H5'    A 203           H5'        A 203   8.292  -3.136  11.423
  774   H5''    A 203           H5"        A 203   9.725  -2.598  12.304
  775    H4'    A 203           H4'        A 203   9.089  -1.079  10.471
  776    H3'    A 203           H3'        A 203   9.636  -0.175  13.109
  777    H2'    A 203           H2'        A 203   7.418   0.449  13.493
  778   HO2'    A 203           HO2        A 203   7.123   2.697  13.054
  779    H1'    A 203           H1'        A 203   7.253   1.219  10.560
  780    H8     A 203          8H          A 203   5.037  -0.424  13.365
  781    H61    A 203          1H6         A 203   0.615   3.095  10.581
  782    H62    A 203          2H6         A 203   0.846   2.021  11.967
  783    H2     A 203          2H          A 203   4.262   3.662   8.462
  784    H5'    G 204           H5'        G 204  10.309   1.858   8.669
  785   H5''    G 204           H5"        G 204  10.203   0.107   8.742
  786    H4'    G 204           H4'        G 204  11.829  -0.211   7.033
  787    H3'    G 204           H3'        G 204  13.276   1.985   7.798
  788    H2'    G 204           H2'        G 204  11.410   3.486   7.351
  789   HO2'    G 204           HO2        G 204  13.420   3.493   5.373
  790    H1'    G 204           H1'        G 204  11.302   2.071   4.680
  791    H8     G 204          8H          G 204   9.743   3.364   3.175
  792    H1     G 204          1H          G 204   6.003   5.271   8.072
  793    H21    G 204          1H2         G 204   6.712   4.302   9.898
  794    H22    G 204          2H2         G 204   8.251   3.460   9.939
  795    H5'    U 205           H5'        U 205  13.449  -1.614   4.685
  796   H5''    U 205           H5"        U 205  15.085  -2.255   4.864
  797    H4'    U 205           H4'        U 205  14.350  -2.988   2.758
  798    H3'    U 205           H3'        U 205  16.619  -1.442   2.782
  799   HO3'    U 205           HO3        U 205  16.641  -2.059   0.420
  800    H2'    U 205           H2'        U 205  15.503   0.597   2.258
  801   HO2'    U 205           HO2        U 205  17.087   0.383   0.602
  802    H1'    U 205           H1'        U 205  13.871  -0.894   0.197
  803    H3     U 205          3H          U 205  11.652   2.863  -1.013
  804    H5     U 205          5H          U 205  12.300   3.486   3.070
  805    H6     U 205          6H          U 205  13.390   1.295   3.192
  Start of MODEL   11
    1    H1   GLY 105          1H        GLY 105  -3.633  16.987   8.416
    2    H2   GLY 105          2H        GLY 105  -3.021  15.469   8.322
    3    H3   GLY 105          3H        GLY 105  -3.770  15.966   9.691
    4    HA2  GLY 105          1HA       GLY 105  -5.882  16.141   8.558
    5    HA3  GLY 105          2HA       GLY 105  -5.075  15.626   7.066
    6    H    SER 106           H        SER 106  -7.314  14.373   8.559
    7    HA   SER 106           HA       SER 106  -6.353  11.991   9.882
    8    HB2  SER 106          1HB       SER 106  -9.102  12.706   8.791
    9    HB3  SER 106          2HB       SER 106  -8.739  11.345   9.869
   10    HG   SER 106           HG       SER 106  -9.465  13.192  11.025
   11    H    HIS 107           H        HIS 107  -6.805  12.664   6.516
   12    HA   HIS 107           HA       HIS 107  -7.153   9.844   5.715
   13    HB2  HIS 107          1HB       HIS 107  -7.276  10.700   3.475
   14    HB3  HIS 107          2HB       HIS 107  -8.322  11.645   4.514
   15    HD2  HIS 107          2HD       HIS 107  -8.120  14.204   4.224
   16    HE1  HIS 107          1HE       HIS 107  -4.371  14.411   2.200
   17    HE2  HIS 107          2HE       HIS 107  -6.377  15.759   3.003
   18    H    MET 108           H        MET 108  -5.693   9.000   3.954
   19    HA   MET 108           HA       MET 108  -2.947   9.937   3.860
   20    HB2  MET 108          1HB       MET 108  -3.502   8.023   5.848
   21    HB3  MET 108          2HB       MET 108  -2.961   7.032   4.500
   22    HG2  MET 108          1HG       MET 108  -1.479   9.377   5.753
   23    HG3  MET 108          2HG       MET 108  -1.132   7.670   6.011
   24    HE1  MET 108          1HE       MET 108   2.026   9.002   4.065
   25    HE2  MET 108          2HE       MET 108   1.052   9.846   5.290
   26    HE3  MET 108          3HE       MET 108   1.467   8.130   5.507
   27    H    LYS 109           H        LYS 109  -1.826   9.008   2.058
   28    HA   LYS 109           HA       LYS 109  -3.457   7.354   0.169
   29    HB2  LYS 109          1HB       LYS 109  -1.474   9.562  -0.349
   30    HB3  LYS 109          2HB       LYS 109  -1.712   8.288  -1.533
   31    HG2  LYS 109          1HG       LYS 109  -4.333   9.058  -0.752
   32    HG3  LYS 109          2HG       LYS 109  -3.473  10.567  -0.941
   33    HD2  LYS 109          1HD       LYS 109  -3.708   8.285  -2.956
   34    HD3  LYS 109          2HD       LYS 109  -4.600   9.805  -3.022
   35    HE2  LYS 109          1HE       LYS 109  -2.674  11.085  -3.548
   36    HE3  LYS 109          2HE       LYS 109  -1.571   9.777  -3.102
   37    HZ1  LYS 109          1HZ       LYS 109  -1.857   9.952  -5.527
   38    HZ2  LYS 109          2HZ       LYS 109  -3.461   9.614  -5.391
   39    HZ3  LYS 109          3HZ       LYS 109  -2.352   8.490  -4.963
   40    H    LYS 110           H        LYS 110  -1.294   6.699   2.415
   41    HA   LYS 110           HA       LYS 110  -0.352   4.313   0.919
   42    HB2  LYS 110          1HB       LYS 110   1.462   6.078   1.018
   43    HB3  LYS 110          2HB       LYS 110   1.443   5.922   2.775
   44    HG2  LYS 110          1HG       LYS 110   2.087   3.514   2.553
   45    HG3  LYS 110          2HG       LYS 110   2.010   3.670   0.795
   46    HD2  LYS 110          1HD       LYS 110   4.309   3.766   1.386
   47    HD3  LYS 110          2HD       LYS 110   3.839   5.397   0.904
   48    HE2  LYS 110          1HE       LYS 110   3.642   6.064   3.278
   49    HE3  LYS 110          2HE       LYS 110   3.974   4.406   3.794
   50    HZ1  LYS 110          1HZ       LYS 110   5.905   6.154   2.362
   51    HZ2  LYS 110          2HZ       LYS 110   6.200   4.606   2.842
   52    HZ3  LYS 110          3HZ       LYS 110   5.939   5.758   3.950
   53    H    ILE 111           H        ILE 111  -0.365   2.444   2.024
   54    HA   ILE 111           HA       ILE 111  -1.140   2.503   4.915
   55    HB   ILE 111           HB       ILE 111  -2.465   0.603   4.714
   56   HG12  ILE 111          1HG1      ILE 111  -1.401   0.186   1.921
   57   HG13  ILE 111          2HG1      ILE 111  -1.135  -0.837   3.327
   58   HG21  ILE 111          1HG2      ILE 111  -3.173   2.183   2.223
   59   HG22  ILE 111          2HG2      ILE 111  -4.261   1.301   3.323
   60   HG23  ILE 111          3HG2      ILE 111  -3.421   2.748   3.895
   61   HD11  ILE 111          1HD1      ILE 111  -3.787  -0.495   1.893
   62   HD12  ILE 111          2HD1      ILE 111  -2.726  -1.910   1.882
   63   HD13  ILE 111          3HD1      ILE 111  -3.535  -1.429   3.385
   64    H    PHE 112           H        PHE 112  -0.351   0.993   6.220
   65    HA   PHE 112           HA       PHE 112   2.203  -0.402   5.630
   66    HB2  PHE 112          1HB       PHE 112   1.834   0.957   7.730
   67    HB3  PHE 112          2HB       PHE 112   0.477  -0.072   8.132
   68    HD1  PHE 112          1HD       PHE 112   4.122   0.200   7.980
   69    HD2  PHE 112          2HD       PHE 112   0.839  -2.420   8.905
   70    HE1  PHE 112          1HE       PHE 112   5.655  -1.255   9.241
   71    HE2  PHE 112          2HE       PHE 112   2.377  -3.855  10.238
   72    HZ   PHE 112           HZ       PHE 112   4.794  -3.284  10.401
   73    H    VAL 113           H        VAL 113   2.210  -2.641   5.507
   74    HA   VAL 113           HA       VAL 113  -0.306  -4.178   5.991
   75    HB   VAL 113           HB       VAL 113   1.686  -4.795   3.795
   76   HG11  VAL 113          1HG1      VAL 113  -1.074  -5.929   4.432
   77   HG12  VAL 113          2HG1      VAL 113  -0.034  -6.395   3.067
   78   HG13  VAL 113          3HG1      VAL 113   0.473  -6.755   4.720
   79   HG21  VAL 113          1HG2      VAL 113  -1.069  -3.520   3.570
   80   HG22  VAL 113          2HG2      VAL 113   0.486  -2.758   3.164
   81   HG23  VAL 113          3HG2      VAL 113  -0.088  -4.127   2.216
   82    H    GLY 114           H        GLY 114   0.031  -5.219   7.834
   83    HA2  GLY 114          1HA       GLY 114   2.789  -6.067   8.603
   84    HA3  GLY 114          2HA       GLY 114   1.440  -5.751   9.681
   85    H    GLY 115           H        GLY 115   3.344  -8.097   9.205
   86    HA2  GLY 115          1HA       GLY 115   3.106 -10.267   9.979
   87    HA3  GLY 115          2HA       GLY 115   1.352 -10.178   9.799
   88    H    LEU 116           H        LEU 116   3.335  -9.314   7.056
   89    HA   LEU 116           HA       LEU 116   2.182 -11.313   5.304
   90    HB2  LEU 116          1HB       LEU 116   4.545  -9.404   5.107
   91    HB3  LEU 116          2HB       LEU 116   4.118 -10.487   3.791
   92    HG   LEU 116           HG       LEU 116   2.051  -8.571   4.927
   93   HD11  LEU 116          1HD1      LEU 116   3.981  -7.199   4.298
   94   HD12  LEU 116          2HD1      LEU 116   2.692  -7.006   3.101
   95   HD13  LEU 116          3HD1      LEU 116   4.091  -8.042   2.737
   96   HD21  LEU 116          1HD2      LEU 116   1.364 -10.437   3.321
   97   HD22  LEU 116          2HD2      LEU 116   2.453  -9.717   2.129
   98   HD23  LEU 116          3HD2      LEU 116   1.056  -8.798   2.719
   99    H    SER 117           H        SER 117   2.720 -13.412   5.131
  100    HA   SER 117           HA       SER 117   4.888 -14.622   6.578
  101    HB2  SER 117          1HB       SER 117   2.845 -15.840   5.977
  102    HB3  SER 117          2HB       SER 117   3.266 -15.725   4.256
  103    HG   SER 117           HG       SER 117   4.550 -17.346   4.508
  104    H    VAL 118           H        VAL 118   6.920 -15.326   5.917
  105    HA   VAL 118           HA       VAL 118   8.121 -13.535   4.110
  106    HB   VAL 118           HB       VAL 118   9.010 -14.653   6.277
  107   HG11  VAL 118          1HG1      VAL 118  10.426 -16.373   4.202
  108   HG12  VAL 118          2HG1      VAL 118  10.732 -16.308   5.946
  109   HG13  VAL 118          3HG1      VAL 118   9.194 -16.952   5.348
  110   HG21  VAL 118          1HG2      VAL 118   9.997 -12.750   5.164
  111   HG22  VAL 118          2HG2      VAL 118  11.249 -13.877   5.707
  112   HG23  VAL 118          3HG2      VAL 118  10.797 -13.809   3.982
  113    H    ASN 119           H        ASN 119   6.709 -16.388   3.168
  114    HA   ASN 119           HA       ASN 119   8.287 -16.799   0.721
  115    HB2  ASN 119          1HB       ASN 119   6.633 -18.435   0.180
  116    HB3  ASN 119          2HB       ASN 119   7.070 -18.637   1.875
  117   HD21  ASN 119          1HD2      ASN 119   4.492 -17.940  -0.348
  118   HD22  ASN 119          2HD2      ASN 119   3.281 -17.637   0.886
  119    H    THR 120           H        THR 120   5.810 -14.591   1.731
  120    HA   THR 120           HA       THR 120   4.615 -14.062  -0.857
  121    HB   THR 120           HB       THR 120   4.629 -12.368   1.672
  122    HG1  THR 120          1HG       THR 120   3.639 -14.149   2.232
  123   HG21  THR 120          1HG2      THR 120   2.880 -12.250  -0.804
  124   HG22  THR 120          2HG2      THR 120   3.861 -10.956  -0.089
  125   HG23  THR 120          3HG2      THR 120   2.423 -11.551   0.756
  126    H    THR 121           H        THR 121   5.039 -12.556  -2.348
  127    HA   THR 121           HA       THR 121   7.330 -10.715  -1.879
  128    HB   THR 121           HB       THR 121   7.829 -12.533  -3.507
  129    HG1  THR 121          1HG       THR 121   8.935 -11.065  -4.762
  130   HG21  THR 121          1HG2      THR 121   6.065 -10.861  -5.366
  131   HG22  THR 121          2HG2      THR 121   5.691 -12.504  -4.798
  132   HG23  THR 121          3HG2      THR 121   7.106 -12.224  -5.820
  133    H    VAL 122           H        VAL 122   7.380  -8.781  -3.232
  134    HA   VAL 122           HA       VAL 122   5.253  -7.111  -2.448
  135    HB   VAL 122           HB       VAL 122   7.631  -6.477  -2.860
  136   HG11  VAL 122          1HG1      VAL 122   6.854  -6.246  -5.799
  137   HG12  VAL 122          2HG1      VAL 122   8.390  -5.788  -5.046
  138   HG13  VAL 122          3HG1      VAL 122   7.932  -7.494  -5.126
  139   HG21  VAL 122          1HG2      VAL 122   5.575  -4.734  -4.258
  140   HG22  VAL 122          2HG2      VAL 122   5.879  -4.790  -2.506
  141   HG23  VAL 122          3HG2      VAL 122   7.144  -4.223  -3.621
  142    H    GLU 123           H        GLU 123   5.716  -8.713  -5.568
  143    HA   GLU 123           HA       GLU 123   3.622  -7.302  -6.944
  144    HB2  GLU 123          1HB       GLU 123   4.751 -10.089  -7.443
  145    HB3  GLU 123          2HB       GLU 123   3.769  -9.175  -8.579
  146    HG2  GLU 123          1HG       GLU 123   6.547  -8.392  -7.584
  147    HG3  GLU 123          2HG       GLU 123   6.176  -9.148  -9.123
  148    H    ASP 124           H        ASP 124   3.552 -10.194  -4.842
  149    HA   ASP 124           HA       ASP 124   0.869 -11.067  -5.473
  150    HB2  ASP 124          1HB       ASP 124   2.260 -11.218  -2.766
  151    HB3  ASP 124          2HB       ASP 124   0.917 -12.198  -3.320
  152    H    VAL 125           H        VAL 125   2.252  -8.824  -3.089
  153    HA   VAL 125           HA       VAL 125  -0.211  -8.061  -1.828
  154    HB   VAL 125           HB       VAL 125   2.477  -6.628  -1.894
  155   HG11  VAL 125          1HG1      VAL 125   0.158  -6.396   0.064
  156   HG12  VAL 125          2HG1      VAL 125   1.739  -5.600   0.224
  157   HG13  VAL 125          3HG1      VAL 125   0.666  -5.152  -1.104
  158   HG21  VAL 125          1HG2      VAL 125   1.321  -8.684   0.034
  159   HG22  VAL 125          2HG2      VAL 125   2.757  -8.879  -0.992
  160   HG23  VAL 125          3HG2      VAL 125   2.776  -7.732   0.347
  161    H    LYS 126           H        LYS 126   1.739  -6.453  -4.382
  162    HA   LYS 126           HA       LYS 126   0.004  -4.231  -4.809
  163    HB2  LYS 126          1HB       LYS 126   2.302  -4.367  -5.661
  164    HB3  LYS 126          2HB       LYS 126   1.855  -5.696  -6.737
  165    HG2  LYS 126          1HG       LYS 126   0.346  -4.202  -8.000
  166    HG3  LYS 126          2HG       LYS 126   0.707  -2.871  -6.882
  167    HD2  LYS 126          1HD       LYS 126   3.092  -2.948  -7.548
  168    HD3  LYS 126          2HD       LYS 126   2.747  -4.313  -8.634
  169    HE2  LYS 126          1HE       LYS 126   1.151  -2.872  -9.903
  170    HE3  LYS 126          2HE       LYS 126   1.555  -1.510  -8.850
  171    HZ1  LYS 126          1HZ       LYS 126   3.860  -1.673  -9.645
  172    HZ2  LYS 126          2HZ       LYS 126   2.853  -1.468 -10.913
  173    HZ3  LYS 126          3HZ       LYS 126   3.485  -2.940 -10.605
  174    H    HIS 127           H        HIS 127   0.021  -7.404  -6.536
  175    HA   HIS 127           HA       HIS 127  -2.286  -6.793  -8.135
  176    HB2  HIS 127          1HB       HIS 127  -0.953  -9.404  -7.379
  177    HB3  HIS 127          2HB       HIS 127  -2.405  -9.333  -8.372
  178    HD2  HIS 127          2HD       HIS 127   1.137  -9.593  -8.899
  179    HE1  HIS 127          1HE       HIS 127  -0.237  -7.553 -12.381
  180    HE2  HIS 127          2HE       HIS 127   1.715  -8.831 -11.359
  181    H    TYR 128           H        TYR 128  -2.053  -8.280  -4.872
  182    HA   TYR 128           HA       TYR 128  -4.835  -8.871  -4.721
  183    HB2  TYR 128          1HB       TYR 128  -3.434 -10.018  -3.239
  184    HB3  TYR 128          2HB       TYR 128  -2.766  -8.529  -2.580
  185    HD1  TYR 128          1HD       TYR 128  -5.608 -10.846  -2.487
  186    HD2  TYR 128          2HD       TYR 128  -4.057  -7.101  -1.004
  187    HE1  TYR 128          1HE       TYR 128  -7.384 -10.794  -0.738
  188    HE2  TYR 128          2HE       TYR 128  -5.853  -7.031   0.700
  189    HH   TYR 128           HH       TYR 128  -7.783  -8.016   1.472
  190    H    PHE 129           H        PHE 129  -3.145  -5.954  -3.457
  191    HA   PHE 129           HA       PHE 129  -5.599  -4.842  -2.552
  192    HB2  PHE 129          1HB       PHE 129  -2.861  -3.672  -2.797
  193    HB3  PHE 129          2HB       PHE 129  -4.240  -2.684  -2.351
  194    HD1  PHE 129          1HD       PHE 129  -1.745  -4.897  -1.073
  195    HD2  PHE 129          2HD       PHE 129  -5.763  -3.512  -0.380
  196    HE1  PHE 129          1HE       PHE 129  -1.616  -5.685   1.280
  197    HE2  PHE 129          2HE       PHE 129  -5.623  -4.321   1.969
  198    HZ   PHE 129           HZ       PHE 129  -3.554  -5.397   2.799
  199    H    GLU 130           H        GLU 130  -4.374  -4.711  -5.758
  200    HA   GLU 130           HA       GLU 130  -5.854  -2.445  -6.649
  201    HB2  GLU 130          1HB       GLU 130  -4.714  -4.862  -8.062
  202    HB3  GLU 130          2HB       GLU 130  -5.728  -3.690  -8.918
  203    HG2  GLU 130          1HG       GLU 130  -4.235  -1.848  -8.070
  204    HG3  GLU 130          2HG       GLU 130  -3.129  -3.085  -7.480
  205    H    GLN 131           H        GLN 131  -7.200  -5.425  -5.564
  206    HA   GLN 131           HA       GLN 131  -9.535  -5.473  -7.235
  207    HB2  GLN 131          1HB       GLN 131 -10.418  -7.026  -5.687
  208    HB3  GLN 131          2HB       GLN 131  -8.681  -7.322  -5.742
  209    HG2  GLN 131          1HG       GLN 131  -8.501  -5.908  -3.611
  210    HG3  GLN 131          2HG       GLN 131 -10.265  -5.904  -3.551
  211   HE21  GLN 131          1HE2      GLN 131  -7.392  -7.988  -3.452
  212   HE22  GLN 131          2HE2      GLN 131  -8.188  -9.335  -2.644
  213    H    PHE 132           H        PHE 132  -8.701  -3.506  -4.423
  214    HA   PHE 132           HA       PHE 132 -11.458  -2.612  -3.934
  215    HB2  PHE 132          1HB       PHE 132  -8.800  -1.698  -2.757
  216    HB3  PHE 132          2HB       PHE 132 -10.399  -1.305  -2.139
  217    HD1  PHE 132          1HD       PHE 132 -11.962  -3.440  -1.639
  218    HD2  PHE 132          2HD       PHE 132  -7.662  -3.528  -1.835
  219    HE1  PHE 132          1HE       PHE 132 -11.941  -5.570  -0.358
  220    HE2  PHE 132          2HE       PHE 132  -7.638  -5.628  -0.509
  221    HZ   PHE 132           HZ       PHE 132  -9.780  -6.661   0.218
  222    H    GLY 133           H        GLY 133  -8.601  -1.407  -5.536
  223    HA2  GLY 133          1HA       GLY 133  -9.679   0.439  -7.284
  224    HA3  GLY 133          2HA       GLY 133  -9.316   1.364  -5.820
  225    H    LYS 134           H        LYS 134  -7.898   2.046  -8.040
  226    HA   LYS 134           HA       LYS 134  -5.719   0.380  -8.687
  227    HB2  LYS 134          1HB       LYS 134  -6.687   2.108 -10.195
  228    HB3  LYS 134          2HB       LYS 134  -5.997   3.364  -9.179
  229    HG2  LYS 134          1HG       LYS 134  -4.536   3.131 -11.031
  230    HG3  LYS 134          2HG       LYS 134  -3.686   2.394  -9.684
  231    HD2  LYS 134          1HD       LYS 134  -4.503   0.113 -10.540
  232    HD3  LYS 134          2HD       LYS 134  -5.249   0.970 -11.888
  233    HE2  LYS 134          1HE       LYS 134  -3.240   0.211 -12.785
  234    HE3  LYS 134          2HE       LYS 134  -2.911   1.907 -12.416
  235    HZ1  LYS 134          1HZ       LYS 134  -2.120  -0.437 -10.747
  236    HZ2  LYS 134          2HZ       LYS 134  -1.795   1.112 -10.341
  237    HZ3  LYS 134          3HZ       LYS 134  -1.107   0.454 -11.673
  238    H    VAL 135           H        VAL 135  -3.745   0.182  -8.099
  239    HA   VAL 135           HA       VAL 135  -2.692   1.550  -5.663
  240    HB   VAL 135           HB       VAL 135  -2.011  -1.044  -7.083
  241   HG11  VAL 135          1HG1      VAL 135  -0.605   0.171  -4.688
  242   HG12  VAL 135          2HG1      VAL 135  -0.437  -1.506  -5.229
  243   HG13  VAL 135          3HG1      VAL 135   0.109  -0.190  -6.274
  244   HG21  VAL 135          1HG2      VAL 135  -2.810  -2.064  -4.994
  245   HG22  VAL 135          2HG2      VAL 135  -3.076  -0.455  -4.282
  246   HG23  VAL 135          3HG2      VAL 135  -4.071  -0.998  -5.641
  247    H    ASP 136           H        ASP 136  -0.933   2.811  -5.770
  248    HA   ASP 136           HA       ASP 136   0.091   3.650  -8.405
  249    HB2  ASP 136          1HB       ASP 136  -0.520   5.426  -6.971
  250    HB3  ASP 136          2HB       ASP 136   0.352   4.734  -5.606
  251    H    ASP 137           H        ASP 137   1.384   2.178  -5.409
  252    HA   ASP 137           HA       ASP 137   3.506   0.807  -6.849
  253    HB2  ASP 137          1HB       ASP 137   4.342   3.245  -6.503
  254    HB3  ASP 137          2HB       ASP 137   4.311   2.907  -4.774
  255    H    ALA 138           H        ALA 138   4.811  -0.514  -5.281
  256    HA   ALA 138           HA       ALA 138   3.810  -0.775  -2.532
  257    HB1  ALA 138          1HB       ALA 138   2.375  -2.346  -3.798
  258    HB2  ALA 138          2HB       ALA 138   3.824  -3.135  -4.462
  259    HB3  ALA 138          3HB       ALA 138   3.484  -3.216  -2.721
  260    H    MET 139           H        MET 139   5.285  -1.818  -1.113
  261    HA   MET 139           HA       MET 139   7.894  -2.764  -2.113
  262    HB2  MET 139          1HB       MET 139   9.199  -1.214  -0.744
  263    HB3  MET 139          2HB       MET 139   8.312  -0.381  -2.016
  264    HG2  MET 139          1HG       MET 139   6.580   0.290  -0.363
  265    HG3  MET 139          2HG       MET 139   7.508  -0.482   0.921
  266    HE1  MET 139          1HE       MET 139  10.511   0.282   0.492
  267    HE2  MET 139          2HE       MET 139  10.595   1.809   1.391
  268    HE3  MET 139          3HE       MET 139   9.637   0.456   2.031
  269    H    LEU 140           H        LEU 140   8.796  -4.295  -0.785
  270    HA   LEU 140           HA       LEU 140   7.679  -4.620   1.976
  271    HB2  LEU 140          1HB       LEU 140   9.004  -6.795   0.343
  272    HB3  LEU 140          2HB       LEU 140   8.292  -6.937   1.943
  273    HG   LEU 140           HG       LEU 140   6.823  -6.503  -0.685
  274   HD11  LEU 140          1HD1      LEU 140   5.815  -8.680  -0.145
  275   HD12  LEU 140          2HD1      LEU 140   6.734  -8.747   1.373
  276   HD13  LEU 140          3HD1      LEU 140   7.585  -8.815  -0.183
  277   HD21  LEU 140          1HD2      LEU 140   5.743  -6.500   2.155
  278   HD22  LEU 140          2HD2      LEU 140   4.739  -6.734   0.701
  279   HD23  LEU 140          3HD2      LEU 140   5.588  -5.217   0.931
  280    H    MET 141           H        MET 141   9.169  -5.096   3.656
  281    HA   MET 141           HA       MET 141  11.661  -3.610   3.268
  282    HB2  MET 141          1HB       MET 141  10.615  -4.884   5.806
  283    HB3  MET 141          2HB       MET 141  11.894  -3.675   5.645
  284    HG2  MET 141          1HG       MET 141   8.923  -3.379   5.394
  285    HG3  MET 141          2HG       MET 141  10.074  -2.421   6.311
  286    HE1  MET 141          1HE       MET 141  12.239  -1.569   3.946
  287    HE2  MET 141          2HE       MET 141  11.530   0.033   3.660
  288    HE3  MET 141          3HE       MET 141  11.641  -0.614   5.314
  289    H    PHE 142           H        PHE 142  12.430  -5.100   1.715
  290    HA   PHE 142           HA       PHE 142  13.175  -7.755   2.275
  291    HB2  PHE 142          1HB       PHE 142  13.863  -5.851   0.042
  292    HB3  PHE 142          2HB       PHE 142  14.439  -7.500   0.068
  293    HD1  PHE 142          1HD       PHE 142  12.455  -9.321   0.642
  294    HD2  PHE 142          2HD       PHE 142  12.005  -5.524  -1.346
  295    HE1  PHE 142          1HE       PHE 142  10.544 -10.227  -0.662
  296    HE2  PHE 142          2HE       PHE 142  10.081  -6.423  -2.630
  297    HZ   PHE 142           HZ       PHE 142   9.357  -8.784  -2.298
  298    H    ASP 143           H        ASP 143  15.045  -8.894   2.220
  299    HA   ASP 143           HA       ASP 143  17.627  -7.497   2.706
  300    HB2  ASP 143          1HB       ASP 143  17.156  -8.522   4.753
  301    HB3  ASP 143          2HB       ASP 143  16.571  -9.997   3.984
  302    H    LYS 144           H        LYS 144  18.641  -7.451   0.835
  303    HA   LYS 144           HA       LYS 144  18.096  -9.239  -1.331
  304    HB2  LYS 144          1HB       LYS 144  20.369  -7.249  -0.936
  305    HB3  LYS 144          2HB       LYS 144  19.979  -8.029  -2.460
  306    HG2  LYS 144          1HG       LYS 144  18.228  -6.072  -0.915
  307    HG3  LYS 144          2HG       LYS 144  19.073  -5.774  -2.425
  308    HD2  LYS 144          1HD       LYS 144  16.718  -7.678  -2.034
  309    HD3  LYS 144          2HD       LYS 144  16.670  -6.088  -2.789
  310    HE2  LYS 144          1HE       LYS 144  18.110  -6.814  -4.614
  311    HE3  LYS 144          2HE       LYS 144  18.373  -8.387  -3.846
  312    HZ1  LYS 144          1HZ       LYS 144  16.665  -8.458  -5.598
  313    HZ2  LYS 144          2HZ       LYS 144  15.711  -7.437  -4.750
  314    HZ3  LYS 144          3HZ       LYS 144  16.074  -8.929  -4.151
  315    H    THR 145           H        THR 145  20.078  -9.900   1.321
  316    HA   THR 145           HA       THR 145  21.920 -11.684   0.031
  317    HB   THR 145           HB       THR 145  21.037 -12.208   2.836
  318    HG1  THR 145          1HG       THR 145  21.234 -10.073   2.938
  319   HG21  THR 145          1HG2      THR 145  22.808 -13.618   1.858
  320   HG22  THR 145          2HG2      THR 145  23.456 -12.596   3.149
  321   HG23  THR 145          3HG2      THR 145  23.753 -12.168   1.448
  322    H    THR 146           H        THR 146  18.612 -12.141   1.084
  323    HA   THR 146           HA       THR 146  18.557 -14.784  -0.254
  324    HB   THR 146           HB       THR 146  17.619 -15.988   1.455
  325    HG1  THR 146          1HG       THR 146  16.897 -14.978   3.379
  326   HG21  THR 146          1HG2      THR 146  18.996 -15.829   3.437
  327   HG22  THR 146          2HG2      THR 146  19.477 -14.166   3.049
  328   HG23  THR 146          3HG2      THR 146  20.015 -15.524   2.025
  329    H    ASN 147           H        ASN 147  17.101 -11.856  -0.127
  330    HA   ASN 147           HA       ASN 147  15.233 -10.920  -0.800
  331    HB2  ASN 147          1HB       ASN 147  14.730 -13.475  -2.348
  332    HB3  ASN 147          2HB       ASN 147  13.782 -12.002  -2.509
  333   HD21  ASN 147          1HD2      ASN 147  16.269 -13.620  -3.958
  334   HD22  ASN 147          2HD2      ASN 147  17.065 -12.235  -4.689
  335    H    ARG 148           H        ARG 148  15.253 -12.765   1.660
  336    HA   ARG 148           HA       ARG 148  12.379 -12.938   2.328
  337    HB2  ARG 148          1HB       ARG 148  14.995 -13.268   3.826
  338    HB3  ARG 148          2HB       ARG 148  13.507 -13.114   4.715
  339    HG2  ARG 148          1HG       ARG 148  14.450 -15.455   4.258
  340    HG3  ARG 148          2HG       ARG 148  12.727 -15.199   4.164
  341    HD2  ARG 148          1HD       ARG 148  14.485 -15.208   1.700
  342    HD3  ARG 148          2HD       ARG 148  13.814 -16.682   2.394
  343    HE   ARG 148           HE       ARG 148  11.533 -15.377   2.165
  344   HH11  ARG 148          1HH1      ARG 148  14.061 -15.397  -0.302
  345   HH12  ARG 148          2HH1      ARG 148  12.877 -15.253  -1.574
  346   HH21  ARG 148          1HH2      ARG 148  10.195 -14.945   0.565
  347   HH22  ARG 148          2HH2      ARG 148  10.740 -14.934  -1.099
  348    H    HIS 149           H        HIS 149  11.643 -11.684   4.336
  349    HA   HIS 149           HA       HIS 149  12.644  -8.897   4.392
  350    HB2  HIS 149          1HB       HIS 149  10.341  -8.007   3.998
  351    HB3  HIS 149          2HB       HIS 149  11.049  -8.788   2.600
  352    HD2  HIS 149          2HD       HIS 149   9.626 -10.566   1.418
  353    HE1  HIS 149          1HE       HIS 149   6.601 -11.133   4.354
  354    HE2  HIS 149          2HE       HIS 149   7.335 -11.690   1.962
  355    H    ARG 150           H        ARG 150  11.497  -7.573   5.977
  356    HA   ARG 150           HA       ARG 150  11.582  -8.824   8.577
  357    HB2  ARG 150          1HB       ARG 150  10.626  -6.058   7.763
  358    HB3  ARG 150          2HB       ARG 150  10.894  -6.589   9.425
  359    HG2  ARG 150          1HG       ARG 150  13.285  -6.941   8.992
  360    HG3  ARG 150          2HG       ARG 150  13.065  -6.462   7.304
  361    HD2  ARG 150          1HD       ARG 150  13.940  -4.568   8.483
  362    HD3  ARG 150          2HD       ARG 150  12.264  -4.228   8.045
  363    HE   ARG 150           HE       ARG 150  12.526  -5.328  10.735
  364   HH11  ARG 150          1HH1      ARG 150  12.952  -2.299   9.018
  365   HH12  ARG 150          2HH1      ARG 150  12.298  -1.365  10.351
  366   HH21  ARG 150          1HH2      ARG 150  11.889  -4.006  12.458
  367   HH22  ARG 150          2HH2      ARG 150  11.876  -2.266  12.237
  368    H    GLY 151           H        GLY 151   9.093  -9.314   6.535
  369    HA2  GLY 151          1HA       GLY 151   7.064 -10.321   6.975
  370    HA3  GLY 151          2HA       GLY 151   7.209  -9.925   8.693
  371    H    PHE 152           H        PHE 152   7.607  -7.227   6.533
  372    HA   PHE 152           HA       PHE 152   4.770  -6.573   6.408
  373    HB2  PHE 152          1HB       PHE 152   4.837  -4.581   7.720
  374    HB3  PHE 152          2HB       PHE 152   5.439  -5.862   8.735
  375    HD1  PHE 152          1HD       PHE 152   6.172  -2.678   7.117
  376    HD2  PHE 152          2HD       PHE 152   7.928  -5.975   9.269
  377    HE1  PHE 152          1HE       PHE 152   8.128  -1.265   7.684
  378    HE2  PHE 152          2HE       PHE 152   9.904  -4.561   9.800
  379    HZ   PHE 152           HZ       PHE 152   9.997  -2.212   9.016
  380    H    GLY 153           H        GLY 153   4.469  -4.439   5.355
  381    HA2  GLY 153          1HA       GLY 153   6.658  -3.097   4.007
  382    HA3  GLY 153          2HA       GLY 153   5.708  -4.095   2.904
  383    H    PHE 154           H        PHE 154   5.451  -1.928   1.958
  384    HA   PHE 154           HA       PHE 154   3.051  -0.546   3.008
  385    HB2  PHE 154          1HB       PHE 154   5.509   0.726   1.787
  386    HB3  PHE 154          2HB       PHE 154   3.989   1.559   2.071
  387    HD1  PHE 154          1HD       PHE 154   3.226   2.134   4.332
  388    HD2  PHE 154          2HD       PHE 154   6.932   0.024   3.682
  389    HE1  PHE 154          1HE       PHE 154   3.901   2.591   6.674
  390    HE2  PHE 154          2HE       PHE 154   7.575   0.424   6.028
  391    HZ   PHE 154           HZ       PHE 154   6.077   1.728   7.533
  392    H    VAL 155           H        VAL 155   1.582   0.353   1.613
  393    HA   VAL 155           HA       VAL 155   1.937  -0.088  -1.306
  394    HB   VAL 155           HB       VAL 155  -0.675  -0.751   0.063
  395   HG11  VAL 155          1HG1      VAL 155  -1.260  -1.711  -2.130
  396   HG12  VAL 155          2HG1      VAL 155  -0.919   0.015  -2.260
  397   HG13  VAL 155          3HG1      VAL 155   0.302  -1.169  -2.784
  398   HG21  VAL 155          1HG2      VAL 155  -0.234  -3.090  -0.474
  399   HG22  VAL 155          2HG2      VAL 155   1.404  -2.673  -1.035
  400   HG23  VAL 155          3HG2      VAL 155   0.954  -2.484   0.674
  401    H    THR 156           H        THR 156   1.676   1.676  -2.392
  402    HA   THR 156           HA       THR 156   0.255   3.991  -1.249
  403    HB   THR 156           HB       THR 156   1.919   4.175  -3.722
  404    HG1  THR 156          1HG       THR 156   3.684   4.611  -2.440
  405   HG21  THR 156          1HG2      THR 156   1.310   6.124  -1.453
  406   HG22  THR 156          2HG2      THR 156   0.604   6.168  -3.086
  407   HG23  THR 156          3HG2      THR 156   2.332   6.462  -2.867
  408    H    PHE 157           H        PHE 157  -1.391   5.124  -2.286
  409    HA   PHE 157           HA       PHE 157  -2.825   3.519  -4.314
  410    HB2  PHE 157          1HB       PHE 157  -3.805   4.939  -1.871
  411    HB3  PHE 157          2HB       PHE 157  -4.881   4.488  -3.180
  412    HD1  PHE 157          1HD       PHE 157  -5.647   2.244  -3.487
  413    HD2  PHE 157          2HD       PHE 157  -2.475   3.079  -0.692
  414    HE1  PHE 157          1HE       PHE 157  -5.822  -0.068  -2.594
  415    HE2  PHE 157          2HE       PHE 157  -2.619   0.762   0.155
  416    HZ   PHE 157           HZ       PHE 157  -4.298  -0.818  -0.775
  417    H    GLU 158           H        GLU 158  -4.300   4.376  -5.743
  418    HA   GLU 158           HA       GLU 158  -3.517   6.854  -7.022
  419    HB2  GLU 158          1HB       GLU 158  -4.430   4.960  -8.215
  420    HB3  GLU 158          2HB       GLU 158  -5.972   5.091  -7.384
  421    HG2  GLU 158          1HG       GLU 158  -4.813   7.387  -9.026
  422    HG3  GLU 158          2HG       GLU 158  -5.642   6.047  -9.801
  423    H    SER 159           H        SER 159  -6.097   6.023  -4.688
  424    HA   SER 159           HA       SER 159  -6.436   8.914  -4.081
  425    HB2  SER 159          1HB       SER 159  -8.209   8.415  -5.641
  426    HB3  SER 159          2HB       SER 159  -8.693   6.988  -4.699
  427    HG   SER 159           HG       SER 159  -9.885   9.050  -4.358
  428    H    GLU 160           H        GLU 160  -6.784   9.407  -1.996
  429    HA   GLU 160           HA       GLU 160  -6.466   7.523   0.139
  430    HB2  GLU 160          1HB       GLU 160  -7.074   9.336   1.589
  431    HB3  GLU 160          2HB       GLU 160  -5.865   9.858   0.452
  432    HG2  GLU 160          1HG       GLU 160  -8.816  10.546   0.347
  433    HG3  GLU 160          2HG       GLU 160  -7.508  11.543   0.992
  434    H    ASP 161           H        ASP 161  -9.288   8.381  -1.735
  435    HA   ASP 161           HA       ASP 161 -11.236   7.420   0.176
  436    HB2  ASP 161          1HB       ASP 161 -11.377   7.766  -2.830
  437    HB3  ASP 161          2HB       ASP 161 -12.704   7.155  -1.860
  438    H    ILE 162           H        ILE 162  -9.041   5.756  -1.979
  439    HA   ILE 162           HA       ILE 162 -10.387   3.151  -1.604
  440    HB   ILE 162           HB       ILE 162  -7.562   3.655  -2.596
  441   HG12  ILE 162          1HG1      ILE 162  -8.934   4.784  -4.170
  442   HG13  ILE 162          2HG1      ILE 162  -8.448   3.241  -4.854
  443   HG21  ILE 162          1HG2      ILE 162  -9.418   1.237  -2.709
  444   HG22  ILE 162          2HG2      ILE 162  -7.906   1.378  -3.632
  445   HG23  ILE 162          3HG2      ILE 162  -7.861   1.382  -1.873
  446   HD11  ILE 162          1HD1      ILE 162 -10.765   3.651  -5.428
  447   HD12  ILE 162          2HD1      ILE 162 -10.740   2.321  -4.253
  448   HD13  ILE 162          3HD1      ILE 162 -11.198   3.957  -3.738
  449    H    VAL 163           H        VAL 163  -7.600   4.961  -0.224
  450    HA   VAL 163           HA       VAL 163  -6.613   2.870   1.407
  451    HB   VAL 163           HB       VAL 163  -6.609   5.891   1.824
  452   HG11  VAL 163          1HG1      VAL 163  -6.333   5.105   4.052
  453   HG12  VAL 163          2HG1      VAL 163  -5.328   3.747   3.531
  454   HG13  VAL 163          3HG1      VAL 163  -4.700   5.410   3.459
  455   HG21  VAL 163          1HG2      VAL 163  -4.581   3.835   0.876
  456   HG22  VAL 163          2HG2      VAL 163  -5.369   5.114  -0.086
  457   HG23  VAL 163          3HG2      VAL 163  -4.205   5.536   1.185
  458    H    GLU 164           H        GLU 164  -9.122   5.335   2.213
  459    HA   GLU 164           HA       GLU 164  -9.639   4.217   4.817
  460    HB2  GLU 164          1HB       GLU 164 -11.532   5.599   4.964
  461    HB3  GLU 164          2HB       GLU 164 -10.271   6.508   4.125
  462    HG2  GLU 164          1HG       GLU 164 -11.387   6.086   1.976
  463    HG3  GLU 164          2HG       GLU 164 -12.652   5.155   2.789
  464    H    LYS 165           H        LYS 165 -11.034   3.374   1.660
  465    HA   LYS 165           HA       LYS 165 -13.106   1.581   2.559
  466    HB2  LYS 165          1HB       LYS 165 -13.002   2.587   0.328
  467    HB3  LYS 165          2HB       LYS 165 -11.494   1.771  -0.018
  468    HG2  LYS 165          1HG       LYS 165 -12.633  -0.436   0.065
  469    HG3  LYS 165          2HG       LYS 165 -14.178   0.403   0.338
  470    HD2  LYS 165          1HD       LYS 165 -13.881   1.628  -1.807
  471    HD3  LYS 165          2HD       LYS 165 -12.317   0.825  -2.057
  472    HE2  LYS 165          1HE       LYS 165 -13.467  -1.383  -2.092
  473    HE3  LYS 165          2HE       LYS 165 -15.024  -0.568  -1.884
  474    HZ1  LYS 165          1HZ       LYS 165 -13.182  -0.160  -4.193
  475    HZ2  LYS 165          2HZ       LYS 165 -14.635   0.574  -4.003
  476    HZ3  LYS 165          3HZ       LYS 165 -14.565  -1.038  -4.233
  477    H    VAL 166           H        VAL 166  -9.778   1.023   1.539
  478    HA   VAL 166           HA       VAL 166  -9.647  -1.815   2.043
  479    HB   VAL 166           HB       VAL 166  -7.457   0.292   1.978
  480   HG11  VAL 166          1HG1      VAL 166  -7.255  -2.722   1.754
  481   HG12  VAL 166          2HG1      VAL 166  -5.930  -1.580   1.460
  482   HG13  VAL 166          3HG1      VAL 166  -6.609  -1.731   3.084
  483   HG21  VAL 166          1HG2      VAL 166  -8.223  -1.669  -0.204
  484   HG22  VAL 166          2HG2      VAL 166  -8.822  -0.018  -0.186
  485   HG23  VAL 166          3HG2      VAL 166  -7.093  -0.304  -0.313
  486    H    CYS 167           H        CYS 167  -8.618   1.003   4.042
  487    HA   CYS 167           HA       CYS 167  -7.708  -0.535   6.246
  488    HB2  CYS 167          1HB       CYS 167  -8.566   2.364   6.033
  489    HB3  CYS 167          2HB       CYS 167  -7.936   1.638   7.523
  490    HG   CYS 167           HG       CYS 167  -6.556   2.009   4.573
  491    H    GLU 168           H        GLU 168 -11.041   0.599   5.586
  492    HA   GLU 168           HA       GLU 168 -12.145   0.025   8.130
  493    HB2  GLU 168          1HB       GLU 168 -13.219   1.442   6.519
  494    HB3  GLU 168          2HB       GLU 168 -13.153   0.198   5.280
  495    HG2  GLU 168          1HG       GLU 168 -15.363   0.456   5.961
  496    HG3  GLU 168          2HG       GLU 168 -14.817  -1.141   6.442
  497    H    ILE 169           H        ILE 169 -11.255  -2.153   5.495
  498    HA   ILE 169           HA       ILE 169 -12.767  -4.455   6.458
  499    HB   ILE 169           HB       ILE 169 -10.411  -4.201   4.567
  500   HG12  ILE 169          1HG1      ILE 169 -13.328  -4.836   3.906
  501   HG13  ILE 169          2HG1      ILE 169 -12.747  -3.178   3.964
  502   HG21  ILE 169          1HG2      ILE 169 -10.960  -6.506   3.807
  503   HG22  ILE 169          2HG2      ILE 169 -10.377  -6.453   5.457
  504   HG23  ILE 169          3HG2      ILE 169 -12.116  -6.651   5.149
  505   HD11  ILE 169          1HD1      ILE 169 -12.732  -3.922   1.684
  506   HD12  ILE 169          2HD1      ILE 169 -11.066  -3.657   2.227
  507   HD13  ILE 169          3HD1      ILE 169 -11.710  -5.311   2.084
  508    H    HIS 170           H        HIS 170  -9.596  -3.116   7.054
  509    HA   HIS 170           HA       HIS 170  -8.093  -3.276   8.694
  510    HB2  HIS 170          1HB       HIS 170 -10.120  -3.155  10.101
  511    HB3  HIS 170          2HB       HIS 170 -10.120  -4.909  10.229
  512    HD2  HIS 170          2HD       HIS 170  -6.659  -3.266  10.473
  513    HE1  HIS 170          1HE       HIS 170  -7.825  -4.242  14.452
  514    HE2  HIS 170          2HE       HIS 170  -5.884  -3.506  12.966
  515    H    PHE 171           H        PHE 171  -9.501  -6.520   8.301
  516    HA   PHE 171           HA       PHE 171  -6.751  -7.567   8.060
  517    HB2  PHE 171          1HB       PHE 171  -8.961  -8.831   9.575
  518    HB3  PHE 171          2HB       PHE 171  -7.728  -9.816   8.807
  519    HD1  PHE 171          1HD       PHE 171  -8.303  -7.228  11.408
  520    HD2  PHE 171          2HD       PHE 171  -5.414  -9.824   9.530
  521    HE1  PHE 171          1HE       PHE 171  -6.709  -6.808  13.267
  522    HE2  PHE 171          2HE       PHE 171  -3.828  -9.405  11.396
  523    HZ   PHE 171           HZ       PHE 171  -4.472  -7.898  13.263
  524    H    HIS 172           H        HIS 172  -6.033  -8.463   6.416
  525    HA   HIS 172           HA       HIS 172  -7.849  -9.119   4.120
  526    HB2  HIS 172          1HB       HIS 172  -5.203  -7.630   4.302
  527    HB3  HIS 172          2HB       HIS 172  -5.851  -8.232   2.795
  528    HD2  HIS 172          2HD       HIS 172  -6.646  -5.627   5.563
  529    HE1  HIS 172          1HE       HIS 172  -8.880  -4.470   2.151
  530    HE2  HIS 172          2HE       HIS 172  -8.148  -3.782   4.462
  531    H    GLU 173           H        GLU 173  -6.955 -10.688   2.551
  532    HA   GLU 173           HA       GLU 173  -5.235 -12.728   3.935
  533    HB2  GLU 173          1HB       GLU 173  -7.609 -13.349   3.811
  534    HB3  GLU 173          2HB       GLU 173  -7.555 -13.207   2.048
  535    HG2  GLU 173          1HG       GLU 173  -5.796 -14.976   1.971
  536    HG3  GLU 173          2HG       GLU 173  -5.855 -15.105   3.728
  537    H    ILE 174           H        ILE 174  -3.287 -12.935   3.042
  538    HA   ILE 174           HA       ILE 174  -3.004 -12.815   0.062
  539    HB   ILE 174           HB       ILE 174  -1.113 -11.481   2.030
  540   HG12  ILE 174          1HG1      ILE 174  -3.140 -10.314   0.072
  541   HG13  ILE 174          2HG1      ILE 174  -3.178 -10.185   1.830
  542   HG21  ILE 174          1HG2      ILE 174  -1.091 -11.581  -1.029
  543   HG22  ILE 174          2HG2      ILE 174   0.078 -10.727   0.002
  544   HG23  ILE 174          3HG2      ILE 174   0.019 -12.477   0.034
  545   HD11  ILE 174          1HD1      ILE 174  -1.050  -8.856   1.738
  546   HD12  ILE 174          2HD1      ILE 174  -1.224  -8.825  -0.035
  547   HD13  ILE 174          3HD1      ILE 174  -2.464  -8.092   0.989
  548    H    ASN 175           H        ASN 175  -2.001 -14.526  -0.763
  549    HA   ASN 175           HA       ASN 175  -1.336 -16.682  -0.821
  550    HB2  ASN 175          1HB       ASN 175   0.875 -15.567   0.933
  551    HB3  ASN 175          2HB       ASN 175   0.926 -17.153   0.169
  552   HD21  ASN 175          1HD2      ASN 175   2.447 -14.494  -0.204
  553   HD22  ASN 175          2HD2      ASN 175   2.506 -14.368  -1.969
  554    H    ASN 176           H        ASN 176  -3.414 -16.309   0.872
  555    HA   ASN 176           HA       ASN 176  -4.695 -17.085   2.487
  556    HB2  ASN 176          1HB       ASN 176  -2.960 -19.563   2.396
  557    HB3  ASN 176          2HB       ASN 176  -4.547 -19.441   3.153
  558   HD21  ASN 176          1HD2      ASN 176  -6.302 -18.361   1.533
  559   HD22  ASN 176          2HD2      ASN 176  -6.278 -19.162  -0.038
  560    H    LYS 177           H        LYS 177  -1.862 -15.864   3.382
  561    HA   LYS 177           HA       LYS 177  -2.210 -16.361   6.286
  562    HB2  LYS 177          1HB       LYS 177   0.092 -16.261   5.479
  563    HB3  LYS 177          2HB       LYS 177  -0.203 -14.689   4.723
  564    HG2  LYS 177          1HG       LYS 177   1.069 -14.344   6.699
  565    HG3  LYS 177          2HG       LYS 177  -0.543 -13.694   6.963
  566    HD2  LYS 177          1HD       LYS 177  -1.076 -15.990   8.098
  567    HD3  LYS 177          2HD       LYS 177   0.665 -16.277   8.072
  568    HE2  LYS 177          1HE       LYS 177  -0.667 -13.797   9.209
  569    HE3  LYS 177          2HE       LYS 177  -0.370 -15.251  10.179
  570    HZ1  LYS 177          1HZ       LYS 177   1.415 -13.665  10.482
  571    HZ2  LYS 177          2HZ       LYS 177   1.705 -13.562   8.881
  572    HZ3  LYS 177          3HZ       LYS 177   2.023 -14.971   9.701
  573    H    MET 178           H        MET 178  -3.080 -14.865   7.681
  574    HA   MET 178           HA       MET 178  -4.661 -12.666   6.529
  575    HB2  MET 178          1HB       MET 178  -4.460 -13.685   9.385
  576    HB3  MET 178          2HB       MET 178  -5.504 -12.375   8.837
  577    HG2  MET 178          1HG       MET 178  -5.654 -15.299   8.052
  578    HG3  MET 178          2HG       MET 178  -6.809 -14.393   9.017
  579    HE1  MET 178          1HE       MET 178  -8.411 -12.469   8.011
  580    HE2  MET 178          2HE       MET 178  -7.062 -11.627   7.211
  581    HE3  MET 178          3HE       MET 178  -8.505 -12.070   6.280
  582    H    VAL 179           H        VAL 179  -4.099 -10.598   6.577
  583    HA   VAL 179           HA       VAL 179  -1.794  -9.718   8.236
  584    HB   VAL 179           HB       VAL 179  -0.905  -8.410   6.395
  585   HG11  VAL 179          1HG1      VAL 179  -1.245 -11.303   5.519
  586   HG12  VAL 179          2HG1      VAL 179   0.087 -10.189   5.154
  587   HG13  VAL 179          3HG1      VAL 179  -0.158 -10.746   6.817
  588   HG21  VAL 179          1HG2      VAL 179  -2.904  -7.996   5.032
  589   HG22  VAL 179          2HG2      VAL 179  -1.604  -8.716   4.080
  590   HG23  VAL 179          3HG2      VAL 179  -2.971  -9.719   4.592
  591    H    GLU 180           H        GLU 180  -1.696  -7.556   8.782
  592    HA   GLU 180           HA       GLU 180  -4.398  -6.312   9.021
  593    HB2  GLU 180          1HB       GLU 180  -2.988  -6.822  11.053
  594    HB3  GLU 180          2HB       GLU 180  -1.855  -5.580  10.505
  595    HG2  GLU 180          1HG       GLU 180  -3.738  -3.914  10.546
  596    HG3  GLU 180          2HG       GLU 180  -4.814  -5.184  11.130
  597    H    CYS 181           H        CYS 181  -4.958  -4.539   7.856
  598    HA   CYS 181           HA       CYS 181  -2.846  -2.875   6.572
  599    HB2  CYS 181          1HB       CYS 181  -4.683  -1.751   5.407
  600    HB3  CYS 181          2HB       CYS 181  -4.646  -3.488   5.072
  601    HG   CYS 181           HG       CYS 181  -6.441  -1.975   7.400
  602    H    LYS 182           H        LYS 182  -2.324  -0.895   7.284
  603    HA   LYS 182           HA       LYS 182  -4.068   0.574   9.209
  604    HB2  LYS 182          1HB       LYS 182  -1.090   0.151   9.688
  605    HB3  LYS 182          2HB       LYS 182  -2.202   1.062  10.705
  606    HG2  LYS 182          1HG       LYS 182  -3.419  -1.029  11.255
  607    HG3  LYS 182          2HG       LYS 182  -2.299  -1.955  10.245
  608    HD2  LYS 182          1HD       LYS 182  -1.470  -0.375  12.708
  609    HD3  LYS 182          2HD       LYS 182  -1.797  -2.113  12.660
  610    HE2  LYS 182          1HE       LYS 182  -0.036  -2.313  10.835
  611    HE3  LYS 182          2HE       LYS 182   0.396  -0.629  11.159
  612    HZ1  LYS 182          1HZ       LYS 182   0.766  -2.987  12.883
  613    HZ2  LYS 182          2HZ       LYS 182   0.675  -1.484  13.571
  614    HZ3  LYS 182          3HZ       LYS 182   1.836  -1.808  12.480
  615    H    LYS 183           H        LYS 183  -3.751   2.889   9.108
  616    HA   LYS 183           HA       LYS 183  -2.678   3.965   6.633
  617    HB2  LYS 183          1HB       LYS 183  -3.417   5.309   9.261
  618    HB3  LYS 183          2HB       LYS 183  -2.896   6.186   7.815
  619    HG2  LYS 183          1HG       LYS 183  -4.799   5.360   6.532
  620    HG3  LYS 183          2HG       LYS 183  -5.315   4.326   7.877
  621    HD2  LYS 183          1HD       LYS 183  -5.660   6.324   9.301
  622    HD3  LYS 183          2HD       LYS 183  -5.177   7.375   7.952
  623    HE2  LYS 183          1HE       LYS 183  -7.064   6.589   6.606
  624    HE3  LYS 183          2HE       LYS 183  -7.498   5.396   7.838
  625    HZ1  LYS 183          1HZ       LYS 183  -8.010   7.203   9.359
  626    HZ2  LYS 183          2HZ       LYS 183  -8.865   7.426   7.988
  627    HZ3  LYS 183          3HZ       LYS 183  -7.536   8.339   8.285
  628    H    ALA 184           H        ALA 184  -0.677   4.756   6.107
  629    HA   ALA 184           HA       ALA 184   1.541   3.926   7.757
  630    HB1  ALA 184          1HB       ALA 184   2.919   4.907   5.978
  631    HB2  ALA 184          2HB       ALA 184   1.635   3.880   5.309
  632    HB3  ALA 184          3HB       ALA 184   1.475   5.651   5.253
  633    H    GLN 185           H        GLN 185   2.781   5.054   9.184
  634    HA   GLN 185           HA       GLN 185   2.735   8.011   9.136
  635    HB2  GLN 185          1HB       GLN 185   2.460   6.291  11.617
  636    HB3  GLN 185          2HB       GLN 185   2.936   7.982  11.678
  637    HG2  GLN 185          1HG       GLN 185   0.305   6.932  10.565
  638    HG3  GLN 185          2HG       GLN 185   0.543   7.656  12.150
  639   HE21  GLN 185          1HE2      GLN 185  -1.367   8.681  10.328
  640   HE22  GLN 185          2HE2      GLN 185  -0.817  10.282   9.853
  641    HA   PRO 186           HA       PRO 186   7.031   7.627   8.815
  642    HB2  PRO 186          1HB       PRO 186   7.425  10.005  10.612
  643    HB3  PRO 186          2HB       PRO 186   7.994   9.747   8.937
  644    HG2  PRO 186          1HG       PRO 186   5.882  11.375   9.450
  645    HG3  PRO 186          2HG       PRO 186   5.843  10.255   8.048
  646    HD2  PRO 186          1HD       PRO 186   4.592   9.863  10.789
  647    HD3  PRO 186          2HD       PRO 186   3.880   9.638   9.172
  648    H    LYS 187           H        LYS 187   8.929   6.773   9.780
  649    HA   LYS 187           HA       LYS 187   8.765   5.715  12.458
  650    HB2  LYS 187          1HB       LYS 187  11.096   4.987  12.116
  651    HB3  LYS 187          2HB       LYS 187  10.014   4.482  10.828
  652    HG2  LYS 187          1HG       LYS 187  10.891   6.120   9.297
  653    HG3  LYS 187          2HG       LYS 187  11.800   6.938  10.585
  654    HD2  LYS 187          1HD       LYS 187  13.260   5.016  10.871
  655    HD3  LYS 187          2HD       LYS 187  12.309   4.057   9.721
  656    HE2  LYS 187          1HE       LYS 187  12.890   5.564   7.890
  657    HE3  LYS 187          2HE       LYS 187  13.715   6.665   9.006
  658    HZ1  LYS 187          1HZ       LYS 187  14.577   3.868   8.414
  659    HZ2  LYS 187          2HZ       LYS 187  15.324   4.883   9.455
  660    HZ3  LYS 187          3HZ       LYS 187  15.291   5.223   7.858
  661    H    GLU 188           H        GLU 188   9.717   8.757  11.393
  662    HA   GLU 188           HA       GLU 188  11.236   9.583  13.755
  663    HB2  GLU 188          1HB       GLU 188   9.750  11.199  11.642
  664    HB3  GLU 188          2HB       GLU 188  10.796  11.870  12.907
  665    HG2  GLU 188          1HG       GLU 188  12.693  10.483  12.014
  666    HG3  GLU 188          2HG       GLU 188  11.659   9.992  10.668
  667    H    VAL 189           H        VAL 189   7.843   9.196  13.041
  668    HA   VAL 189           HA       VAL 189   6.994  10.553  15.558
  669    HB   VAL 189           HB       VAL 189   5.295   9.258  13.394
  670   HG11  VAL 189          1HG1      VAL 189   3.429  10.461  14.472
  671   HG12  VAL 189          2HG1      VAL 189   4.153   9.287  15.573
  672   HG13  VAL 189          3HG1      VAL 189   4.524  11.017  15.757
  673   HG21  VAL 189          1HG2      VAL 189   5.881  12.201  13.909
  674   HG22  VAL 189          2HG2      VAL 189   6.391  11.264  12.489
  675   HG23  VAL 189          3HG2      VAL 189   4.675  11.571  12.766
  676    H    MET 190           H        MET 190   6.829   7.400  13.901
  677    HA   MET 190           HA       MET 190   6.077   5.950  16.332
  678    HB2  MET 190          1HB       MET 190   6.696   4.954  13.521
  679    HB3  MET 190          2HB       MET 190   6.063   3.993  14.867
  680    HG2  MET 190          1HG       MET 190   4.119   5.653  14.978
  681    HG3  MET 190          2HG       MET 190   4.710   6.313  13.453
  682    HE1  MET 190          1HE       MET 190   2.726   2.189  14.116
  683    HE2  MET 190          2HE       MET 190   4.386   2.437  14.691
  684    HE3  MET 190          3HE       MET 190   3.053   3.416  15.353
  685    H    SER 191           H        SER 191   8.200   7.033  17.220
  686    HA   SER 191           HA       SER 191  10.721   5.961  16.645
  687    HB2  SER 191          1HB       SER 191   9.684   7.104  19.257
  688    HB3  SER 191          2HB       SER 191  11.386   6.763  18.900
  689    HG   SER 191           HG       SER 191  10.830   8.940  18.446
  690    HA   PRO 192           HA       PRO 192  10.185   2.623  20.100
  691    HB2  PRO 192          1HB       PRO 192   7.277   1.929  19.715
  692    HB3  PRO 192          2HB       PRO 192   8.267   1.879  21.207
  693    HG2  PRO 192          1HG       PRO 192   6.540   3.922  20.798
  694    HG3  PRO 192          2HG       PRO 192   8.189   4.268  21.421
  695    HD2  PRO 192          1HD       PRO 192   7.195   4.447  18.553
  696    HD3  PRO 192          2HD       PRO 192   8.122   5.651  19.493
  697    H    THR 193           H        THR 193  10.958   0.658  19.478
  698    HA   THR 193           HA       THR 193  10.896  -0.028  16.766
  699    HB   THR 193           HB       THR 193  11.962  -2.063  18.637
  700    HG1  THR 193          1HG       THR 193  13.711  -0.762  19.141
  701   HG21  THR 193          1HG2      THR 193  13.924  -1.905  17.141
  702   HG22  THR 193          2HG2      THR 193  13.152  -0.570  16.255
  703   HG23  THR 193          3HG2      THR 193  12.452  -2.201  16.209
  704    H    GLY 194           H        GLY 194   8.579  -1.048  18.973
  705    HA2  GLY 194          1HA       GLY 194   6.691  -2.335  18.657
  706    HA3  GLY 194          2HA       GLY 194   7.239  -2.703  17.025
  707    H    SER 195           H        SER 195   9.725  -3.976  17.767
  708    HA   SER 195           HA       SER 195   8.959  -6.665  18.300
  709    HB2  SER 195          1HB       SER 195  10.956  -5.973  17.025
  710    HB3  SER 195          2HB       SER 195  11.695  -5.359  18.516
  711    HG   SER 195           HG       SER 195  12.386  -7.494  17.977
  712    H    ALA 196           H        ALA 196   9.532  -8.068  20.039
  713    HA   ALA 196           HA       ALA 196  10.192  -6.962  22.679
  714    HB1  ALA 196          1HB       ALA 196   8.194  -7.942  23.755
  715    HB2  ALA 196          2HB       ALA 196   7.735  -6.708  22.568
  716    HB3  ALA 196          3HB       ALA 196   7.568  -8.433  22.165
  717    H    ARG 197           H        ARG 197  10.895  -8.510  24.178
  718    HA   ARG 197           HA       ARG 197  12.233 -10.801  22.960
  719    HB2  ARG 197          1HB       ARG 197  13.449 -10.953  25.043
  720    HB3  ARG 197          2HB       ARG 197  13.396  -9.285  24.487
  721    HG2  ARG 197          1HG       ARG 197  11.617  -8.769  26.147
  722    HG3  ARG 197          2HG       ARG 197  11.629 -10.458  26.688
  723    HD2  ARG 197          1HD       ARG 197  13.994 -10.240  27.357
  724    HD3  ARG 197          2HD       ARG 197  14.020  -8.567  26.810
  725    HE   ARG 197           HE       ARG 197  12.691  -9.676  29.219
  726   HH11  ARG 197          1HH1      ARG 197  13.245  -6.766  27.336
  727   HH12  ARG 197          2HH1      ARG 197  12.802  -5.725  28.661
  728   HH21  ARG 197          1HH2      ARG 197  12.114  -8.289  30.844
  729   HH22  ARG 197          2HH2      ARG 197  12.179  -6.570  30.588
  730    H    GLY 198           H        GLY 198   9.183 -10.647  24.344
  731    HA2  GLY 198          1HA       GLY 198   9.108 -13.011  25.954
  732    HA3  GLY 198          2HA       GLY 198   7.717 -12.199  25.247
  733    H    ARG 199           H        ARG 199   8.106 -15.014  25.591
  734    HA   ARG 199           HA       ARG 199   7.550 -15.992  22.857
  735    HB2  ARG 199          1HB       ARG 199  10.017 -16.233  23.182
  736    HB3  ARG 199          2HB       ARG 199   9.729 -17.194  24.621
  737    HG2  ARG 199          1HG       ARG 199   8.257 -18.398  22.413
  738    HG3  ARG 199          2HG       ARG 199   9.872 -18.003  21.857
  739    HD2  ARG 199          1HD       ARG 199   9.899 -20.248  22.688
  740    HD3  ARG 199          2HD       ARG 199  10.847 -19.242  23.782
  741    HE   ARG 199           HE       ARG 199   8.022 -20.195  24.268
  742   HH11  ARG 199          1HH1      ARG 199  11.205 -19.618  25.648
  743   HH12  ARG 199          2HH1      ARG 199  10.674 -20.068  27.245
  744   HH21  ARG 199          1HH2      ARG 199   7.388 -20.565  26.326
  745   HH22  ARG 199          2HH2      ARG 199   8.575 -20.635  27.610
  746    H    SER 200           H        SER 200   6.012 -17.525  22.843
  747    HA   SER 200           HA       SER 200   4.563 -18.302  25.249
  748    HB2  SER 200          1HB       SER 200   3.480 -17.895  23.043
  749    HB3  SER 200          2HB       SER 200   4.308 -19.328  22.395
  750    HG   SER 200           HG       SER 200   2.163 -19.792  23.186
  751    H5'    G 201           H5'        G 201   7.333 -12.981   7.351
  752   H5''    G 201           H5"        G 201   8.167 -11.978   8.537
  753    H4'    G 201           H4'        G 201   5.775 -11.745   8.807
  754    H3'    G 201           H3'        G 201   7.422 -12.168  10.919
  755    H2'    G 201           H2'        G 201   7.178 -14.537  10.944
  756   HO2'    G 201           HO2        G 201   6.508 -13.803  13.081
  757    H1'    G 201           H1'        G 201   4.207 -14.251  10.608
  758    H8     G 201          8H          G 201   7.234 -16.193   9.068
  759    H1     G 201          1H          G 201   1.979 -19.697  10.365
  760    H21    G 201          1H2         G 201   0.463 -18.378  11.344
  761    H22    G 201          2H2         G 201   0.822 -16.692  11.638
  762   HO5'    G 201           HO5        G 201   9.204 -13.963   8.446
  763    H5'    U 202           H5'        U 202   5.924  -8.945  10.442
  764   H5''    U 202           H5"        U 202   7.071  -8.669  11.759
  765    H4'    U 202           H4'        U 202   6.266  -6.550  10.838
  766    H3'    U 202           H3'        U 202   6.452  -7.100  13.529
  767    H2'    U 202           H2'        U 202   4.165  -7.619  13.817
  768   HO2'    U 202           HO2        U 202   4.794  -5.190  14.762
  769    H1'    U 202           H1'        U 202   3.462  -5.279  12.037
  770    H3     U 202          3H          U 202  -0.962  -6.037  12.795
  771    H5     U 202          5H          U 202   0.609  -9.914  12.556
  772    H6     U 202          6H          U 202   2.830  -8.956  12.231
  773    H5'    A 203           H5'        A 203   7.957  -3.465  11.524
  774   H5''    A 203           H5"        A 203   9.266  -3.080  12.649
  775    H4'    A 203           H4'        A 203   9.000  -1.326  11.010
  776    H3'    A 203           H3'        A 203   9.104  -0.761  13.755
  777    H2'    A 203           H2'        A 203   6.721  -0.481  13.879
  778   HO2'    A 203           HO2        A 203   8.084   1.956  13.546
  779    H1'    A 203           H1'        A 203   7.055   1.021  11.252
  780    H8     A 203          8H          A 203   4.420  -1.033  13.288
  781    H61    A 203          1H6         A 203   0.496   2.865  10.255
  782    H62    A 203          2H6         A 203   0.516   1.661  11.547
  783    H2     A 203          2H          A 203   4.443   3.573   8.798
  784    H5'    G 204           H5'        G 204  10.214   1.838   9.602
  785   H5''    G 204           H5"        G 204   9.213   0.399   9.335
  786    H4'    G 204           H4'        G 204  11.233  -0.513   7.983
  787    H3'    G 204           H3'        G 204  12.584   1.682   8.895
  788    H2'    G 204           H2'        G 204  11.028   3.204   7.934
  789   HO2'    G 204           HO2        G 204  13.154   2.967   6.064
  790    H1'    G 204           H1'        G 204  11.161   1.620   5.374
  791    H8     G 204          8H          G 204   9.589   2.711   3.654
  792    H1     G 204          1H          G 204   5.917   5.354   8.242
  793    H21    G 204          1H2         G 204   6.540   4.579  10.179
  794    H22    G 204          2H2         G 204   7.967   3.561  10.327
  795    H5'    U 205           H5'        U 205  13.717   0.535   4.416
  796   H5''    U 205           H5"        U 205  15.446   0.802   4.195
  797    H4'    U 205           H4'        U 205  14.309   1.620   2.273
  798    H3'    U 205           H3'        U 205  15.959   3.355   3.835
  799   HO3'    U 205           HO3        U 205  16.087   4.367   1.637
  800    H2'    U 205           H2'        U 205  14.118   4.712   4.423
  801   HO2'    U 205           HO2        U 205  15.478   6.154   3.230
  802    H1'    U 205           H1'        U 205  13.137   4.038   1.640
  803    H3     U 205          3H          U 205   9.119   5.968   1.278
  804    H5     U 205          5H          U 205  10.148   6.761   5.255
  805    H6     U 205          6H          U 205  12.136   5.381   4.981
  Start of MODEL   12
    1    H1   GLY 105          1H        GLY 105  -3.568  21.298   4.153
    2    H2   GLY 105          2H        GLY 105  -3.543  20.252   5.413
    3    H3   GLY 105          3H        GLY 105  -4.878  20.369   4.473
    4    HA2  GLY 105          1HA       GLY 105  -3.702  19.491   2.570
    5    HA3  GLY 105          2HA       GLY 105  -2.246  19.383   3.576
    6    H    SER 106           H        SER 106  -4.038  17.332   2.148
    7    HA   SER 106           HA       SER 106  -5.184  15.652   4.217
    8    HB2  SER 106          1HB       SER 106  -5.447  14.033   2.349
    9    HB3  SER 106          2HB       SER 106  -6.148  15.625   2.027
   10    HG   SER 106           HG       SER 106  -4.928  14.800   0.251
   11    H    HIS 107           H        HIS 107  -4.588  13.438   4.591
   12    HA   HIS 107           HA       HIS 107  -1.815  12.943   5.261
   13    HB2  HIS 107          1HB       HIS 107  -2.743  10.652   5.813
   14    HB3  HIS 107          2HB       HIS 107  -3.510  11.997   6.640
   15    HD2  HIS 107          2HD       HIS 107  -4.403   8.974   4.661
   16    HE1  HIS 107          1HE       HIS 107  -7.932  11.373   4.676
   17    HE2  HIS 107          2HE       HIS 107  -7.025   9.066   4.191
   18    H    MET 108           H        MET 108  -0.640  10.996   4.548
   19    HA   MET 108           HA       MET 108  -0.184  10.889   1.732
   20    HB2  MET 108          1HB       MET 108   0.520   8.886   3.918
   21    HB3  MET 108          2HB       MET 108   1.132   8.829   2.263
   22    HG2  MET 108          1HG       MET 108   2.166  11.056   2.559
   23    HG3  MET 108          2HG       MET 108   1.640  11.081   4.244
   24    HE1  MET 108          1HE       MET 108   3.842   8.353   5.950
   25    HE2  MET 108          2HE       MET 108   2.745   9.729   6.195
   26    HE3  MET 108          3HE       MET 108   2.149   8.241   5.428
   27    H    LYS 109           H        LYS 109  -0.859   9.520   0.125
   28    HA   LYS 109           HA       LYS 109  -3.186   7.802   0.532
   29    HB2  LYS 109          1HB       LYS 109  -1.474   8.263  -1.937
   30    HB3  LYS 109          2HB       LYS 109  -2.954   7.300  -1.889
   31    HG2  LYS 109          1HG       LYS 109  -4.276   9.281  -1.252
   32    HG3  LYS 109          2HG       LYS 109  -2.811  10.286  -1.336
   33    HD2  LYS 109          1HD       LYS 109  -2.497   9.566  -3.718
   34    HD3  LYS 109          2HD       LYS 109  -4.014   8.653  -3.622
   35    HE2  LYS 109          1HE       LYS 109  -5.283  10.703  -3.233
   36    HE3  LYS 109          2HE       LYS 109  -3.797  11.657  -3.141
   37    HZ1  LYS 109          1HZ       LYS 109  -3.369  11.172  -5.457
   38    HZ2  LYS 109          2HZ       LYS 109  -4.883  11.769  -5.353
   39    HZ3  LYS 109          3HZ       LYS 109  -4.642  10.160  -5.577
   40    H    LYS 110           H        LYS 110  -1.213   6.854   2.207
   41    HA   LYS 110           HA       LYS 110  -0.247   4.332   0.927
   42    HB2  LYS 110          1HB       LYS 110   1.508   6.158   0.972
   43    HB3  LYS 110          2HB       LYS 110   1.454   6.085   2.732
   44    HG2  LYS 110          1HG       LYS 110   2.157   3.679   2.627
   45    HG3  LYS 110          2HG       LYS 110   2.133   3.766   0.864
   46    HD2  LYS 110          1HD       LYS 110   4.413   3.952   1.539
   47    HD3  LYS 110          2HD       LYS 110   3.914   5.545   0.964
   48    HE2  LYS 110          1HE       LYS 110   3.592   6.299   3.308
   49    HE3  LYS 110          2HE       LYS 110   3.991   4.679   3.895
   50    HZ1  LYS 110          1HZ       LYS 110   6.232   4.965   2.983
   51    HZ2  LYS 110          2HZ       LYS 110   5.882   6.117   4.066
   52    HZ3  LYS 110          3HZ       LYS 110   5.867   6.482   2.463
   53    H    ILE 111           H        ILE 111  -0.321   2.535   2.080
   54    HA   ILE 111           HA       ILE 111  -0.995   2.684   4.994
   55    HB   ILE 111           HB       ILE 111  -2.194   0.618   4.863
   56   HG12  ILE 111          1HG1      ILE 111  -1.461   0.577   1.925
   57   HG13  ILE 111          2HG1      ILE 111  -0.985  -0.581   3.155
   58   HG21  ILE 111          1HG2      ILE 111  -3.266   2.366   2.630
   59   HG22  ILE 111          2HG2      ILE 111  -4.179   1.344   3.766
   60   HG23  ILE 111          3HG2      ILE 111  -3.365   2.793   4.360
   61   HD11  ILE 111          1HD1      ILE 111  -3.789  -0.226   2.054
   62   HD12  ILE 111          2HD1      ILE 111  -2.678  -1.574   1.773
   63   HD13  ILE 111          3HD1      ILE 111  -3.342  -1.310   3.393
   64    H    PHE 112           H        PHE 112  -0.111   1.256   6.332
   65    HA   PHE 112           HA       PHE 112   2.348  -0.244   5.639
   66    HB2  PHE 112          1HB       PHE 112   2.415   1.138   7.650
   67    HB3  PHE 112          2HB       PHE 112   0.914   0.445   8.238
   68    HD1  PHE 112          1HD       PHE 112   4.520   0.010   7.974
   69    HD2  PHE 112          2HD       PHE 112   0.854  -1.952   9.090
   70    HE1  PHE 112          1HE       PHE 112   5.804  -1.614   9.311
   71    HE2  PHE 112          2HE       PHE 112   2.149  -3.608  10.388
   72    HZ   PHE 112           HZ       PHE 112   4.630  -3.454  10.504
   73    H    VAL 113           H        VAL 113   2.294  -2.459   5.543
   74    HA   VAL 113           HA       VAL 113  -0.198  -3.903   6.317
   75    HB   VAL 113           HB       VAL 113   1.465  -4.566   3.878
   76   HG11  VAL 113          1HG1      VAL 113   0.337  -6.504   4.920
   77   HG12  VAL 113          2HG1      VAL 113  -1.204  -5.623   4.903
   78   HG13  VAL 113          3HG1      VAL 113  -0.418  -6.087   3.377
   79   HG21  VAL 113          1HG2      VAL 113  -1.226  -3.159   4.078
   80   HG22  VAL 113          2HG2      VAL 113   0.300  -2.503   3.422
   81   HG23  VAL 113          3HG2      VAL 113  -0.520  -3.816   2.583
   82    H    GLY 114           H        GLY 114   0.301  -5.021   8.059
   83    HA2  GLY 114          1HA       GLY 114   3.040  -6.225   8.359
   84    HA3  GLY 114          2HA       GLY 114   2.006  -5.709   9.682
   85    H    GLY 115           H        GLY 115   3.273  -8.330   9.073
   86    HA2  GLY 115          1HA       GLY 115   2.560 -10.470   9.767
   87    HA3  GLY 115          2HA       GLY 115   0.889 -10.089   9.366
   88    H    LEU 116           H        LEU 116   3.172  -9.200   6.912
   89    HA   LEU 116           HA       LEU 116   1.970 -10.953   4.946
   90    HB2  LEU 116          1HB       LEU 116   4.433  -9.168   4.986
   91    HB3  LEU 116          2HB       LEU 116   4.001 -10.109   3.565
   92    HG   LEU 116           HG       LEU 116   2.002  -8.191   4.824
   93   HD11  LEU 116          1HD1      LEU 116   2.728  -6.509   3.177
   94   HD12  LEU 116          2HD1      LEU 116   4.049  -7.578   2.660
   95   HD13  LEU 116          3HD1      LEU 116   4.035  -6.906   4.301
   96   HD21  LEU 116          1HD2      LEU 116   1.169  -9.844   3.118
   97   HD22  LEU 116          2HD2      LEU 116   2.386  -9.239   1.984
   98   HD23  LEU 116          3HD2      LEU 116   1.083  -8.170   2.534
   99    H    SER 117           H        SER 117   2.570 -12.948   4.222
  100    HA   SER 117           HA       SER 117   4.317 -14.587   5.749
  101    HB2  SER 117          1HB       SER 117   2.497 -15.509   4.358
  102    HB3  SER 117          2HB       SER 117   3.408 -15.074   2.902
  103    HG   SER 117           HG       SER 117   4.093 -16.931   4.937
  104    H    VAL 118           H        VAL 118   6.436 -15.268   5.475
  105    HA   VAL 118           HA       VAL 118   8.270 -13.688   3.942
  106    HB   VAL 118           HB       VAL 118   8.727 -15.034   6.040
  107   HG11  VAL 118          1HG1      VAL 118   7.910 -17.242   5.207
  108   HG12  VAL 118          2HG1      VAL 118   9.265 -17.287   4.054
  109   HG13  VAL 118          3HG1      VAL 118   9.578 -17.292   5.799
  110   HG21  VAL 118          1HG2      VAL 118  10.739 -15.237   3.769
  111   HG22  VAL 118          2HG2      VAL 118  10.463 -13.819   4.808
  112   HG23  VAL 118          3HG2      VAL 118  11.080 -15.325   5.506
  113    H    ASN 119           H        ASN 119   6.219 -16.226   2.937
  114    HA   ASN 119           HA       ASN 119   7.666 -16.966   0.498
  115    HB2  ASN 119          1HB       ASN 119   4.748 -17.332   1.334
  116    HB3  ASN 119          2HB       ASN 119   5.528 -18.097  -0.046
  117   HD21  ASN 119          1HD2      ASN 119   4.959 -18.309   3.344
  118   HD22  ASN 119          2HD2      ASN 119   5.907 -19.777   3.596
  119    H    THR 120           H        THR 120   5.484 -14.368   1.430
  120    HA   THR 120           HA       THR 120   4.400 -13.793  -1.165
  121    HB   THR 120           HB       THR 120   4.579 -12.035   1.303
  122    HG1  THR 120          1HG       THR 120   2.593 -12.885   1.780
  123   HG21  THR 120          1HG2      THR 120   2.525 -10.974   0.442
  124   HG22  THR 120          2HG2      THR 120   2.680 -11.898  -1.058
  125   HG23  THR 120          3HG2      THR 120   3.909 -10.690  -0.620
  126    H    THR 121           H        THR 121   4.996 -12.531  -2.745
  127    HA   THR 121           HA       THR 121   7.342 -10.737  -2.398
  128    HB   THR 121           HB       THR 121   7.696 -12.584  -4.022
  129    HG1  THR 121          1HG       THR 121   8.773 -11.166  -5.358
  130   HG21  THR 121          1HG2      THR 121   6.862 -12.275  -6.303
  131   HG22  THR 121          2HG2      THR 121   5.867 -10.893  -5.802
  132   HG23  THR 121          3HG2      THR 121   5.503 -12.527  -5.202
  133    H    VAL 122           H        VAL 122   7.358  -8.746  -3.635
  134    HA   VAL 122           HA       VAL 122   5.243  -7.127  -2.758
  135    HB   VAL 122           HB       VAL 122   7.600  -6.467  -3.153
  136   HG11  VAL 122          1HG1      VAL 122   6.812  -6.116  -6.082
  137   HG12  VAL 122          2HG1      VAL 122   8.351  -5.684  -5.321
  138   HG13  VAL 122          3HG1      VAL 122   7.898  -7.386  -5.467
  139   HG21  VAL 122          1HG2      VAL 122   5.570  -4.654  -4.500
  140   HG22  VAL 122          2HG2      VAL 122   5.840  -4.792  -2.744
  141   HG23  VAL 122          3HG2      VAL 122   7.130  -4.190  -3.809
  142    H    GLU 123           H        GLU 123   5.618  -8.591  -5.954
  143    HA   GLU 123           HA       GLU 123   3.474  -7.109  -7.200
  144    HB2  GLU 123          1HB       GLU 123   4.693  -9.817  -7.896
  145    HB3  GLU 123          2HB       GLU 123   3.565  -8.902  -8.913
  146    HG2  GLU 123          1HG       GLU 123   5.197  -6.994  -8.935
  147    HG3  GLU 123          2HG       GLU 123   6.354  -8.010  -8.069
  148    H    ASP 124           H        ASP 124   3.485 -10.008  -5.142
  149    HA   ASP 124           HA       ASP 124   0.727 -10.815  -5.671
  150    HB2  ASP 124          1HB       ASP 124   2.242 -11.097  -3.053
  151    HB3  ASP 124          2HB       ASP 124   0.842 -12.006  -3.572
  152    H    VAL 125           H        VAL 125   2.398  -8.740  -3.246
  153    HA   VAL 125           HA       VAL 125   0.104  -7.969  -1.782
  154    HB   VAL 125           HB       VAL 125   2.622  -6.298  -2.170
  155   HG11  VAL 125          1HG1      VAL 125   0.597  -6.407   0.107
  156   HG12  VAL 125          2HG1      VAL 125   2.061  -5.401   0.051
  157   HG13  VAL 125          3HG1      VAL 125   0.742  -5.088  -1.078
  158   HG21  VAL 125          1HG2      VAL 125   1.985  -8.551  -0.235
  159   HG22  VAL 125          2HG2      VAL 125   3.321  -8.473  -1.406
  160   HG23  VAL 125          3HG2      VAL 125   3.313  -7.393  -0.010
  161    H    LYS 126           H        LYS 126   1.616  -6.254  -4.570
  162    HA   LYS 126           HA       LYS 126  -0.411  -4.227  -4.730
  163    HB2  LYS 126          1HB       LYS 126   1.729  -3.954  -5.792
  164    HB3  LYS 126          2HB       LYS 126   1.456  -5.333  -6.865
  165    HG2  LYS 126          1HG       LYS 126  -0.166  -4.197  -8.140
  166    HG3  LYS 126          2HG       LYS 126  -0.496  -3.018  -6.868
  167    HD2  LYS 126          1HD       LYS 126   1.694  -1.946  -7.219
  168    HD3  LYS 126          2HD       LYS 126   2.088  -3.141  -8.476
  169    HE2  LYS 126          1HE       LYS 126   0.122  -2.414  -9.795
  170    HE3  LYS 126          2HE       LYS 126  -0.311  -1.240  -8.554
  171    HZ1  LYS 126          1HZ       LYS 126   2.233  -1.160 -10.091
  172    HZ2  LYS 126          2HZ       LYS 126   1.700  -0.001  -9.051
  173    HZ3  LYS 126          3HZ       LYS 126   0.912  -0.270 -10.441
  174    H    HIS 127           H        HIS 127  -0.286  -7.428  -6.417
  175    HA   HIS 127           HA       HIS 127  -2.727  -7.142  -7.822
  176    HB2  HIS 127          1HB       HIS 127  -0.955  -8.880  -8.149
  177    HB3  HIS 127          2HB       HIS 127  -1.510  -9.688  -6.682
  178    HD2  HIS 127          2HD       HIS 127  -2.223  -9.265 -10.346
  179    HE1  HIS 127          1HE       HIS 127  -5.357 -11.773  -8.884
  180    HE2  HIS 127          2HE       HIS 127  -4.256 -10.839 -10.985
  181    H    TYR 128           H        TYR 128  -2.229  -8.494  -4.502
  182    HA   TYR 128           HA       TYR 128  -4.967  -8.964  -3.994
  183    HB2  TYR 128          1HB       TYR 128  -2.544  -8.740  -2.275
  184    HB3  TYR 128          2HB       TYR 128  -4.116  -8.668  -1.529
  185    HD1  TYR 128          1HD       TYR 128  -5.782 -10.534  -1.828
  186    HD2  TYR 128          2HD       TYR 128  -1.640 -10.910  -2.949
  187    HE1  TYR 128          1HE       TYR 128  -5.972 -13.011  -1.707
  188    HE2  TYR 128          2HE       TYR 128  -1.828 -13.384  -2.838
  189    HH   TYR 128           HH       TYR 128  -4.896 -15.029  -2.026
  190    H    PHE 129           H        PHE 129  -3.223  -5.902  -3.649
  191    HA   PHE 129           HA       PHE 129  -5.650  -4.704  -2.532
  192    HB2  PHE 129          1HB       PHE 129  -2.929  -3.538  -2.972
  193    HB3  PHE 129          2HB       PHE 129  -4.326  -2.595  -2.452
  194    HD1  PHE 129          1HD       PHE 129  -5.743  -3.705  -0.410
  195    HD2  PHE 129          2HD       PHE 129  -1.595  -4.452  -1.288
  196    HE1  PHE 129          1HE       PHE 129  -5.444  -4.713   1.837
  197    HE2  PHE 129          2HE       PHE 129  -1.291  -5.423   0.974
  198    HZ   PHE 129           HZ       PHE 129  -3.216  -5.605   2.511
  199    H    GLU 130           H        GLU 130  -4.313  -4.868  -5.722
  200    HA   GLU 130           HA       GLU 130  -5.866  -2.834  -6.948
  201    HB2  GLU 130          1HB       GLU 130  -4.655  -5.415  -7.925
  202    HB3  GLU 130          2HB       GLU 130  -5.688  -4.450  -8.986
  203    HG2  GLU 130          1HG       GLU 130  -4.278  -2.471  -8.659
  204    HG3  GLU 130          2HG       GLU 130  -3.207  -3.378  -7.597
  205    H    GLN 131           H        GLN 131  -6.995  -5.752  -5.550
  206    HA   GLN 131           HA       GLN 131  -9.489  -6.165  -6.876
  207    HB2  GLN 131          1HB       GLN 131  -8.767  -6.439  -3.910
  208    HB3  GLN 131          2HB       GLN 131 -10.167  -7.162  -4.719
  209    HG2  GLN 131          1HG       GLN 131  -8.563  -8.333  -6.255
  210    HG3  GLN 131          2HG       GLN 131  -7.230  -7.806  -5.236
  211   HE21  GLN 131          1HE2      GLN 131  -7.451  -8.355  -2.830
  212   HE22  GLN 131          2HE2      GLN 131  -8.260  -9.875  -2.416
  213    H    PHE 132           H        PHE 132  -8.553  -4.022  -4.252
  214    HA   PHE 132           HA       PHE 132 -11.216  -2.951  -3.806
  215    HB2  PHE 132          1HB       PHE 132  -8.513  -2.108  -2.700
  216    HB3  PHE 132          2HB       PHE 132 -10.061  -1.475  -2.172
  217    HD1  PHE 132          1HD       PHE 132 -11.887  -3.282  -1.434
  218    HD2  PHE 132          2HD       PHE 132  -7.650  -4.028  -1.667
  219    HE1  PHE 132          1HE       PHE 132 -12.154  -5.284   0.005
  220    HE2  PHE 132          2HE       PHE 132  -7.908  -5.988  -0.176
  221    HZ   PHE 132           HZ       PHE 132 -10.166  -6.635   0.652
  222    H    GLY 133           H        GLY 133  -8.519  -1.828  -5.699
  223    HA2  GLY 133          1HA       GLY 133  -9.789  -0.082  -7.406
  224    HA3  GLY 133          2HA       GLY 133  -9.401   0.919  -6.007
  225    H    LYS 134           H        LYS 134  -8.117   1.967  -7.890
  226    HA   LYS 134           HA       LYS 134  -5.868   0.566  -8.990
  227    HB2  LYS 134          1HB       LYS 134  -7.057   2.330 -10.168
  228    HB3  LYS 134          2HB       LYS 134  -6.504   3.535  -8.999
  229    HG2  LYS 134          1HG       LYS 134  -4.168   3.180  -9.676
  230    HG3  LYS 134          2HG       LYS 134  -4.639   1.818 -10.707
  231    HD2  LYS 134          1HD       LYS 134  -5.938   3.310 -12.160
  232    HD3  LYS 134          2HD       LYS 134  -5.572   4.694 -11.111
  233    HE2  LYS 134          1HE       LYS 134  -3.150   4.410 -11.573
  234    HE3  LYS 134          2HE       LYS 134  -3.498   3.004 -12.586
  235    HZ1  LYS 134          1HZ       LYS 134  -3.216   5.008 -13.926
  236    HZ2  LYS 134          2HZ       LYS 134  -4.431   5.772 -13.149
  237    HZ3  LYS 134          3HZ       LYS 134  -4.746   4.467 -14.082
  238    H    VAL 135           H        VAL 135  -4.293  -0.144  -7.816
  239    HA   VAL 135           HA       VAL 135  -2.957   1.361  -5.670
  240    HB   VAL 135           HB       VAL 135  -2.229  -1.254  -7.031
  241   HG11  VAL 135          1HG1      VAL 135  -0.802  -1.632  -5.014
  242   HG12  VAL 135          2HG1      VAL 135  -0.227  -0.279  -5.992
  243   HG13  VAL 135          3HG1      VAL 135  -1.133   0.022  -4.493
  244   HG21  VAL 135          1HG2      VAL 135  -4.379  -1.357  -5.758
  245   HG22  VAL 135          2HG2      VAL 135  -3.097  -2.322  -5.019
  246   HG23  VAL 135          3HG2      VAL 135  -3.533  -0.743  -4.325
  247    H    ASP 136           H        ASP 136  -1.182   2.592  -5.885
  248    HA   ASP 136           HA       ASP 136  -0.116   3.226  -8.556
  249    HB2  ASP 136          1HB       ASP 136  -0.530   5.094  -7.128
  250    HB3  ASP 136          2HB       ASP 136   0.345   4.357  -5.794
  251    H    ASP 137           H        ASP 137   1.240   2.020  -5.442
  252    HA   ASP 137           HA       ASP 137   3.317   0.457  -6.841
  253    HB2  ASP 137          1HB       ASP 137   4.050   2.924  -6.774
  254    HB3  ASP 137          2HB       ASP 137   4.056   2.794  -5.015
  255    H    ALA 138           H        ALA 138   4.760  -0.618  -5.212
  256    HA   ALA 138           HA       ALA 138   3.813  -0.827  -2.454
  257    HB1  ALA 138          1HB       ALA 138   2.338  -2.445  -3.571
  258    HB2  ALA 138          2HB       ALA 138   3.730  -3.237  -4.332
  259    HB3  ALA 138          3HB       ALA 138   3.522  -3.300  -2.567
  260    H    MET 139           H        MET 139   5.351  -1.863  -1.046
  261    HA   MET 139           HA       MET 139   7.875  -2.889  -2.142
  262    HB2  MET 139          1HB       MET 139   9.302  -1.306  -0.875
  263    HB3  MET 139          2HB       MET 139   8.465  -0.600  -2.253
  264    HG2  MET 139          1HG       MET 139   6.809   0.443  -0.758
  265    HG3  MET 139          2HG       MET 139   7.583  -0.306   0.640
  266    HE1  MET 139          1HE       MET 139   6.990   2.697   0.737
  267    HE2  MET 139          2HE       MET 139   7.944   1.866   1.992
  268    HE3  MET 139          3HE       MET 139   8.536   3.386   1.282
  269    H    LEU 140           H        LEU 140   8.692  -4.463  -0.935
  270    HA   LEU 140           HA       LEU 140   7.653  -4.982   1.800
  271    HB2  LEU 140          1HB       LEU 140   9.465  -6.587  -0.032
  272    HB3  LEU 140          2HB       LEU 140   8.936  -7.113   1.566
  273    HG   LEU 140           HG       LEU 140   7.059  -6.589  -0.786
  274   HD11  LEU 140          1HD1      LEU 140   6.847  -9.066  -0.797
  275   HD12  LEU 140          2HD1      LEU 140   8.147  -9.170   0.397
  276   HD13  LEU 140          3HD1      LEU 140   8.486  -8.522  -1.221
  277   HD21  LEU 140          1HD2      LEU 140   5.888  -6.304   1.332
  278   HD22  LEU 140          2HD2      LEU 140   6.601  -7.810   1.969
  279   HD23  LEU 140          3HD2      LEU 140   5.443  -7.861   0.624
  280    H    MET 141           H        MET 141   8.927  -5.042   3.634
  281    HA   MET 141           HA       MET 141  11.478  -3.530   3.457
  282    HB2  MET 141          1HB       MET 141   9.659  -4.150   5.799
  283    HB3  MET 141          2HB       MET 141  11.183  -3.262   5.901
  284    HG2  MET 141          1HG       MET 141   8.766  -2.439   4.246
  285    HG3  MET 141          2HG       MET 141   9.265  -1.731   5.764
  286    HE1  MET 141          1HE       MET 141   8.762  -0.461   2.612
  287    HE2  MET 141          2HE       MET 141  10.297  -0.135   1.781
  288    HE3  MET 141          3HE       MET 141   9.710  -1.805   1.947
  289    H    PHE 142           H        PHE 142  12.752  -5.104   2.561
  290    HA   PHE 142           HA       PHE 142  13.174  -7.643   3.714
  291    HB2  PHE 142          1HB       PHE 142  14.623  -6.160   1.598
  292    HB3  PHE 142          2HB       PHE 142  15.330  -7.594   2.309
  293    HD1  PHE 142          1HD       PHE 142  14.494  -9.805   1.867
  294    HD2  PHE 142          2HD       PHE 142  12.423  -6.340   0.354
  295    HE1  PHE 142          1HE       PHE 142  13.117 -11.269   0.417
  296    HE2  PHE 142          2HE       PHE 142  11.077  -7.809  -1.134
  297    HZ   PHE 142           HZ       PHE 142  11.401 -10.270  -1.086
  298    H    ASP 143           H        ASP 143  14.629  -8.627   4.994
  299    HA   ASP 143           HA       ASP 143  16.278  -6.922   6.782
  300    HB2  ASP 143          1HB       ASP 143  15.095  -8.575   7.977
  301    HB3  ASP 143          2HB       ASP 143  15.477  -9.822   6.793
  302    H    LYS 144           H        LYS 144  16.649  -9.699   4.637
  303    HA   LYS 144           HA       LYS 144  19.139  -8.589   3.470
  304    HB2  LYS 144          1HB       LYS 144  18.848 -11.489   4.377
  305    HB3  LYS 144          2HB       LYS 144  20.216 -10.826   3.487
  306    HG2  LYS 144          1HG       LYS 144  19.386 -10.027   6.313
  307    HG3  LYS 144          2HG       LYS 144  20.635 -11.193   5.925
  308    HD2  LYS 144          1HD       LYS 144  22.077  -9.575   4.972
  309    HD3  LYS 144          2HD       LYS 144  20.828  -8.339   4.883
  310    HE2  LYS 144          1HE       LYS 144  21.907  -9.476   7.498
  311    HE3  LYS 144          2HE       LYS 144  22.508  -8.010   6.714
  312    HZ1  LYS 144          1HZ       LYS 144  20.160  -7.160   6.846
  313    HZ2  LYS 144          2HZ       LYS 144  20.888  -7.339   8.310
  314    HZ3  LYS 144          3HZ       LYS 144  19.755  -8.398   7.794
  315    H    THR 145           H        THR 145  18.590  -8.287   1.422
  316    HA   THR 145           HA       THR 145  16.208  -9.135   0.348
  317    HB   THR 145           HB       THR 145  18.286  -8.271  -1.583
  318    HG1  THR 145          1HG       THR 145  18.175  -6.185  -0.792
  319   HG21  THR 145          1HG2      THR 145  16.486  -6.761  -2.319
  320   HG22  THR 145          2HG2      THR 145  15.458  -7.298  -0.973
  321   HG23  THR 145          3HG2      THR 145  15.901  -8.429  -2.270
  322    H    THR 146           H        THR 146  19.178 -10.849   0.038
  323    HA   THR 146           HA       THR 146  18.182 -12.678  -1.995
  324    HB   THR 146           HB       THR 146  20.590 -11.966  -1.653
  325    HG1  THR 146          1HG       THR 146  21.263 -13.911  -2.498
  326   HG21  THR 146          1HG2      THR 146  20.556 -14.327   0.273
  327   HG22  THR 146          2HG2      THR 146  20.716 -12.627   0.770
  328   HG23  THR 146          3HG2      THR 146  21.963 -13.372  -0.246
  329    H    ASN 147           H        ASN 147  17.432 -12.429   1.253
  330    HA   ASN 147           HA       ASN 147  16.888 -15.364   1.488
  331    HB2  ASN 147          1HB       ASN 147  18.927 -14.727   2.688
  332    HB3  ASN 147          2HB       ASN 147  18.038 -13.484   3.567
  333   HD21  ASN 147          1HD2      ASN 147  18.623 -14.465   5.591
  334   HD22  ASN 147          2HD2      ASN 147  17.873 -15.973   6.092
  335    H    ARG 148           H        ARG 148  15.941 -12.297   3.233
  336    HA   ARG 148           HA       ARG 148  13.136 -13.217   3.331
  337    HB2  ARG 148          1HB       ARG 148  13.051 -13.533   5.742
  338    HB3  ARG 148          2HB       ARG 148  14.250 -14.624   5.053
  339    HG2  ARG 148          1HG       ARG 148  16.056 -12.966   5.730
  340    HG3  ARG 148          2HG       ARG 148  14.790 -12.006   6.515
  341    HD2  ARG 148          1HD       ARG 148  14.235 -13.973   7.943
  342    HD3  ARG 148          2HD       ARG 148  15.613 -14.840   7.232
  343    HE   ARG 148           HE       ARG 148  16.368 -12.219   8.249
  344   HH11  ARG 148          1HH1      ARG 148  15.644 -15.407   9.547
  345   HH12  ARG 148          2HH1      ARG 148  16.709 -15.141  10.912
  346   HH21  ARG 148          1HH2      ARG 148  17.499 -11.914   9.898
  347   HH22  ARG 148          2HH2      ARG 148  17.752 -13.138  11.148
  348    H    HIS 149           H        HIS 149  11.670 -11.832   4.326
  349    HA   HIS 149           HA       HIS 149  12.611  -9.078   4.944
  350    HB2  HIS 149          1HB       HIS 149  10.535  -8.187   4.066
  351    HB3  HIS 149          2HB       HIS 149  11.355  -9.116   2.825
  352    HD2  HIS 149          2HD       HIS 149   9.894 -10.801   1.551
  353    HE1  HIS 149          1HE       HIS 149   6.517 -10.899   4.142
  354    HE2  HIS 149          2HE       HIS 149   7.432 -11.663   1.889
  355    H    ARG 150           H        ARG 150  11.243  -7.822   6.347
  356    HA   ARG 150           HA       ARG 150  11.093  -9.236   8.870
  357    HB2  ARG 150          1HB       ARG 150  10.613  -6.341   8.062
  358    HB3  ARG 150          2HB       ARG 150  10.580  -6.917   9.736
  359    HG2  ARG 150          1HG       ARG 150  12.886  -7.720   9.567
  360    HG3  ARG 150          2HG       ARG 150  13.005  -7.132   7.901
  361    HD2  ARG 150          1HD       ARG 150  12.265  -5.315  10.232
  362    HD3  ARG 150          2HD       ARG 150  13.939  -5.646   9.783
  363    HE   ARG 150           HE       ARG 150  12.604  -4.828   7.425
  364   HH11  ARG 150          1HH1      ARG 150  13.560  -3.326  10.494
  365   HH12  ARG 150          2HH1      ARG 150  13.921  -1.811   9.660
  366   HH21  ARG 150          1HH2      ARG 150  13.248  -2.791   6.562
  367   HH22  ARG 150          2HH2      ARG 150  13.676  -1.544   7.716
  368    H    GLY 151           H        GLY 151   8.833  -9.625   6.725
  369    HA2  GLY 151          1HA       GLY 151   6.656 -10.345   6.925
  370    HA3  GLY 151          2HA       GLY 151   6.703 -10.010   8.663
  371    H    PHE 152           H        PHE 152   7.542  -7.266   6.668
  372    HA   PHE 152           HA       PHE 152   4.751  -6.394   6.465
  373    HB2  PHE 152          1HB       PHE 152   4.979  -4.380   7.704
  374    HB3  PHE 152          2HB       PHE 152   5.435  -5.699   8.752
  375    HD1  PHE 152          1HD       PHE 152   6.551  -2.662   7.036
  376    HD2  PHE 152          2HD       PHE 152   7.803  -5.953   9.519
  377    HE1  PHE 152          1HE       PHE 152   8.542  -1.373   7.746
  378    HE2  PHE 152          2HE       PHE 152   9.849  -4.688  10.152
  379    HZ   PHE 152           HZ       PHE 152  10.209  -2.389   9.288
  380    H    GLY 153           H        GLY 153   4.459  -4.421   5.274
  381    HA2  GLY 153          1HA       GLY 153   6.678  -3.224   3.793
  382    HA3  GLY 153          2HA       GLY 153   5.587  -4.199   2.801
  383    H    PHE 154           H        PHE 154   5.646  -1.816   1.981
  384    HA   PHE 154           HA       PHE 154   3.234  -0.429   3.026
  385    HB2  PHE 154          1HB       PHE 154   5.716   0.791   1.839
  386    HB3  PHE 154          2HB       PHE 154   4.200   1.656   2.041
  387    HD1  PHE 154          1HD       PHE 154   3.390   2.359   4.239
  388    HD2  PHE 154          2HD       PHE 154   6.974   0.002   3.843
  389    HE1  PHE 154          1HE       PHE 154   3.977   2.843   6.605
  390    HE2  PHE 154          2HE       PHE 154   7.535   0.442   6.204
  391    HZ   PHE 154           HZ       PHE 154   6.050   1.872   7.594
  392    H    VAL 155           H        VAL 155   1.742   0.482   1.673
  393    HA   VAL 155           HA       VAL 155   1.962  -0.103  -1.235
  394    HB   VAL 155           HB       VAL 155  -0.574  -0.705   0.291
  395   HG11  VAL 155          1HG1      VAL 155  -1.224  -1.840  -1.799
  396   HG12  VAL 155          2HG1      VAL 155  -0.911  -0.126  -2.074
  397   HG13  VAL 155          3HG1      VAL 155   0.303  -1.332  -2.555
  398   HG21  VAL 155          1HG2      VAL 155  -0.104  -3.080  -0.076
  399   HG22  VAL 155          2HG2      VAL 155   1.510  -2.675  -0.709
  400   HG23  VAL 155          3HG2      VAL 155   1.089  -2.361   0.991
  401    H    THR 156           H        THR 156   1.551   1.548  -2.445
  402    HA   THR 156           HA       THR 156   0.138   3.900  -1.350
  403    HB   THR 156           HB       THR 156   1.887   4.114  -3.755
  404    HG1  THR 156          1HG       THR 156   3.608   4.569  -2.419
  405   HG21  THR 156          1HG2      THR 156   1.172   6.041  -1.501
  406   HG22  THR 156          2HG2      THR 156   0.522   6.077  -3.156
  407   HG23  THR 156          3HG2      THR 156   2.234   6.403  -2.878
  408    H    PHE 157           H        PHE 157  -1.476   4.995  -2.451
  409    HA   PHE 157           HA       PHE 157  -2.761   3.431  -4.632
  410    HB2  PHE 157          1HB       PHE 157  -3.960   4.882  -2.291
  411    HB3  PHE 157          2HB       PHE 157  -4.891   4.259  -3.639
  412    HD1  PHE 157          1HD       PHE 157  -2.542   3.168  -0.913
  413    HD2  PHE 157          2HD       PHE 157  -5.624   1.995  -3.687
  414    HE1  PHE 157          1HE       PHE 157  -2.632   0.932   0.124
  415    HE2  PHE 157          2HE       PHE 157  -5.742  -0.232  -2.603
  416    HZ   PHE 157           HZ       PHE 157  -4.233  -0.778  -0.704
  417    H    GLU 158           H        GLU 158  -3.967   4.428  -6.229
  418    HA   GLU 158           HA       GLU 158  -2.977   7.084  -7.028
  419    HB2  GLU 158          1HB       GLU 158  -3.250   5.314  -8.649
  420    HB3  GLU 158          2HB       GLU 158  -4.969   5.185  -8.319
  421    HG2  GLU 158          1HG       GLU 158  -3.709   7.795  -9.258
  422    HG3  GLU 158          2HG       GLU 158  -4.083   6.515 -10.398
  423    H    SER 159           H        SER 159  -6.072   5.735  -5.864
  424    HA   SER 159           HA       SER 159  -7.130   8.507  -5.494
  425    HB2  SER 159          1HB       SER 159  -8.515   5.879  -6.035
  426    HB3  SER 159          2HB       SER 159  -9.358   7.252  -5.294
  427    HG   SER 159           HG       SER 159  -7.975   7.262  -7.798
  428    H    GLU 160           H        GLU 160  -7.563   9.269  -3.552
  429    HA   GLU 160           HA       GLU 160  -6.567   8.027  -1.187
  430    HB2  GLU 160          1HB       GLU 160  -6.674  10.430  -1.590
  431    HB3  GLU 160          2HB       GLU 160  -8.443  10.376  -1.637
  432    HG2  GLU 160          1HG       GLU 160  -8.457   9.662   0.753
  433    HG3  GLU 160          2HG       GLU 160  -6.689   9.790   0.772
  434    H    ASP 161           H        ASP 161  -9.870   8.136  -2.534
  435    HA   ASP 161           HA       ASP 161 -11.239   7.110  -0.281
  436    HB2  ASP 161          1HB       ASP 161 -11.853   6.980  -3.237
  437    HB3  ASP 161          2HB       ASP 161 -12.918   6.286  -2.021
  438    H    ILE 162           H        ILE 162  -9.228   5.311  -2.518
  439    HA   ILE 162           HA       ILE 162 -10.272   2.705  -1.717
  440    HB   ILE 162           HB       ILE 162  -7.489   3.180  -2.793
  441   HG12  ILE 162          1HG1      ILE 162  -8.744   4.329  -4.404
  442   HG13  ILE 162          2HG1      ILE 162  -8.347   2.745  -5.048
  443   HG21  ILE 162          1HG2      ILE 162  -7.920   0.931  -2.007
  444   HG22  ILE 162          2HG2      ILE 162  -9.440   0.836  -2.911
  445   HG23  ILE 162          3HG2      ILE 162  -7.882   0.889  -3.765
  446   HD11  ILE 162          1HD1      ILE 162 -11.071   3.678  -4.028
  447   HD12  ILE 162          2HD1      ILE 162 -10.611   3.293  -5.694
  448   HD13  ILE 162          3HD1      ILE 162 -10.712   2.000  -4.479
  449    H    VAL 163           H        VAL 163  -7.621   4.846  -0.609
  450    HA   VAL 163           HA       VAL 163  -6.409   3.005   1.190
  451    HB   VAL 163           HB       VAL 163  -6.667   6.043   1.470
  452   HG11  VAL 163          1HG1      VAL 163  -5.954   5.088   3.604
  453   HG12  VAL 163          2HG1      VAL 163  -4.690   4.158   2.777
  454   HG13  VAL 163          3HG1      VAL 163  -4.613   5.929   2.825
  455   HG21  VAL 163          1HG2      VAL 163  -4.445   4.368   0.249
  456   HG22  VAL 163          2HG2      VAL 163  -5.594   5.387  -0.659
  457   HG23  VAL 163          3HG2      VAL 163  -4.450   6.127   0.450
  458    H    GLU 164           H        GLU 164  -9.133   5.288   1.617
  459    HA   GLU 164           HA       GLU 164  -9.719   4.652   4.359
  460    HB2  GLU 164          1HB       GLU 164 -11.672   5.563   2.202
  461    HB3  GLU 164          2HB       GLU 164 -11.883   5.685   3.944
  462    HG2  GLU 164          1HG       GLU 164  -9.912   7.206   2.199
  463    HG3  GLU 164          2HG       GLU 164 -11.295   7.854   3.066
  464    H    LYS 165           H        LYS 165 -11.087   3.301   1.309
  465    HA   LYS 165           HA       LYS 165 -12.889   1.435   2.451
  466    HB2  LYS 165          1HB       LYS 165 -12.735   2.148   0.055
  467    HB3  LYS 165          2HB       LYS 165 -11.278   1.166  -0.120
  468    HG2  LYS 165          1HG       LYS 165 -12.691  -0.850   0.609
  469    HG3  LYS 165          2HG       LYS 165 -14.105   0.199   0.453
  470    HD2  LYS 165          1HD       LYS 165 -12.117  -0.554  -1.729
  471    HD3  LYS 165          2HD       LYS 165 -13.762  -1.174  -1.549
  472    HE2  LYS 165          1HE       LYS 165 -14.650   1.132  -1.926
  473    HE3  LYS 165          2HE       LYS 165 -12.996   1.722  -2.146
  474    HZ1  LYS 165          1HZ       LYS 165 -14.013   1.243  -4.284
  475    HZ2  LYS 165          2HZ       LYS 165 -14.340  -0.297  -3.863
  476    HZ3  LYS 165          3HZ       LYS 165 -12.786   0.182  -4.054
  477    H    VAL 166           H        VAL 166  -9.512   0.891   1.472
  478    HA   VAL 166           HA       VAL 166  -9.321  -1.853   2.304
  479    HB   VAL 166           HB       VAL 166  -7.140   0.228   1.960
  480   HG11  VAL 166          1HG1      VAL 166  -5.667  -1.709   1.490
  481   HG12  VAL 166          2HG1      VAL 166  -6.274  -1.742   3.151
  482   HG13  VAL 166          3HG1      VAL 166  -6.990  -2.807   1.918
  483   HG21  VAL 166          1HG2      VAL 166  -8.647  -0.265  -0.117
  484   HG22  VAL 166          2HG2      VAL 166  -6.908  -0.393  -0.287
  485   HG23  VAL 166          3HG2      VAL 166  -7.903  -1.858  -0.101
  486    H    CYS 167           H        CYS 167  -8.361   1.206   3.964
  487    HA   CYS 167           HA       CYS 167  -7.330  -0.157   6.283
  488    HB2  CYS 167          1HB       CYS 167  -6.684   2.132   5.487
  489    HB3  CYS 167          2HB       CYS 167  -8.272   2.736   5.993
  490    HG   CYS 167           HG       CYS 167  -8.040   2.152   8.519
  491    H    GLU 168           H        GLU 168 -10.654   1.121   5.586
  492    HA   GLU 168           HA       GLU 168 -11.719   0.765   8.175
  493    HB2  GLU 168          1HB       GLU 168 -12.722   2.105   6.426
  494    HB3  GLU 168          2HB       GLU 168 -12.933   0.685   5.377
  495    HG2  GLU 168          1HG       GLU 168 -14.500  -0.291   6.918
  496    HG3  GLU 168          2HG       GLU 168 -14.174   0.984   8.108
  497    H    ILE 169           H        ILE 169 -11.191  -1.581   5.547
  498    HA   ILE 169           HA       ILE 169 -12.608  -3.791   6.770
  499    HB   ILE 169           HB       ILE 169 -10.357  -3.667   4.742
  500   HG12  ILE 169          1HG1      ILE 169 -13.295  -4.414   4.308
  501   HG13  ILE 169          2HG1      ILE 169 -12.763  -2.744   4.227
  502   HG21  ILE 169          1HG2      ILE 169 -10.229  -5.862   5.774
  503   HG22  ILE 169          2HG2      ILE 169 -11.983  -6.096   5.610
  504   HG23  ILE 169          3HG2      ILE 169 -10.931  -6.040   4.181
  505   HD11  ILE 169          1HD1      ILE 169 -11.152  -3.325   2.421
  506   HD12  ILE 169          2HD1      ILE 169 -11.807  -4.981   2.421
  507   HD13  ILE 169          3HD1      ILE 169 -12.849  -3.613   1.995
  508    H    HIS 170           H        HIS 170  -9.346  -2.534   7.062
  509    HA   HIS 170           HA       HIS 170  -7.709  -2.682   8.583
  510    HB2  HIS 170          1HB       HIS 170  -9.638  -2.264  10.085
  511    HB3  HIS 170          2HB       HIS 170  -9.767  -3.988  10.383
  512    HD2  HIS 170          2HD       HIS 170  -6.134  -2.912  10.378
  513    HE1  HIS 170          1HE       HIS 170  -7.347  -2.903  14.460
  514    HE2  HIS 170          2HE       HIS 170  -5.347  -2.834  12.888
  515    H    PHE 171           H        PHE 171  -9.384  -5.846   8.663
  516    HA   PHE 171           HA       PHE 171  -6.722  -7.151   8.536
  517    HB2  PHE 171          1HB       PHE 171  -9.189  -8.115   9.924
  518    HB3  PHE 171          2HB       PHE 171  -7.886  -9.174   9.474
  519    HD1  PHE 171          1HD       PHE 171  -8.889  -6.516  11.780
  520    HD2  PHE 171          2HD       PHE 171  -5.563  -8.887  10.395
  521    HE1  PHE 171          1HE       PHE 171  -7.587  -5.874  13.793
  522    HE2  PHE 171          2HE       PHE 171  -4.273  -8.258  12.418
  523    HZ   PHE 171           HZ       PHE 171  -5.277  -6.742  14.116
  524    H    HIS 172           H        HIS 172  -6.067  -8.354   6.954
  525    HA   HIS 172           HA       HIS 172  -7.977  -9.032   4.740
  526    HB2  HIS 172          1HB       HIS 172  -5.339  -7.528   4.612
  527    HB3  HIS 172          2HB       HIS 172  -6.122  -8.233   3.209
  528    HD2  HIS 172          2HD       HIS 172  -6.751  -5.419   5.846
  529    HE1  HIS 172          1HE       HIS 172  -8.880  -4.398   2.320
  530    HE2  HIS 172          2HE       HIS 172  -8.144  -3.585   4.596
  531    H    GLU 173           H        GLU 173  -7.255 -10.661   3.255
  532    HA   GLU 173           HA       GLU 173  -5.230 -12.556   4.386
  533    HB2  GLU 173          1HB       GLU 173  -7.505 -13.403   4.342
  534    HB3  GLU 173          2HB       GLU 173  -7.628 -13.069   2.606
  535    HG2  GLU 173          1HG       GLU 173  -5.823 -14.704   2.155
  536    HG3  GLU 173          2HG       GLU 173  -5.652 -15.002   3.887
  537    H    ILE 174           H        ILE 174  -3.392 -12.875   3.306
  538    HA   ILE 174           HA       ILE 174  -3.214 -12.410   0.360
  539    HB   ILE 174           HB       ILE 174  -1.352 -11.241   2.467
  540   HG12  ILE 174          1HG1      ILE 174  -3.122 -10.003   0.315
  541   HG13  ILE 174          2HG1      ILE 174  -3.324  -9.875   2.060
  542   HG21  ILE 174          1HG2      ILE 174  -0.960 -11.351  -0.559
  543   HG22  ILE 174          2HG2      ILE 174   0.078 -10.486   0.592
  544   HG23  ILE 174          3HG2      ILE 174   0.004 -12.235   0.636
  545   HD11  ILE 174          1HD1      ILE 174  -1.138  -8.579   0.403
  546   HD12  ILE 174          2HD1      ILE 174  -2.469  -7.810   1.274
  547   HD13  ILE 174          3HD1      ILE 174  -1.175  -8.604   2.187
  548    H    ASN 175           H        ASN 175  -2.354 -14.168  -0.605
  549    HA   ASN 175           HA       ASN 175  -1.594 -16.274  -0.825
  550    HB2  ASN 175          1HB       ASN 175   0.686 -15.103   0.795
  551    HB3  ASN 175          2HB       ASN 175   0.762 -16.687   0.039
  552   HD21  ASN 175          1HD2      ASN 175   2.328 -14.225  -0.460
  553   HD22  ASN 175          2HD2      ASN 175   2.262 -14.072  -2.220
  554    H    ASN 176           H        ASN 176  -3.550 -16.086   1.067
  555    HA   ASN 176           HA       ASN 176  -4.642 -17.016   2.745
  556    HB2  ASN 176          1HB       ASN 176  -2.805 -19.400   2.422
  557    HB3  ASN 176          2HB       ASN 176  -4.367 -19.382   3.238
  558   HD21  ASN 176          1HD2      ASN 176  -6.179 -18.203   1.651
  559   HD22  ASN 176          2HD2      ASN 176  -6.186 -18.995   0.075
  560    H    LYS 177           H        LYS 177  -1.851 -15.674   3.425
  561    HA   LYS 177           HA       LYS 177  -1.819 -16.284   6.338
  562    HB2  LYS 177          1HB       LYS 177   0.316 -16.091   5.069
  563    HB3  LYS 177          2HB       LYS 177  -0.114 -14.452   4.604
  564    HG2  LYS 177          1HG       LYS 177   1.485 -14.319   6.321
  565    HG3  LYS 177          2HG       LYS 177  -0.045 -13.758   6.992
  566    HD2  LYS 177          1HD       LYS 177  -0.286 -15.743   8.332
  567    HD3  LYS 177          2HD       LYS 177   0.911 -16.620   7.371
  568    HE2  LYS 177          1HE       LYS 177   1.887 -16.012   9.521
  569    HE3  LYS 177          2HE       LYS 177   2.722 -15.206   8.192
  570    HZ1  LYS 177          1HZ       LYS 177   2.373 -13.604   9.909
  571    HZ2  LYS 177          2HZ       LYS 177   0.762 -13.943  10.032
  572    HZ3  LYS 177          3HZ       LYS 177   1.377 -13.205   8.696
  573    H    MET 178           H        MET 178  -2.423 -14.724   7.869
  574    HA   MET 178           HA       MET 178  -4.354 -12.682   6.966
  575    HB2  MET 178          1HB       MET 178  -5.154 -14.094   8.701
  576    HB3  MET 178          2HB       MET 178  -3.676 -13.907   9.647
  577    HG2  MET 178          1HG       MET 178  -5.516 -12.632  10.620
  578    HG3  MET 178          2HG       MET 178  -4.175 -11.605  10.144
  579    HE1  MET 178          1HE       MET 178  -7.360 -13.078   8.048
  580    HE2  MET 178          2HE       MET 178  -7.931 -12.522   9.645
  581    HE3  MET 178          3HE       MET 178  -8.379 -11.623   8.181
  582    H    VAL 179           H        VAL 179  -4.020 -10.561   7.009
  583    HA   VAL 179           HA       VAL 179  -1.598  -9.472   8.296
  584    HB   VAL 179           HB       VAL 179  -1.010  -8.073   6.499
  585   HG11  VAL 179          1HG1      VAL 179  -1.574 -10.779   5.247
  586   HG12  VAL 179          2HG1      VAL 179  -0.297  -9.611   4.837
  587   HG13  VAL 179          3HG1      VAL 179  -0.273 -10.429   6.409
  588   HG21  VAL 179          1HG2      VAL 179  -3.394  -9.071   4.919
  589   HG22  VAL 179          2HG2      VAL 179  -3.176  -7.429   5.577
  590   HG23  VAL 179          3HG2      VAL 179  -2.101  -8.026   4.315
  591    H    GLU 180           H        GLU 180  -1.574  -7.323   8.816
  592    HA   GLU 180           HA       GLU 180  -4.264  -6.063   9.295
  593    HB2  GLU 180          1HB       GLU 180  -2.865  -6.613  11.325
  594    HB3  GLU 180          2HB       GLU 180  -1.659  -5.463  10.726
  595    HG2  GLU 180          1HG       GLU 180  -3.513  -3.704  10.702
  596    HG3  GLU 180          2HG       GLU 180  -4.558  -4.894  11.479
  597    H    CYS 181           H        CYS 181  -4.740  -4.357   8.071
  598    HA   CYS 181           HA       CYS 181  -2.581  -2.775   6.753
  599    HB2  CYS 181          1HB       CYS 181  -5.528  -3.022   6.057
  600    HB3  CYS 181          2HB       CYS 181  -4.341  -2.027   5.212
  601    HG   CYS 181           HG       CYS 181  -4.878  -4.232   3.847
  602    H    LYS 182           H        LYS 182  -2.247  -0.736   7.334
  603    HA   LYS 182           HA       LYS 182  -4.257   0.897   8.762
  604    HB2  LYS 182          1HB       LYS 182  -2.531   1.285  10.633
  605    HB3  LYS 182          2HB       LYS 182  -3.485  -0.200  10.641
  606    HG2  LYS 182          1HG       LYS 182  -1.492  -1.407   9.653
  607    HG3  LYS 182          2HG       LYS 182  -0.558   0.082   9.892
  608    HD2  LYS 182          1HD       LYS 182  -0.934  -0.046  12.315
  609    HD3  LYS 182          2HD       LYS 182  -2.076  -1.387  12.094
  610    HE2  LYS 182          1HE       LYS 182  -0.199  -2.715  11.035
  611    HE3  LYS 182          2HE       LYS 182   0.912  -1.424  11.514
  612    HZ1  LYS 182          1HZ       LYS 182   0.858  -3.235  13.110
  613    HZ2  LYS 182          2HZ       LYS 182  -0.737  -3.101  13.331
  614    HZ3  LYS 182          3HZ       LYS 182   0.263  -1.877  13.841
  615    H    LYS 183           H        LYS 183  -3.833   3.137   8.739
  616    HA   LYS 183           HA       LYS 183  -2.431   4.070   6.441
  617    HB2  LYS 183          1HB       LYS 183  -3.437   5.566   8.887
  618    HB3  LYS 183          2HB       LYS 183  -2.736   6.366   7.471
  619    HG2  LYS 183          1HG       LYS 183  -4.449   5.414   6.002
  620    HG3  LYS 183          2HG       LYS 183  -5.149   4.512   7.356
  621    HD2  LYS 183          1HD       LYS 183  -5.661   6.645   8.522
  622    HD3  LYS 183          2HD       LYS 183  -5.002   7.550   7.137
  623    HE2  LYS 183          1HE       LYS 183  -6.674   6.511   5.645
  624    HE3  LYS 183          2HE       LYS 183  -7.297   5.541   6.985
  625    HZ1  LYS 183          1HZ       LYS 183  -8.638   7.496   6.561
  626    HZ2  LYS 183          2HZ       LYS 183  -7.386   8.504   6.852
  627    HZ3  LYS 183          3HZ       LYS 183  -8.002   7.591   8.074
  628    H    ALA 184           H        ALA 184  -0.470   4.944   6.020
  629    HA   ALA 184           HA       ALA 184   1.692   4.068   7.668
  630    HB1  ALA 184          1HB       ALA 184   1.843   4.178   5.240
  631    HB2  ALA 184          2HB       ALA 184   1.630   5.943   5.271
  632    HB3  ALA 184          3HB       ALA 184   3.091   5.211   5.973
  633    H    GLN 185           H        GLN 185   2.773   5.003   9.280
  634    HA   GLN 185           HA       GLN 185   2.700   7.952   9.669
  635    HB2  GLN 185          1HB       GLN 185   2.480   5.772  11.769
  636    HB3  GLN 185          2HB       GLN 185   2.742   7.468  12.153
  637    HG2  GLN 185          1HG       GLN 185   0.300   6.320  10.740
  638    HG3  GLN 185          2HG       GLN 185   0.391   6.794  12.428
  639   HE21  GLN 185          1HE2      GLN 185  -1.572   7.869  10.710
  640   HE22  GLN 185          2HE2      GLN 185  -1.214   9.579  10.510
  641    HA   PRO 186           HA       PRO 186   6.955   8.012   9.503
  642    HB2  PRO 186          1HB       PRO 186   7.148   9.648  12.027
  643    HB3  PRO 186          2HB       PRO 186   7.827   9.987  10.406
  644    HG2  PRO 186          1HG       PRO 186   5.586  11.248  11.258
  645    HG3  PRO 186          2HG       PRO 186   5.682  10.632   9.570
  646    HD2  PRO 186          1HD       PRO 186   4.352   9.368  11.970
  647    HD3  PRO 186          2HD       PRO 186   3.719   9.585  10.338
  648    H    LYS 187           H        LYS 187   8.840   6.960  10.012
  649    HA   LYS 187           HA       LYS 187   8.896   4.917  11.988
  650    HB2  LYS 187          1HB       LYS 187  11.181   4.528  11.279
  651    HB3  LYS 187          2HB       LYS 187  10.173   4.869   9.877
  652    HG2  LYS 187          1HG       LYS 187  11.016   7.317  10.055
  653    HG3  LYS 187          2HG       LYS 187  12.218   6.704  11.193
  654    HD2  LYS 187          1HD       LYS 187  11.843   5.814   8.299
  655    HD3  LYS 187          2HD       LYS 187  13.084   6.923   8.893
  656    HE2  LYS 187          1HE       LYS 187  14.026   5.101  10.318
  657    HE3  LYS 187          2HE       LYS 187  12.797   3.993   9.687
  658    HZ1  LYS 187          1HZ       LYS 187  13.700   4.423   7.443
  659    HZ2  LYS 187          2HZ       LYS 187  14.784   3.702   8.389
  660    HZ3  LYS 187          3HZ       LYS 187  14.924   5.316   8.085
  661    H    GLU 188           H        GLU 188   9.878   8.161  12.195
  662    HA   GLU 188           HA       GLU 188  11.329   7.933  14.730
  663    HB2  GLU 188          1HB       GLU 188  11.575  10.338  14.603
  664    HB3  GLU 188          2HB       GLU 188  11.966   9.571  13.087
  665    HG2  GLU 188          1HG       GLU 188  10.820  11.364  12.313
  666    HG3  GLU 188          2HG       GLU 188   9.539  10.169  12.331
  667    H    VAL 189           H        VAL 189   7.952   8.510  13.854
  668    HA   VAL 189           HA       VAL 189   7.298   9.430  16.556
  669    HB   VAL 189           HB       VAL 189   6.169  10.135  14.271
  670   HG11  VAL 189          1HG1      VAL 189   4.255   7.978  15.281
  671   HG12  VAL 189          2HG1      VAL 189   3.903   9.206  14.067
  672   HG13  VAL 189          3HG1      VAL 189   5.119   7.973  13.725
  673   HG21  VAL 189          1HG2      VAL 189   5.793  11.183  16.453
  674   HG22  VAL 189          2HG2      VAL 189   4.293  11.001  15.529
  675   HG23  VAL 189          3HG2      VAL 189   4.639   9.894  16.882
  676    H    MET 190           H        MET 190   7.263   6.428  14.856
  677    HA   MET 190           HA       MET 190   5.746   5.052  16.994
  678    HB2  MET 190          1HB       MET 190   6.601   4.122  14.231
  679    HB3  MET 190          2HB       MET 190   5.639   3.189  15.389
  680    HG2  MET 190          1HG       MET 190   4.027   5.225  15.400
  681    HG3  MET 190          2HG       MET 190   4.885   5.730  13.946
  682    HE1  MET 190          1HE       MET 190   2.454   3.284  15.639
  683    HE2  MET 190          2HE       MET 190   2.076   2.087  14.386
  684    HE3  MET 190          3HE       MET 190   3.660   2.056  15.185
  685    H    SER 191           H        SER 191   8.728   5.895  17.218
  686    HA   SER 191           HA       SER 191  10.304   3.534  17.333
  687    HB2  SER 191          1HB       SER 191  11.829   4.877  18.754
  688    HB3  SER 191          2HB       SER 191  11.328   5.703  17.273
  689    HG   SER 191           HG       SER 191  10.327   6.140  19.915
  690    HA   PRO 192           HA       PRO 192   8.780   1.458  20.908
  691    HB2  PRO 192          1HB       PRO 192  10.950   0.029  21.796
  692    HB3  PRO 192          2HB       PRO 192  10.073  -0.338  20.278
  693    HG2  PRO 192          1HG       PRO 192  12.609   1.302  20.610
  694    HG3  PRO 192          2HG       PRO 192  12.300  -0.036  19.456
  695    HD2  PRO 192          1HD       PRO 192  12.038   2.557  18.712
  696    HD3  PRO 192          2HD       PRO 192  10.890   1.319  18.121
  697    H    THR 193           H        THR 193   8.506   1.704  23.084
  698    HA   THR 193           HA       THR 193   9.836   3.939  24.377
  699    HB   THR 193           HB       THR 193   8.201   3.974  25.975
  700    HG1  THR 193          1HG       THR 193   6.857   2.240  26.423
  701   HG21  THR 193          1HG2      THR 193   6.072   3.883  24.855
  702   HG22  THR 193          2HG2      THR 193   6.678   2.757  23.625
  703   HG23  THR 193          3HG2      THR 193   7.272   4.434  23.675
  704    H    GLY 194           H        GLY 194  10.450   0.584  24.456
  705    HA2  GLY 194          1HA       GLY 194  12.762   0.681  26.039
  706    HA3  GLY 194          2HA       GLY 194  11.431   0.324  27.143
  707    H    SER 195           H        SER 195  12.627  -1.680  27.496
  708    HA   SER 195           HA       SER 195  12.878  -3.742  25.497
  709    HB2  SER 195          1HB       SER 195  14.213  -3.696  27.559
  710    HB3  SER 195          2HB       SER 195  12.746  -3.944  28.526
  711    HG   SER 195           HG       SER 195  13.907  -5.895  28.112
  712    H    ALA 196           H        ALA 196  11.721  -5.736  25.365
  713    HA   ALA 196           HA       ALA 196   8.847  -5.502  25.303
  714    HB1  ALA 196          1HB       ALA 196  10.177  -6.804  23.675
  715    HB2  ALA 196          2HB       ALA 196  10.685  -7.917  24.969
  716    HB3  ALA 196          3HB       ALA 196   8.978  -7.826  24.487
  717    H    ARG 197           H        ARG 197  10.969  -6.370  27.876
  718    HA   ARG 197           HA       ARG 197   8.718  -7.143  29.617
  719    HB2  ARG 197          1HB       ARG 197   9.786  -9.204  30.410
  720    HB3  ARG 197          2HB       ARG 197   9.382  -9.294  28.699
  721    HG2  ARG 197          1HG       ARG 197  11.782  -8.823  28.121
  722    HG3  ARG 197          2HG       ARG 197  12.163  -8.763  29.847
  723    HD2  ARG 197          1HD       ARG 197  12.780 -10.941  29.017
  724    HD3  ARG 197          2HD       ARG 197  11.401 -11.113  30.094
  725    HE   ARG 197           HE       ARG 197  10.070 -11.826  28.326
  726   HH11  ARG 197          1HH1      ARG 197  13.063 -10.642  26.930
  727   HH12  ARG 197          2HH1      ARG 197  12.688 -11.295  25.358
  728   HH21  ARG 197          1HH2      ARG 197   9.656 -12.615  26.300
  729   HH22  ARG 197          2HH2      ARG 197  10.809 -12.380  25.019
  730    H    GLY 198           H        GLY 198   9.187  -7.092  31.859
  731    HA2  GLY 198          1HA       GLY 198  11.585  -6.520  33.154
  732    HA3  GLY 198          2HA       GLY 198  10.950  -4.947  32.667
  733    H    ARG 199           H        ARG 199  11.272  -5.228  35.245
  734    HA   ARG 199           HA       ARG 199   9.004  -6.264  36.737
  735    HB2  ARG 199          1HB       ARG 199  11.190  -6.119  37.760
  736    HB3  ARG 199          2HB       ARG 199  11.308  -4.398  37.412
  737    HG2  ARG 199          1HG       ARG 199  10.905  -4.786  39.766
  738    HG3  ARG 199          2HG       ARG 199   9.591  -3.871  39.054
  739    HD2  ARG 199          1HD       ARG 199   9.015  -6.759  38.978
  740    HD3  ARG 199          2HD       ARG 199   9.463  -6.240  40.607
  741    HE   ARG 199           HE       ARG 199   7.554  -4.392  39.452
  742   HH11  ARG 199          1HH1      ARG 199   7.594  -7.533  41.040
  743   HH12  ARG 199          2HH1      ARG 199   5.983  -7.291  41.666
  744   HH21  ARG 199          1HH2      ARG 199   5.681  -4.158  40.210
  745   HH22  ARG 199          2HH2      ARG 199   4.874  -5.378  41.204
  746    H    SER 200           H        SER 200   7.073  -5.434  36.946
  747    HA   SER 200           HA       SER 200   6.184  -2.937  35.859
  748    HB2  SER 200          1HB       SER 200   4.837  -4.834  37.826
  749    HB3  SER 200          2HB       SER 200   4.032  -3.517  36.958
  750    HG   SER 200           HG       SER 200   4.475  -4.540  34.998
  751    H5'    G 201           H5'        G 201   4.855 -13.890   7.807
  752   H5''    G 201           H5"        G 201   6.533 -13.785   7.244
  753    H4'    G 201           H4'        G 201   5.556 -14.615  10.002
  754    H3'    G 201           H3'        G 201   6.050 -12.063   8.989
  755    H2'    G 201           H2'        G 201   8.286 -12.500   8.418
  756   HO2'    G 201           HO2        G 201   8.215 -11.498  11.072
  757    H1'    G 201           H1'        G 201   8.565 -14.016  11.038
  758    H8     G 201          8H          G 201  10.200 -13.176   7.687
  759    H1     G 201          1H          G 201  13.334 -17.607  11.167
  760    H21    G 201          1H2         G 201  12.016 -18.242  12.884
  761    H22    G 201          2H2         G 201  10.423 -17.525  13.069
  762   HO5'    G 201           HO5        G 201   6.516 -16.182   7.920
  763    H5'    U 202           H5'        U 202   6.442  -9.813  12.123
  764   H5''    U 202           H5"        U 202   4.880  -9.529  12.881
  765    H4'    U 202           H4'        U 202   6.254  -7.905  10.717
  766    H3'    U 202           H3'        U 202   6.359  -7.762  13.445
  767    H2'    U 202           H2'        U 202   4.082  -7.570  13.830
  768   HO2'    U 202           HO2        U 202   5.127  -4.973  13.750
  769    H1'    U 202           H1'        U 202   3.603  -5.646  11.562
  770    H3     U 202          3H          U 202  -0.737  -5.898  12.975
  771    H5     U 202          5H          U 202   0.392  -9.921  12.642
  772    H6     U 202          6H          U 202   2.653  -9.208  12.074
  773    H5'    A 203           H5'        A 203   8.247  -2.835  14.503
  774   H5''    A 203           H5"        A 203   6.616  -2.180  14.657
  775    H4'    A 203           H4'        A 203   8.075  -2.523  12.001
  776    H3'    A 203           H3'        A 203   8.727  -0.595  13.859
  777    H2'    A 203           H2'        A 203   6.371   0.050  14.042
  778   HO2'    A 203           HO2        A 203   7.825   1.890  12.442
  779    H1'    A 203           H1'        A 203   6.519   0.040  11.011
  780    H8     A 203          8H          A 203   3.684  -1.156  13.360
  781    H61    A 203          1H6         A 203   0.402   3.207  10.241
  782    H62    A 203          2H6         A 203   0.250   1.972  11.496
  783    H2     A 203          2H          A 203   4.492   3.456   8.942
  784    H5'    G 204           H5'        G 204   9.866   1.923   9.154
  785   H5''    G 204           H5"        G 204   9.163   0.307   9.109
  786    H4'    G 204           H4'        G 204  11.231  -0.488   7.927
  787    H3'    G 204           H3'        G 204  12.516   1.763   8.791
  788    H2'    G 204           H2'        G 204  11.099   3.321   7.718
  789   HO2'    G 204           HO2        G 204  13.141   2.731   5.804
  790    H1'    G 204           H1'        G 204  11.107   1.683   5.192
  791    H8     G 204          8H          G 204   9.656   3.052   3.577
  792    H1     G 204          1H          G 204   5.972   5.368   8.348
  793    H21    G 204          1H2         G 204   6.568   4.349  10.239
  794    H22    G 204          2H2         G 204   7.968   3.274  10.274
  795    H5'    U 205           H5'        U 205  16.207   0.211   4.574
  796   H5''    U 205           H5"        U 205  14.911   1.326   5.024
  797    H4'    U 205           H4'        U 205  13.347  -0.694   5.082
  798    H3'    U 205           H3'        U 205  15.762  -2.194   4.793
  799   HO3'    U 205           HO3        U 205  14.280  -3.913   4.668
  800    H2'    U 205           H2'        U 205  15.898  -1.797   2.480
  801   HO2'    U 205           HO2        U 205  15.547  -4.088   2.618
  802    H1'    U 205           H1'        U 205  12.874  -1.862   2.559
  803    H3     U 205          3H          U 205  15.498   0.560  -1.453
  804    H5     U 205          5H          U 205  11.713  -1.188  -1.771
  805    H6     U 205          6H          U 205  11.841  -1.822   0.580
  Start of MODEL   13
    1    H1   GLY 105          1H        GLY 105  -7.249  15.584   1.713
    2    H2   GLY 105          2H        GLY 105  -8.623  15.090   2.462
    3    H3   GLY 105          3H        GLY 105  -7.672  13.993   1.699
    4    HA2  GLY 105          1HA       GLY 105  -6.953  15.517   4.116
    5    HA3  GLY 105          2HA       GLY 105  -7.355  13.791   4.055
    6    H    SER 106           H        SER 106  -5.788  12.328   3.476
    7    HA   SER 106           HA       SER 106  -3.013  13.131   3.630
    8    HB2  SER 106          1HB       SER 106  -3.720  11.012   4.528
    9    HB3  SER 106          2HB       SER 106  -4.319  10.478   2.946
   10    HG   SER 106           HG       SER 106  -2.078   9.848   3.726
   11    H    HIS 107           H        HIS 107  -1.818  13.962   2.072
   12    HA   HIS 107           HA       HIS 107  -2.319  13.592  -0.798
   13    HB2  HIS 107          1HB       HIS 107  -1.367  15.672   0.113
   14    HB3  HIS 107          2HB       HIS 107   0.012  14.783   0.759
   15    HD2  HIS 107          2HD       HIS 107  -1.495  15.982  -2.596
   16    HE1  HIS 107          1HE       HIS 107   2.533  14.823  -3.398
   17    HE2  HIS 107          2HE       HIS 107   0.447  15.908  -4.379
   18    H    MET 108           H        MET 108  -0.414  11.993   1.687
   19    HA   MET 108           HA       MET 108   1.466  10.641  -0.012
   20    HB2  MET 108          1HB       MET 108   0.453  10.002   2.790
   21    HB3  MET 108          2HB       MET 108   1.781   9.159   1.988
   22    HG2  MET 108          1HG       MET 108   3.087  11.218   1.858
   23    HG3  MET 108          2HG       MET 108   1.749  12.147   2.530
   24    HE1  MET 108          1HE       MET 108   4.587   9.538   3.232
   25    HE2  MET 108          2HE       MET 108   4.356   9.153   4.952
   26    HE3  MET 108          3HE       MET 108   3.186   8.567   3.753
   27    H    LYS 109           H        LYS 109  -1.789   9.742   1.103
   28    HA   LYS 109           HA       LYS 109  -3.125   7.915   0.739
   29    HB2  LYS 109          1HB       LYS 109  -1.806   8.043  -1.993
   30    HB3  LYS 109          2HB       LYS 109  -3.265   7.129  -1.623
   31    HG2  LYS 109          1HG       LYS 109  -4.522   9.105  -1.097
   32    HG3  LYS 109          2HG       LYS 109  -3.108  10.153  -1.292
   33    HD2  LYS 109          1HD       LYS 109  -4.117   8.316  -3.494
   34    HD3  LYS 109          2HD       LYS 109  -4.720   9.972  -3.311
   35    HE2  LYS 109          1HE       LYS 109  -2.716  10.960  -3.926
   36    HE3  LYS 109          2HE       LYS 109  -1.737   9.602  -3.376
   37    HZ1  LYS 109          1HZ       LYS 109  -3.470   9.455  -5.781
   38    HZ2  LYS 109          2HZ       LYS 109  -2.411   8.325  -5.259
   39    HZ3  LYS 109          3HZ       LYS 109  -1.851   9.757  -5.828
   40    H    LYS 110           H        LYS 110  -0.925   7.170   2.165
   41    HA   LYS 110           HA       LYS 110   0.003   4.560   1.039
   42    HB2  LYS 110          1HB       LYS 110   1.644   6.414   1.190
   43    HB3  LYS 110          2HB       LYS 110   1.413   6.464   2.937
   44    HG2  LYS 110          1HG       LYS 110   2.304   4.122   3.085
   45    HG3  LYS 110          2HG       LYS 110   2.525   4.121   1.323
   46    HD2  LYS 110          1HD       LYS 110   4.034   6.119   1.549
   47    HD3  LYS 110          2HD       LYS 110   3.851   6.027   3.312
   48    HE2  LYS 110          1HE       LYS 110   4.812   3.724   3.255
   49    HE3  LYS 110          2HE       LYS 110   5.057   3.879   1.508
   50    HZ1  LYS 110          1HZ       LYS 110   7.071   4.422   2.801
   51    HZ2  LYS 110          2HZ       LYS 110   6.292   5.605   3.592
   52    HZ3  LYS 110          3HZ       LYS 110   6.565   5.745   1.974
   53    H    ILE 111           H        ILE 111  -0.087   2.733   2.193
   54    HA   ILE 111           HA       ILE 111  -0.999   2.826   5.038
   55    HB   ILE 111           HB       ILE 111  -2.224   0.801   4.809
   56   HG12  ILE 111          1HG1      ILE 111  -1.463   0.733   1.883
   57   HG13  ILE 111          2HG1      ILE 111  -0.890  -0.375   3.124
   58   HG21  ILE 111          1HG2      ILE 111  -3.320   2.989   4.273
   59   HG22  ILE 111          2HG2      ILE 111  -3.132   2.602   2.543
   60   HG23  ILE 111          3HG2      ILE 111  -4.127   1.572   3.602
   61   HD11  ILE 111          1HD1      ILE 111  -3.180  -1.212   3.495
   62   HD12  ILE 111          2HD1      ILE 111  -3.764  -0.183   2.164
   63   HD13  ILE 111          3HD1      ILE 111  -2.598  -1.476   1.841
   64    H    PHE 112           H        PHE 112  -0.244   1.333   6.381
   65    HA   PHE 112           HA       PHE 112   2.339  -0.043   5.888
   66    HB2  PHE 112          1HB       PHE 112   1.844   1.308   7.979
   67    HB3  PHE 112          2HB       PHE 112   0.499   0.227   8.312
   68    HD1  PHE 112          1HD       PHE 112   4.145   0.571   8.212
   69    HD2  PHE 112          2HD       PHE 112   0.884  -2.060   9.188
   70    HE1  PHE 112          1HE       PHE 112   5.709  -0.883   9.415
   71    HE2  PHE 112          2HE       PHE 112   2.454  -3.530  10.439
   72    HZ   PHE 112           HZ       PHE 112   4.876  -2.949  10.561
   73    H    VAL 113           H        VAL 113   2.396  -2.307   5.852
   74    HA   VAL 113           HA       VAL 113  -0.099  -3.868   6.269
   75    HB   VAL 113           HB       VAL 113   1.882  -4.455   4.054
   76   HG11  VAL 113          1HG1      VAL 113   0.696  -6.425   4.953
   77   HG12  VAL 113          2HG1      VAL 113  -0.863  -5.604   4.714
   78   HG13  VAL 113          3HG1      VAL 113   0.148  -6.045   3.318
   79   HG21  VAL 113          1HG2      VAL 113  -0.868  -3.169   3.842
   80   HG22  VAL 113          2HG2      VAL 113   0.694  -2.420   3.429
   81   HG23  VAL 113          3HG2      VAL 113   0.103  -3.783   2.483
   82    H    GLY 114           H        GLY 114   0.207  -5.227   7.916
   83    HA2  GLY 114          1HA       GLY 114   2.983  -6.235   8.515
   84    HA3  GLY 114          2HA       GLY 114   1.806  -5.783   9.734
   85    H    GLY 115           H        GLY 115   3.272  -8.308   9.275
   86    HA2  GLY 115          1HA       GLY 115   2.688 -10.459   9.996
   87    HA3  GLY 115          2HA       GLY 115   0.998 -10.183   9.574
   88    H    LEU 116           H        LEU 116   3.411  -9.415   7.176
   89    HA   LEU 116           HA       LEU 116   2.276 -11.270   5.230
   90    HB2  LEU 116          1HB       LEU 116   4.636  -9.347   5.254
   91    HB3  LEU 116          2HB       LEU 116   4.271 -10.349   3.857
   92    HG   LEU 116           HG       LEU 116   2.134  -8.521   5.026
   93   HD11  LEU 116          1HD1      LEU 116   4.256  -7.839   2.961
   94   HD12  LEU 116          2HD1      LEU 116   4.077  -7.097   4.566
   95   HD13  LEU 116          3HD1      LEU 116   2.833  -6.841   3.332
   96   HD21  LEU 116          1HD2      LEU 116   2.689  -9.565   2.216
   97   HD22  LEU 116          2HD2      LEU 116   1.272  -8.625   2.729
   98   HD23  LEU 116          3HD2      LEU 116   1.512 -10.283   3.320
   99    H    SER 117           H        SER 117   3.046 -13.265   4.559
  100    HA   SER 117           HA       SER 117   5.069 -14.571   6.163
  101    HB2  SER 117          1HB       SER 117   4.743 -16.499   4.785
  102    HB3  SER 117          2HB       SER 117   3.159 -15.790   5.135
  103    HG   SER 117           HG       SER 117   3.335 -16.337   2.943
  104    H    VAL 118           H        VAL 118   7.151 -15.316   5.534
  105    HA   VAL 118           HA       VAL 118   8.638 -13.585   3.778
  106    HB   VAL 118           HB       VAL 118  10.556 -14.879   4.200
  107   HG11  VAL 118          1HG1      VAL 118   8.911 -14.994   6.759
  108   HG12  VAL 118          2HG1      VAL 118  10.673 -14.898   6.606
  109   HG13  VAL 118          3HG1      VAL 118   9.673 -13.524   6.106
  110   HG21  VAL 118          1HG2      VAL 118  10.536 -17.044   5.389
  111   HG22  VAL 118          2HG2      VAL 118   8.763 -17.074   5.316
  112   HG23  VAL 118          3HG2      VAL 118   9.725 -17.162   3.824
  113    H    ASN 119           H        ASN 119   6.685 -16.276   3.023
  114    HA   ASN 119           HA       ASN 119   7.928 -16.855   0.418
  115    HB2  ASN 119          1HB       ASN 119   5.281 -17.691   1.682
  116    HB3  ASN 119          2HB       ASN 119   5.894 -18.284   0.141
  117   HD21  ASN 119          1HD2      ASN 119   5.422 -19.497   3.013
  118   HD22  ASN 119          2HD2      ASN 119   6.890 -20.441   3.210
  119    H    THR 120           H        THR 120   5.429 -14.692   1.676
  120    HA   THR 120           HA       THR 120   4.273 -13.983  -0.904
  121    HB   THR 120           HB       THR 120   4.226 -12.585   1.808
  122    HG1  THR 120          1HG       THR 120   3.137 -14.444   1.938
  123   HG21  THR 120          1HG2      THR 120   2.657 -11.993  -0.721
  124   HG22  THR 120          2HG2      THR 120   3.692 -10.887   0.203
  125   HG23  THR 120          3HG2      THR 120   2.170 -11.465   0.898
  126    H    THR 121           H        THR 121   4.833 -12.425  -2.294
  127    HA   THR 121           HA       THR 121   7.096 -10.622  -1.600
  128    HB   THR 121           HB       THR 121   7.730 -12.472  -3.160
  129    HG1  THR 121          1HG       THR 121   9.008 -11.029  -4.286
  130   HG21  THR 121          1HG2      THR 121   6.257 -10.741  -5.210
  131   HG22  THR 121          2HG2      THR 121   5.745 -12.361  -4.687
  132   HG23  THR 121          3HG2      THR 121   7.283 -12.152  -5.535
  133    H    VAL 122           H        VAL 122   7.324  -8.697  -2.959
  134    HA   VAL 122           HA       VAL 122   5.230  -6.983  -2.326
  135    HB   VAL 122           HB       VAL 122   7.642  -6.438  -2.688
  136   HG11  VAL 122          1HG1      VAL 122   8.452  -5.731  -4.848
  137   HG12  VAL 122          2HG1      VAL 122   7.935  -7.418  -4.969
  138   HG13  VAL 122          3HG1      VAL 122   6.912  -6.118  -5.630
  139   HG21  VAL 122          1HG2      VAL 122   7.245  -4.154  -3.366
  140   HG22  VAL 122          2HG2      VAL 122   5.691  -4.588  -4.097
  141   HG23  VAL 122          3HG2      VAL 122   5.909  -4.709  -2.334
  142    H    GLU 123           H        GLU 123   5.709  -8.542  -5.473
  143    HA   GLU 123           HA       GLU 123   3.655  -7.082  -6.872
  144    HB2  GLU 123          1HB       GLU 123   4.800  -9.863  -7.366
  145    HB3  GLU 123          2HB       GLU 123   3.750  -8.962  -8.477
  146    HG2  GLU 123          1HG       GLU 123   5.457  -7.119  -8.524
  147    HG3  GLU 123          2HG       GLU 123   6.536  -8.132  -7.558
  148    H    ASP 124           H        ASP 124   3.527  -9.991  -4.809
  149    HA   ASP 124           HA       ASP 124   0.783 -10.731  -5.431
  150    HB2  ASP 124          1HB       ASP 124   2.180 -11.130  -2.760
  151    HB3  ASP 124          2HB       ASP 124   0.848 -12.049  -3.426
  152    H    VAL 125           H        VAL 125   2.383  -8.763  -2.855
  153    HA   VAL 125           HA       VAL 125  -0.010  -8.056  -1.500
  154    HB   VAL 125           HB       VAL 125   2.546  -6.420  -1.555
  155   HG11  VAL 125          1HG1      VAL 125   0.337  -6.655   0.538
  156   HG12  VAL 125          2HG1      VAL 125   1.835  -5.712   0.699
  157   HG13  VAL 125          3HG1      VAL 125   0.633  -5.250  -0.507
  158   HG21  VAL 125          1HG2      VAL 125   3.144  -8.678  -0.920
  159   HG22  VAL 125          2HG2      VAL 125   3.033  -7.743   0.567
  160   HG23  VAL 125          3HG2      VAL 125   1.709  -8.826   0.111
  161    H    LYS 126           H        LYS 126   1.661  -6.310  -4.163
  162    HA   LYS 126           HA       LYS 126  -0.271  -4.192  -4.336
  163    HB2  LYS 126          1HB       LYS 126   1.855  -3.990  -5.429
  164    HB3  LYS 126          2HB       LYS 126   1.549  -5.395  -6.461
  165    HG2  LYS 126          1HG       LYS 126  -0.073  -4.264  -7.754
  166    HG3  LYS 126          2HG       LYS 126  -0.352  -3.040  -6.513
  167    HD2  LYS 126          1HD       LYS 126   1.870  -2.048  -6.932
  168    HD3  LYS 126          2HD       LYS 126   2.184  -3.274  -8.184
  169    HE2  LYS 126          1HE       LYS 126   0.219  -2.491  -9.467
  170    HE3  LYS 126          2HE       LYS 126  -0.171  -1.322  -8.209
  171    HZ1  LYS 126          1HZ       LYS 126   1.008  -0.305 -10.062
  172    HZ2  LYS 126          2HZ       LYS 126   2.317  -1.256  -9.833
  173    HZ3  LYS 126          3HZ       LYS 126   1.886  -0.132  -8.714
  174    H    HIS 127           H        HIS 127  -0.234  -7.331  -6.153
  175    HA   HIS 127           HA       HIS 127  -2.719  -6.859  -7.469
  176    HB2  HIS 127          1HB       HIS 127  -1.195  -9.383  -6.813
  177    HB3  HIS 127          2HB       HIS 127  -2.764  -9.428  -7.614
  178    HD2  HIS 127          2HD       HIS 127   0.673  -9.555  -8.601
  179    HE1  HIS 127          1HE       HIS 127  -1.229  -7.641 -11.903
  180    HE2  HIS 127          2HE       HIS 127   0.884  -8.837 -11.131
  181    H    TYR 128           H        TYR 128  -2.174  -8.392  -4.266
  182    HA   TYR 128           HA       TYR 128  -4.954  -8.850  -3.820
  183    HB2  TYR 128          1HB       TYR 128  -2.529  -9.024  -2.105
  184    HB3  TYR 128          2HB       TYR 128  -4.112  -8.988  -1.376
  185    HD1  TYR 128          1HD       TYR 128  -1.778 -11.072  -3.299
  186    HD2  TYR 128          2HD       TYR 128  -5.809 -10.734  -1.817
  187    HE1  TYR 128          1HE       TYR 128  -2.092 -13.506  -3.631
  188    HE2  TYR 128          2HE       TYR 128  -6.124 -13.185  -2.137
  189    HH   TYR 128           HH       TYR 128  -3.591 -15.262  -3.572
  190    H    PHE 129           H        PHE 129  -3.305  -5.857  -3.658
  191    HA   PHE 129           HA       PHE 129  -5.668  -4.713  -2.282
  192    HB2  PHE 129          1HB       PHE 129  -2.926  -3.572  -2.630
  193    HB3  PHE 129          2HB       PHE 129  -4.318  -2.594  -2.194
  194    HD1  PHE 129          1HD       PHE 129  -5.828  -3.581  -0.175
  195    HD2  PHE 129          2HD       PHE 129  -1.670  -4.468  -0.846
  196    HE1  PHE 129          1HE       PHE 129  -5.588  -4.291   2.194
  197    HE2  PHE 129          2HE       PHE 129  -1.440  -5.185   1.516
  198    HZ   PHE 129           HZ       PHE 129  -3.398  -5.088   3.045
  199    H    GLU 130           H        GLU 130  -4.209  -4.740  -5.422
  200    HA   GLU 130           HA       GLU 130  -5.582  -2.649  -6.704
  201    HB2  GLU 130          1HB       GLU 130  -4.678  -5.380  -7.648
  202    HB3  GLU 130          2HB       GLU 130  -5.361  -4.203  -8.752
  203    HG2  GLU 130          1HG       GLU 130  -3.084  -3.265  -7.029
  204    HG3  GLU 130          2HG       GLU 130  -2.709  -4.426  -8.276
  205    H    GLN 131           H        GLN 131  -6.985  -5.655  -5.563
  206    HA   GLN 131           HA       GLN 131  -9.331  -5.698  -7.183
  207    HB2  GLN 131          1HB       GLN 131 -10.276  -7.136  -5.481
  208    HB3  GLN 131          2HB       GLN 131  -8.610  -7.602  -5.838
  209    HG2  GLN 131          1HG       GLN 131  -7.857  -6.482  -3.750
  210    HG3  GLN 131          2HG       GLN 131  -9.524  -6.030  -3.388
  211   HE21  GLN 131          1HE2      GLN 131  -7.446  -7.949  -2.072
  212   HE22  GLN 131          2HE2      GLN 131  -8.448  -9.374  -1.772
  213    H    PHE 132           H        PHE 132  -8.574  -3.691  -4.356
  214    HA   PHE 132           HA       PHE 132 -11.359  -2.845  -3.970
  215    HB2  PHE 132          1HB       PHE 132  -8.754  -1.852  -2.750
  216    HB3  PHE 132          2HB       PHE 132 -10.373  -1.403  -2.231
  217    HD1  PHE 132          1HD       PHE 132 -11.996  -3.410  -1.594
  218    HD2  PHE 132          2HD       PHE 132  -7.708  -3.729  -1.787
  219    HE1  PHE 132          1HE       PHE 132 -12.079  -5.456  -0.187
  220    HE2  PHE 132          2HE       PHE 132  -7.785  -5.751  -0.357
  221    HZ   PHE 132           HZ       PHE 132  -9.973  -6.627   0.442
  222    H    GLY 133           H        GLY 133  -8.590  -1.688  -5.696
  223    HA2  GLY 133          1HA       GLY 133  -9.644   0.094  -7.475
  224    HA3  GLY 133          2HA       GLY 133  -9.394   1.081  -6.028
  225    H    LYS 134           H        LYS 134  -7.934   1.775  -8.206
  226    HA   LYS 134           HA       LYS 134  -5.666   0.231  -8.749
  227    HB2  LYS 134          1HB       LYS 134  -6.492   1.798 -10.353
  228    HB3  LYS 134          2HB       LYS 134  -6.177   3.151  -9.284
  229    HG2  LYS 134          1HG       LYS 134  -4.527   3.040 -11.046
  230    HG3  LYS 134          2HG       LYS 134  -3.761   2.857  -9.491
  231    HD2  LYS 134          1HD       LYS 134  -2.822   1.456 -11.332
  232    HD3  LYS 134          2HD       LYS 134  -3.280   0.550  -9.908
  233    HE2  LYS 134          1HE       LYS 134  -5.414  -0.117 -11.022
  234    HE3  LYS 134          2HE       LYS 134  -4.887   0.732 -12.487
  235    HZ1  LYS 134          1HZ       LYS 134  -3.419  -1.508 -11.177
  236    HZ2  LYS 134          2HZ       LYS 134  -2.976  -0.779 -12.576
  237    HZ3  LYS 134          3HZ       LYS 134  -4.348  -1.667 -12.519
  238    H    VAL 135           H        VAL 135  -3.773  -0.008  -8.090
  239    HA   VAL 135           HA       VAL 135  -2.691   1.471  -5.715
  240    HB   VAL 135           HB       VAL 135  -1.921  -1.227  -6.862
  241   HG11  VAL 135          1HG1      VAL 135  -0.980   0.164  -4.328
  242   HG12  VAL 135          2HG1      VAL 135  -0.614  -1.507  -4.772
  243   HG13  VAL 135          3HG1      VAL 135   0.013  -0.183  -5.760
  244   HG21  VAL 135          1HG2      VAL 135  -2.930  -2.187  -4.860
  245   HG22  VAL 135          2HG2      VAL 135  -3.406  -0.566  -4.284
  246   HG23  VAL 135          3HG2      VAL 135  -4.141  -1.257  -5.744
  247    H    ASP 136           H        ASP 136  -1.050   2.827  -6.018
  248    HA   ASP 136           HA       ASP 136   0.271   3.133  -8.618
  249    HB2  ASP 136          1HB       ASP 136   0.482   4.586  -5.976
  250    HB3  ASP 136          2HB       ASP 136   1.647   4.835  -7.268
  251    H    ASP 137           H        ASP 137   1.339   2.225  -5.351
  252    HA   ASP 137           HA       ASP 137   3.590   0.673  -6.436
  253    HB2  ASP 137          1HB       ASP 137   3.897   3.226  -4.858
  254    HB3  ASP 137          2HB       ASP 137   5.114   1.965  -4.771
  255    H    ALA 138           H        ALA 138   4.844  -0.538  -4.916
  256    HA   ALA 138           HA       ALA 138   3.860  -0.790  -2.189
  257    HB1  ALA 138          1HB       ALA 138   3.830  -3.177  -4.086
  258    HB2  ALA 138          2HB       ALA 138   3.615  -3.264  -2.323
  259    HB3  ALA 138          3HB       ALA 138   2.420  -2.416  -3.322
  260    H    MET 139           H        MET 139   5.391  -1.764  -0.786
  261    HA   MET 139           HA       MET 139   8.037  -2.577  -1.807
  262    HB2  MET 139          1HB       MET 139   9.241  -0.875  -0.485
  263    HB3  MET 139          2HB       MET 139   8.326  -0.193  -1.826
  264    HG2  MET 139          1HG       MET 139   6.507   0.448  -0.227
  265    HG3  MET 139          2HG       MET 139   7.511  -0.119   1.105
  266    HE1  MET 139          1HE       MET 139  10.373   2.462   1.324
  267    HE2  MET 139          2HE       MET 139   9.553   1.071   2.071
  268    HE3  MET 139          3HE       MET 139  10.426   0.873   0.533
  269    H    LEU 140           H        LEU 140   8.777  -4.218  -0.587
  270    HA   LEU 140           HA       LEU 140   7.759  -4.515   2.212
  271    HB2  LEU 140          1HB       LEU 140   8.943  -6.707   0.508
  272    HB3  LEU 140          2HB       LEU 140   8.208  -6.852   2.099
  273    HG   LEU 140           HG       LEU 140   6.812  -6.239  -0.532
  274   HD11  LEU 140          1HD1      LEU 140   5.626  -8.333  -0.056
  275   HD12  LEU 140          2HD1      LEU 140   6.500  -8.503   1.480
  276   HD13  LEU 140          3HD1      LEU 140   7.380  -8.608  -0.059
  277   HD21  LEU 140          1HD2      LEU 140   5.671  -4.870   1.097
  278   HD22  LEU 140          2HD2      LEU 140   5.673  -6.192   2.283
  279   HD23  LEU 140          3HD2      LEU 140   4.692  -6.292   0.795
  280    H    MET 141           H        MET 141   9.160  -5.173   3.838
  281    HA   MET 141           HA       MET 141  11.626  -3.661   3.806
  282    HB2  MET 141          1HB       MET 141  10.331  -5.423   5.907
  283    HB3  MET 141          2HB       MET 141  11.711  -4.349   6.185
  284    HG2  MET 141          1HG       MET 141   8.945  -3.434   5.293
  285    HG3  MET 141          2HG       MET 141   9.558  -3.453   6.929
  286    HE1  MET 141          1HE       MET 141  10.283  -1.930   3.294
  287    HE2  MET 141          2HE       MET 141   8.785  -1.331   4.040
  288    HE3  MET 141          3HE       MET 141  10.159  -0.232   3.793
  289    H    PHE 142           H        PHE 142  12.418  -5.163   1.968
  290    HA   PHE 142           HA       PHE 142  13.508  -7.697   2.626
  291    HB2  PHE 142          1HB       PHE 142  13.946  -5.845   0.304
  292    HB3  PHE 142          2HB       PHE 142  14.806  -7.364   0.464
  293    HD1  PHE 142          1HD       PHE 142  13.376  -9.512   0.919
  294    HD2  PHE 142          2HD       PHE 142  11.829  -5.882  -0.799
  295    HE1  PHE 142          1HE       PHE 142  11.553 -10.808  -0.165
  296    HE2  PHE 142          2HE       PHE 142  10.004  -7.174  -1.885
  297    HZ   PHE 142           HZ       PHE 142   9.860  -9.638  -1.565
  298    H    ASP 143           H        ASP 143  15.376  -8.528   3.252
  299    HA   ASP 143           HA       ASP 143  17.629  -6.694   3.911
  300    HB2  ASP 143          1HB       ASP 143  16.934  -7.883   5.814
  301    HB3  ASP 143          2HB       ASP 143  16.884  -9.413   4.939
  302    H    LYS 144           H        LYS 144  19.106  -6.449   2.401
  303    HA   LYS 144           HA       LYS 144  19.413  -8.056   0.083
  304    HB2  LYS 144          1HB       LYS 144  21.404  -6.716  -0.354
  305    HB3  LYS 144          2HB       LYS 144  20.066  -5.714   0.199
  306    HG2  LYS 144          1HG       LYS 144  21.086  -5.586   2.473
  307    HG3  LYS 144          2HG       LYS 144  22.393  -6.652   1.946
  308    HD2  LYS 144          1HD       LYS 144  23.198  -4.393   1.946
  309    HD3  LYS 144          2HD       LYS 144  23.104  -4.957   0.272
  310    HE2  LYS 144          1HE       LYS 144  20.957  -3.736  -0.021
  311    HE3  LYS 144          2HE       LYS 144  21.013  -3.220   1.670
  312    HZ1  LYS 144          1HZ       LYS 144  23.062  -2.001   1.160
  313    HZ2  LYS 144          2HZ       LYS 144  21.856  -1.493   0.186
  314    HZ3  LYS 144          3HZ       LYS 144  23.013  -2.481  -0.402
  315    H    THR 145           H        THR 145  20.678  -8.673   3.227
  316    HA   THR 145           HA       THR 145  22.826 -10.419   2.417
  317    HB   THR 145           HB       THR 145  21.584 -10.751   5.102
  318    HG1  THR 145          1HG       THR 145  21.538  -8.600   4.984
  319   HG21  THR 145          1HG2      THR 145  24.466 -10.504   4.128
  320   HG22  THR 145          2HG2      THR 145  23.628 -12.015   4.551
  321   HG23  THR 145          3HG2      THR 145  23.955 -10.810   5.804
  322    H    THR 146           H        THR 146  19.427 -10.949   2.707
  323    HA   THR 146           HA       THR 146  19.799 -13.861   2.209
  324    HB   THR 146           HB       THR 146  18.296 -14.561   3.789
  325    HG1  THR 146          1HG       THR 146  16.989 -13.053   4.949
  326   HG21  THR 146          1HG2      THR 146  18.941 -13.705   5.950
  327   HG22  THR 146          2HG2      THR 146  19.532 -12.187   5.249
  328   HG23  THR 146          3HG2      THR 146  20.378 -13.720   4.918
  329    H    ASN 147           H        ASN 147  18.114 -11.074   1.268
  330    HA   ASN 147           HA       ASN 147  16.488 -10.572  -0.130
  331    HB2  ASN 147          1HB       ASN 147  16.880 -13.323  -1.345
  332    HB3  ASN 147          2HB       ASN 147  15.941 -12.019  -2.057
  333   HD21  ASN 147          1HD2      ASN 147  18.675 -13.465  -2.681
  334   HD22  ASN 147          2HD2      ASN 147  19.667 -12.084  -3.131
  335    H    ARG 148           H        ARG 148  15.902 -12.185   2.452
  336    HA   ARG 148           HA       ARG 148  12.961 -12.554   2.002
  337    HB2  ARG 148          1HB       ARG 148  14.601 -13.093   4.515
  338    HB3  ARG 148          2HB       ARG 148  12.895 -13.468   4.256
  339    HG2  ARG 148          1HG       ARG 148  13.568 -15.026   2.387
  340    HG3  ARG 148          2HG       ARG 148  15.265 -14.732   2.808
  341    HD2  ARG 148          1HD       ARG 148  14.805 -15.533   5.124
  342    HD3  ARG 148          2HD       ARG 148  13.150 -15.922   4.660
  343    HE   ARG 148           HE       ARG 148  15.607 -17.388   4.006
  344   HH11  ARG 148          1HH1      ARG 148  12.259 -17.025   3.025
  345   HH12  ARG 148          2HH1      ARG 148  12.207 -18.616   2.316
  346   HH21  ARG 148          1HH2      ARG 148  15.471 -19.385   3.064
  347   HH22  ARG 148          2HH2      ARG 148  13.983 -19.905   2.331
  348    H    HIS 149           H        HIS 149  11.539 -11.482   3.658
  349    HA   HIS 149           HA       HIS 149  12.580  -8.769   4.368
  350    HB2  HIS 149          1HB       HIS 149  10.349  -7.868   3.957
  351    HB3  HIS 149          2HB       HIS 149  11.011  -8.615   2.514
  352    HD2  HIS 149          2HD       HIS 149   9.477 -10.341   1.317
  353    HE1  HIS 149          1HE       HIS 149   6.600 -10.966   4.392
  354    HE2  HIS 149          2HE       HIS 149   7.219 -11.506   1.974
  355    H    ARG 150           H        ARG 150  11.511  -7.664   6.074
  356    HA   ARG 150           HA       ARG 150  11.508  -9.196   8.513
  357    HB2  ARG 150          1HB       ARG 150  10.731  -6.298   8.006
  358    HB3  ARG 150          2HB       ARG 150  10.900  -7.026   9.602
  359    HG2  ARG 150          1HG       ARG 150  13.269  -7.624   9.064
  360    HG3  ARG 150          2HG       ARG 150  13.142  -6.660   7.584
  361    HD2  ARG 150          1HD       ARG 150  12.580  -5.592  10.396
  362    HD3  ARG 150          2HD       ARG 150  14.144  -5.500   9.602
  363    HE   ARG 150           HE       ARG 150  11.706  -4.268   8.376
  364   HH11  ARG 150          1HH1      ARG 150  14.947  -3.691   9.674
  365   HH12  ARG 150          2HH1      ARG 150  14.971  -2.078   8.955
  366   HH21  ARG 150          1HH2      ARG 150  11.984  -2.220   7.438
  367   HH22  ARG 150          2HH2      ARG 150  13.402  -1.306   7.901
  368    H    GLY 151           H        GLY 151   8.997  -9.390   6.470
  369    HA2  GLY 151          1HA       GLY 151   6.902 -10.262   6.812
  370    HA3  GLY 151          2HA       GLY 151   7.089 -10.122   8.559
  371    H    PHE 152           H        PHE 152   7.659  -7.198   6.751
  372    HA   PHE 152           HA       PHE 152   4.868  -6.368   6.703
  373    HB2  PHE 152          1HB       PHE 152   5.048  -4.476   8.129
  374    HB3  PHE 152          2HB       PHE 152   5.555  -5.863   9.046
  375    HD1  PHE 152          1HD       PHE 152   6.451  -2.593   7.779
  376    HD2  PHE 152          2HD       PHE 152   8.054  -6.157   9.597
  377    HE1  PHE 152          1HE       PHE 152   8.396  -1.297   8.580
  378    HE2  PHE 152          2HE       PHE 152  10.035  -4.860  10.376
  379    HZ   PHE 152           HZ       PHE 152  10.190  -2.424   9.904
  380    H    GLY 153           H        GLY 153   4.668  -4.155   5.758
  381    HA2  GLY 153          1HA       GLY 153   6.846  -2.863   4.370
  382    HA3  GLY 153          2HA       GLY 153   5.903  -3.881   3.279
  383    H    PHE 154           H        PHE 154   5.628  -1.719   2.287
  384    HA   PHE 154           HA       PHE 154   3.166  -0.396   3.290
  385    HB2  PHE 154          1HB       PHE 154   5.605   0.949   2.111
  386    HB3  PHE 154          2HB       PHE 154   4.056   1.733   2.367
  387    HD1  PHE 154          1HD       PHE 154   3.308   2.413   4.589
  388    HD2  PHE 154          2HD       PHE 154   6.973   0.206   4.062
  389    HE1  PHE 154          1HE       PHE 154   3.984   2.970   6.910
  390    HE2  PHE 154          2HE       PHE 154   7.609   0.695   6.390
  391    HZ   PHE 154           HZ       PHE 154   6.135   2.111   7.821
  392    H    VAL 155           H        VAL 155   1.769   0.597   1.815
  393    HA   VAL 155           HA       VAL 155   2.082  -0.019  -1.076
  394    HB   VAL 155           HB       VAL 155  -0.431  -0.706   0.475
  395   HG11  VAL 155          1HG1      VAL 155  -1.186  -1.746  -1.637
  396   HG12  VAL 155          2HG1      VAL 155  -0.965  -0.010  -1.816
  397   HG13  VAL 155          3HG1      VAL 155   0.265  -1.127  -2.453
  398   HG21  VAL 155          1HG2      VAL 155   1.313  -2.385   0.927
  399   HG22  VAL 155          2HG2      VAL 155   0.032  -3.039  -0.083
  400   HG23  VAL 155          3HG2      VAL 155   1.586  -2.579  -0.816
  401    H    THR 156           H        THR 156   1.230   1.467  -2.433
  402    HA   THR 156           HA       THR 156   0.009   3.907  -1.266
  403    HB   THR 156           HB       THR 156   1.911   4.029  -3.577
  404    HG1  THR 156          1HG       THR 156   3.523   4.515  -2.117
  405   HG21  THR 156          1HG2      THR 156   2.224   6.351  -2.744
  406   HG22  THR 156          2HG2      THR 156   1.015   6.038  -1.477
  407   HG23  THR 156          3HG2      THR 156   0.545   6.031  -3.193
  408    H    PHE 157           H        PHE 157  -1.647   4.979  -2.305
  409    HA   PHE 157           HA       PHE 157  -2.888   3.410  -4.473
  410    HB2  PHE 157          1HB       PHE 157  -3.998   4.906  -2.131
  411    HB3  PHE 157          2HB       PHE 157  -5.007   4.361  -3.461
  412    HD1  PHE 157          1HD       PHE 157  -2.689   3.159  -0.784
  413    HD2  PHE 157          2HD       PHE 157  -5.708   2.082  -3.666
  414    HE1  PHE 157          1HE       PHE 157  -2.830   0.898   0.200
  415    HE2  PHE 157          2HE       PHE 157  -5.890  -0.164  -2.621
  416    HZ   PHE 157           HZ       PHE 157  -4.437  -0.767  -0.694
  417    H    GLU 158           H        GLU 158  -4.292   4.251  -5.983
  418    HA   GLU 158           HA       GLU 158  -3.546   6.716  -7.293
  419    HB2  GLU 158          1HB       GLU 158  -4.479   4.969  -8.606
  420    HB3  GLU 158          2HB       GLU 158  -5.857   4.789  -7.529
  421    HG2  GLU 158          1HG       GLU 158  -6.582   5.742  -9.590
  422    HG3  GLU 158          2HG       GLU 158  -6.837   6.877  -8.280
  423    H    SER 159           H        SER 159  -6.215   5.900  -5.049
  424    HA   SER 159           HA       SER 159  -6.736   8.804  -4.629
  425    HB2  SER 159          1HB       SER 159  -8.378   8.063  -6.243
  426    HB3  SER 159          2HB       SER 159  -8.822   6.685  -5.219
  427    HG   SER 159           HG       SER 159 -10.193   8.628  -5.073
  428    H    GLU 160           H        GLU 160  -7.368   9.414  -2.641
  429    HA   GLU 160           HA       GLU 160  -6.750   7.794  -0.348
  430    HB2  GLU 160          1HB       GLU 160  -6.671  10.338  -0.603
  431    HB3  GLU 160          2HB       GLU 160  -8.438  10.316  -0.462
  432    HG2  GLU 160          1HG       GLU 160  -8.159   9.164   1.779
  433    HG3  GLU 160          2HG       GLU 160  -6.407   9.327   1.589
  434    H    ASP 161           H        ASP 161  -9.723   8.266  -2.217
  435    HA   ASP 161           HA       ASP 161 -11.561   7.212  -0.278
  436    HB2  ASP 161          1HB       ASP 161 -11.658   7.335  -3.299
  437    HB3  ASP 161          2HB       ASP 161 -12.938   6.620  -2.330
  438    H    ILE 162           H        ILE 162  -9.327   5.556  -2.443
  439    HA   ILE 162           HA       ILE 162 -10.417   2.906  -1.813
  440    HB   ILE 162           HB       ILE 162  -7.634   3.474  -2.864
  441   HG12  ILE 162          1HG1      ILE 162  -8.983   4.569  -4.463
  442   HG13  ILE 162          2HG1      ILE 162  -8.506   3.010  -5.116
  443   HG21  ILE 162          1HG2      ILE 162  -9.484   1.047  -2.966
  444   HG22  ILE 162          2HG2      ILE 162  -7.944   1.175  -3.841
  445   HG23  ILE 162          3HG2      ILE 162  -7.957   1.210  -2.082
  446   HD11  ILE 162          1HD1      ILE 162 -11.260   3.771  -4.035
  447   HD12  ILE 162          2HD1      ILE 162 -10.817   3.424  -5.714
  448   HD13  ILE 162          3HD1      ILE 162 -10.809   2.121  -4.508
  449    H    VAL 163           H        VAL 163  -7.714   4.970  -0.632
  450    HA   VAL 163           HA       VAL 163  -6.606   3.093   1.170
  451    HB   VAL 163           HB       VAL 163  -6.823   6.125   1.533
  452   HG11  VAL 163          1HG1      VAL 163  -4.795   5.891   2.958
  453   HG12  VAL 163          2HG1      VAL 163  -6.218   5.132   3.676
  454   HG13  VAL 163          3HG1      VAL 163  -4.989   4.126   2.887
  455   HG21  VAL 163          1HG2      VAL 163  -5.674   5.487  -0.564
  456   HG22  VAL 163          2HG2      VAL 163  -4.567   6.201   0.605
  457   HG23  VAL 163          3HG2      VAL 163  -4.577   4.443   0.368
  458    H    GLU 164           H        GLU 164  -9.317   5.416   1.699
  459    HA   GLU 164           HA       GLU 164  -9.936   4.581   4.378
  460    HB2  GLU 164          1HB       GLU 164 -11.695   5.764   2.194
  461    HB3  GLU 164          2HB       GLU 164 -12.218   5.540   3.856
  462    HG2  GLU 164          1HG       GLU 164  -9.903   7.314   2.978
  463    HG3  GLU 164          2HG       GLU 164 -11.536   7.862   3.326
  464    H    LYS 165           H        LYS 165 -11.306   3.437   1.251
  465    HA   LYS 165           HA       LYS 165 -13.161   1.541   2.262
  466    HB2  LYS 165          1HB       LYS 165 -12.989   2.374  -0.069
  467    HB3  LYS 165          2HB       LYS 165 -11.511   1.439  -0.295
  468    HG2  LYS 165          1HG       LYS 165 -12.814  -0.663   0.192
  469    HG3  LYS 165          2HG       LYS 165 -14.287   0.309   0.260
  470    HD2  LYS 165          1HD       LYS 165 -12.394  -0.012  -2.108
  471    HD3  LYS 165          2HD       LYS 165 -13.957  -0.800  -1.938
  472    HE2  LYS 165          1HE       LYS 165 -13.497   2.210  -2.204
  473    HE3  LYS 165          2HE       LYS 165 -13.977   1.126  -3.509
  474    HZ1  LYS 165          1HZ       LYS 165 -15.602   1.669  -1.077
  475    HZ2  LYS 165          2HZ       LYS 165 -16.026   0.638  -2.275
  476    HZ3  LYS 165          3HZ       LYS 165 -15.906   2.236  -2.575
  477    H    VAL 166           H        VAL 166  -9.776   1.059   1.361
  478    HA   VAL 166           HA       VAL 166  -9.571  -1.733   2.047
  479    HB   VAL 166           HB       VAL 166  -7.453   0.438   1.822
  480   HG11  VAL 166          1HG1      VAL 166  -7.158  -2.583   1.822
  481   HG12  VAL 166          2HG1      VAL 166  -5.868  -1.427   1.424
  482   HG13  VAL 166          3HG1      VAL 166  -6.530  -1.474   3.061
  483   HG21  VAL 166          1HG2      VAL 166  -8.841  -0.097  -0.300
  484   HG22  VAL 166          2HG2      VAL 166  -7.098  -0.248  -0.414
  485   HG23  VAL 166          3HG2      VAL 166  -8.110  -1.699  -0.231
  486    H    CYS 167           H        CYS 167  -8.592   1.252   3.839
  487    HA   CYS 167           HA       CYS 167  -7.549  -0.145   6.077
  488    HB2  CYS 167          1HB       CYS 167  -6.989   2.184   5.474
  489    HB3  CYS 167          2HB       CYS 167  -8.641   2.691   5.872
  490    HG   CYS 167           HG       CYS 167  -6.311   1.358   7.830
  491    H    GLU 168           H        GLU 168 -10.915   1.013   5.492
  492    HA   GLU 168           HA       GLU 168 -11.978   0.545   8.057
  493    HB2  GLU 168          1HB       GLU 168 -13.061   1.879   6.373
  494    HB3  GLU 168          2HB       GLU 168 -13.035   0.553   5.219
  495    HG2  GLU 168          1HG       GLU 168 -15.228   0.892   5.922
  496    HG3  GLU 168          2HG       GLU 168 -14.693  -0.681   6.490
  497    H    ILE 169           H        ILE 169 -11.171  -1.780   5.524
  498    HA   ILE 169           HA       ILE 169 -12.686  -4.011   6.636
  499    HB   ILE 169           HB       ILE 169 -10.392  -3.838   4.662
  500   HG12  ILE 169          1HG1      ILE 169 -13.316  -4.576   4.150
  501   HG13  ILE 169          2HG1      ILE 169 -12.775  -2.906   4.105
  502   HG21  ILE 169          1HG2      ILE 169 -12.013  -6.293   5.447
  503   HG22  ILE 169          2HG2      ILE 169 -10.929  -6.198   4.042
  504   HG23  ILE 169          3HG2      ILE 169 -10.265  -6.041   5.654
  505   HD11  ILE 169          1HD1      ILE 169 -11.152  -3.434   2.319
  506   HD12  ILE 169          2HD1      ILE 169 -11.762  -5.107   2.284
  507   HD13  ILE 169          3HD1      ILE 169 -12.833  -3.761   1.861
  508    H    HIS 170           H        HIS 170  -9.490  -2.679   7.115
  509    HA   HIS 170           HA       HIS 170  -7.883  -2.871   8.641
  510    HB2  HIS 170          1HB       HIS 170  -9.827  -2.591  10.146
  511    HB3  HIS 170          2HB       HIS 170  -9.883  -4.335  10.371
  512    HD2  HIS 170          2HD       HIS 170  -6.319  -3.014  10.326
  513    HE1  HIS 170          1HE       HIS 170  -7.370  -3.349  14.437
  514    HE2  HIS 170          2HE       HIS 170  -5.439  -3.028  12.791
  515    H    PHE 171           H        PHE 171  -9.453  -6.076   8.551
  516    HA   PHE 171           HA       PHE 171  -6.763  -7.304   8.350
  517    HB2  PHE 171          1HB       PHE 171  -9.169  -8.335   9.765
  518    HB3  PHE 171          2HB       PHE 171  -7.937  -9.422   9.153
  519    HD1  PHE 171          1HD       PHE 171  -5.725  -9.564  10.116
  520    HD2  PHE 171          2HD       PHE 171  -8.554  -6.637  11.539
  521    HE1  PHE 171          1HE       PHE 171  -4.292  -9.139  12.097
  522    HE2  PHE 171          2HE       PHE 171  -7.107  -6.203  13.511
  523    HZ   PHE 171           HZ       PHE 171  -4.971  -7.451  13.791
  524    H    HIS 172           H        HIS 172  -6.081  -8.303   6.667
  525    HA   HIS 172           HA       HIS 172  -8.008  -8.839   4.428
  526    HB2  HIS 172          1HB       HIS 172  -5.322  -7.428   4.422
  527    HB3  HIS 172          2HB       HIS 172  -6.080  -8.056   2.967
  528    HD2  HIS 172          2HD       HIS 172  -6.645  -5.311   5.663
  529    HE1  HIS 172          1HE       HIS 172  -8.966  -4.257   2.269
  530    HE2  HIS 172          2HE       HIS 172  -8.122  -3.471   4.518
  531    H    GLU 173           H        GLU 173  -7.472 -10.435   2.917
  532    HA   GLU 173           HA       GLU 173  -5.635 -12.545   3.941
  533    HB2  GLU 173          1HB       GLU 173  -8.010 -13.108   3.707
  534    HB3  GLU 173          2HB       GLU 173  -7.935 -12.740   1.975
  535    HG2  GLU 173          1HG       GLU 173  -6.317 -14.563   1.637
  536    HG3  GLU 173          2HG       GLU 173  -6.246 -14.856   3.377
  537    H    ILE 174           H        ILE 174  -3.771 -12.927   2.905
  538    HA   ILE 174           HA       ILE 174  -3.411 -12.238   0.024
  539    HB   ILE 174           HB       ILE 174  -1.458 -11.431   2.222
  540   HG12  ILE 174          1HG1      ILE 174  -3.420  -9.828   0.559
  541   HG13  ILE 174          2HG1      ILE 174  -3.261  -9.885   2.307
  542   HG21  ILE 174          1HG2      ILE 174  -0.109 -10.475   0.416
  543   HG22  ILE 174          2HG2      ILE 174  -0.348 -12.180   0.105
  544   HG23  ILE 174          3HG2      ILE 174  -1.304 -10.980  -0.791
  545   HD11  ILE 174          1HD1      ILE 174  -1.411  -8.500   0.338
  546   HD12  ILE 174          2HD1      ILE 174  -2.440  -7.771   1.577
  547   HD13  ILE 174          3HD1      ILE 174  -1.021  -8.724   2.062
  548    H    ASN 175           H        ASN 175  -2.526 -13.926  -1.038
  549    HA   ASN 175           HA       ASN 175  -1.907 -16.081  -1.395
  550    HB2  ASN 175          1HB       ASN 175   0.292 -15.240   0.521
  551    HB3  ASN 175          2HB       ASN 175   0.333 -16.728  -0.413
  552   HD21  ASN 175          1HD2      ASN 175   2.057 -14.314  -0.452
  553   HD22  ASN 175          2HD2      ASN 175   2.201 -13.986  -2.183
  554    H    ASN 176           H        ASN 176  -4.009 -15.948   0.347
  555    HA   ASN 176           HA       ASN 176  -5.272 -16.974   1.858
  556    HB2  ASN 176          1HB       ASN 176  -3.461 -19.368   1.443
  557    HB3  ASN 176          2HB       ASN 176  -5.045 -19.398   2.201
  558   HD21  ASN 176          1HD2      ASN 176  -4.469 -21.013   0.016
  559   HD22  ASN 176          2HD2      ASN 176  -5.447 -20.449  -1.332
  560    H    LYS 177           H        LYS 177  -2.488 -15.774   2.842
  561    HA   LYS 177           HA       LYS 177  -2.701 -16.654   5.688
  562    HB2  LYS 177          1HB       LYS 177  -0.680 -14.741   4.459
  563    HB3  LYS 177          2HB       LYS 177  -0.631 -15.467   6.060
  564    HG2  LYS 177          1HG       LYS 177  -0.192 -16.840   3.394
  565    HG3  LYS 177          2HG       LYS 177   0.981 -16.532   4.674
  566    HD2  LYS 177          1HD       LYS 177  -0.227 -18.114   6.171
  567    HD3  LYS 177          2HD       LYS 177  -1.384 -18.451   4.862
  568    HE2  LYS 177          1HE       LYS 177   0.502 -19.190   3.407
  569    HE3  LYS 177          2HE       LYS 177   1.625 -18.936   4.749
  570    HZ1  LYS 177          1HZ       LYS 177   0.384 -20.630   6.007
  571    HZ2  LYS 177          2HZ       LYS 177   0.924 -21.259   4.603
  572    HZ3  LYS 177          3HZ       LYS 177  -0.647 -20.858   4.760
  573    H    MET 178           H        MET 178  -2.581 -14.917   7.296
  574    HA   MET 178           HA       MET 178  -4.630 -12.844   6.729
  575    HB2  MET 178          1HB       MET 178  -5.075 -14.473   8.534
  576    HB3  MET 178          2HB       MET 178  -3.539 -14.064   9.285
  577    HG2  MET 178          1HG       MET 178  -4.848 -12.849  10.599
  578    HG3  MET 178          2HG       MET 178  -4.576 -11.618   9.387
  579    HE1  MET 178          1HE       MET 178  -6.386 -10.817   7.670
  580    HE2  MET 178          2HE       MET 178  -6.720 -12.431   6.988
  581    HE3  MET 178          3HE       MET 178  -8.053 -11.423   7.571
  582    H    VAL 179           H        VAL 179  -4.098 -10.748   6.600
  583    HA   VAL 179           HA       VAL 179  -1.711  -9.736   8.034
  584    HB   VAL 179           HB       VAL 179  -0.975  -8.336   6.326
  585   HG11  VAL 179          1HG1      VAL 179  -0.321  -9.804   4.548
  586   HG12  VAL 179          2HG1      VAL 179  -0.259 -10.665   6.096
  587   HG13  VAL 179          3HG1      VAL 179  -1.594 -10.971   4.951
  588   HG21  VAL 179          1HG2      VAL 179  -3.085  -7.542   5.373
  589   HG22  VAL 179          2HG2      VAL 179  -1.974  -8.086   4.127
  590   HG23  VAL 179          3HG2      VAL 179  -3.335  -9.124   4.599
  591    H    GLU 180           H        GLU 180  -1.680  -7.389   8.273
  592    HA   GLU 180           HA       GLU 180  -4.432  -6.250   8.710
  593    HB2  GLU 180          1HB       GLU 180  -3.287  -6.983  10.813
  594    HB3  GLU 180          2HB       GLU 180  -1.983  -5.847  10.442
  595    HG2  GLU 180          1HG       GLU 180  -3.756  -4.003  10.397
  596    HG3  GLU 180          2HG       GLU 180  -4.896  -5.197  11.024
  597    H    CYS 181           H        CYS 181  -4.829  -4.299   7.806
  598    HA   CYS 181           HA       CYS 181  -2.583  -2.684   6.707
  599    HB2  CYS 181          1HB       CYS 181  -4.310  -1.369   5.570
  600    HB3  CYS 181          2HB       CYS 181  -4.359  -3.071   5.105
  601    HG   CYS 181           HG       CYS 181  -6.201  -1.588   7.417
  602    H    LYS 182           H        LYS 182  -2.132  -0.633   7.408
  603    HA   LYS 182           HA       LYS 182  -3.926   0.720   9.373
  604    HB2  LYS 182          1HB       LYS 182  -0.942   0.848   9.796
  605    HB3  LYS 182          2HB       LYS 182  -2.220   1.285  10.906
  606    HG2  LYS 182          1HG       LYS 182  -2.660  -1.082  11.394
  607    HG3  LYS 182          2HG       LYS 182  -1.503  -1.585  10.141
  608    HD2  LYS 182          1HD       LYS 182   0.292  -0.300  11.347
  609    HD3  LYS 182          2HD       LYS 182  -0.826  -0.059  12.694
  610    HE2  LYS 182          1HE       LYS 182  -0.063  -2.788  11.561
  611    HE3  LYS 182          2HE       LYS 182   0.868  -1.989  12.827
  612    HZ1  LYS 182          1HZ       LYS 182  -0.769  -3.574  13.694
  613    HZ2  LYS 182          2HZ       LYS 182  -2.012  -2.720  13.101
  614    HZ3  LYS 182          3HZ       LYS 182  -1.061  -2.066  14.268
  615    H    LYS 183           H        LYS 183  -3.782   3.073   9.167
  616    HA   LYS 183           HA       LYS 183  -2.747   4.091   6.630
  617    HB2  LYS 183          1HB       LYS 183  -3.833   5.449   9.114
  618    HB3  LYS 183          2HB       LYS 183  -3.211   6.359   7.728
  619    HG2  LYS 183          1HG       LYS 183  -4.845   5.448   6.231
  620    HG3  LYS 183          2HG       LYS 183  -5.353   4.227   7.400
  621    HD2  LYS 183          1HD       LYS 183  -6.199   6.022   8.909
  622    HD3  LYS 183          2HD       LYS 183  -5.763   7.234   7.680
  623    HE2  LYS 183          1HE       LYS 183  -7.276   6.140   6.056
  624    HE3  LYS 183          2HE       LYS 183  -7.664   4.881   7.236
  625    HZ1  LYS 183          1HZ       LYS 183  -8.670   6.594   8.643
  626    HZ2  LYS 183          2HZ       LYS 183  -9.363   6.606   7.151
  627    HZ3  LYS 183          3HZ       LYS 183  -8.299   7.764   7.549
  628    H    ALA 184           H        ALA 184  -0.798   4.949   6.107
  629    HA   ALA 184           HA       ALA 184   1.376   4.352   7.935
  630    HB1  ALA 184          1HB       ALA 184   1.432   5.670   5.201
  631    HB2  ALA 184          2HB       ALA 184   2.823   5.003   6.078
  632    HB3  ALA 184          3HB       ALA 184   1.536   3.918   5.519
  633    H    GLN 185           H        GLN 185   2.899   5.729   8.810
  634    HA   GLN 185           HA       GLN 185   2.701   8.624   8.418
  635    HB2  GLN 185          1HB       GLN 185   2.749   9.160  10.793
  636    HB3  GLN 185          2HB       GLN 185   1.302   8.244  10.377
  637    HG2  GLN 185          1HG       GLN 185   2.607   6.144  11.205
  638    HG3  GLN 185          2HG       GLN 185   3.745   7.294  11.910
  639   HE21  GLN 185          1HE2      GLN 185   2.494   9.129  13.283
  640   HE22  GLN 185          2HE2      GLN 185   1.157   8.524  14.246
  641    HA   PRO 186           HA       PRO 186   6.933   8.179   7.884
  642    HB2  PRO 186          1HB       PRO 186   7.479  10.722   9.405
  643    HB3  PRO 186          2HB       PRO 186   8.008  10.246   7.764
  644    HG2  PRO 186          1HG       PRO 186   5.929  11.946   8.067
  645    HG3  PRO 186          2HG       PRO 186   5.823  10.616   6.865
  646    HD2  PRO 186          1HD       PRO 186   4.677  10.704   9.670
  647    HD3  PRO 186          2HD       PRO 186   3.897  10.220   8.147
  648    H    LYS 187           H        LYS 187   9.068   7.803   8.654
  649    HA   LYS 187           HA       LYS 187   9.335   6.134  10.870
  650    HB2  LYS 187          1HB       LYS 187  10.734   6.006   8.900
  651    HB3  LYS 187          2HB       LYS 187  11.245   7.676   9.086
  652    HG2  LYS 187          1HG       LYS 187  13.087   6.357   9.597
  653    HG3  LYS 187          2HG       LYS 187  12.546   7.064  11.111
  654    HD2  LYS 187          1HD       LYS 187  11.410   4.841  11.644
  655    HD3  LYS 187          2HD       LYS 187  12.105   4.209  10.139
  656    HE2  LYS 187          1HE       LYS 187  14.397   4.964  11.058
  657    HE3  LYS 187          2HE       LYS 187  13.570   5.200  12.606
  658    HZ1  LYS 187          1HZ       LYS 187  12.833   2.787  12.311
  659    HZ2  LYS 187          2HZ       LYS 187  14.431   3.011  12.643
  660    HZ3  LYS 187          3HZ       LYS 187  13.966   2.663  11.119
  661    H    GLU 188           H        GLU 188   9.741   9.506  10.776
  662    HA   GLU 188           HA       GLU 188  11.207   9.799  13.290
  663    HB2  GLU 188          1HB       GLU 188  11.494  11.360  11.418
  664    HB3  GLU 188          2HB       GLU 188   9.784  11.763  11.458
  665    HG2  GLU 188          1HG       GLU 188  11.053  13.565  12.383
  666    HG3  GLU 188          2HG       GLU 188  10.039  12.874  13.631
  667    H    VAL 189           H        VAL 189   7.800   9.586  12.489
  668    HA   VAL 189           HA       VAL 189   6.908  11.223  14.724
  669    HB   VAL 189           HB       VAL 189   5.223   9.523  12.864
  670   HG11  VAL 189          1HG1      VAL 189   4.542  11.957  14.571
  671   HG12  VAL 189          2HG1      VAL 189   3.459  11.201  13.384
  672   HG13  VAL 189          3HG1      VAL 189   3.951  10.300  14.823
  673   HG21  VAL 189          1HG2      VAL 189   4.883  11.698  11.630
  674   HG22  VAL 189          2HG2      VAL 189   6.190  12.403  12.597
  675   HG23  VAL 189          3HG2      VAL 189   6.519  11.054  11.487
  676    H    MET 190           H        MET 190   7.246   7.703  14.265
  677    HA   MET 190           HA       MET 190   6.801   7.208  17.031
  678    HB2  MET 190          1HB       MET 190   4.903   5.620  16.724
  679    HB3  MET 190          2HB       MET 190   4.493   7.304  16.512
  680    HG2  MET 190          1HG       MET 190   3.304   6.161  14.870
  681    HG3  MET 190          2HG       MET 190   4.582   7.024  14.038
  682    HE1  MET 190          1HE       MET 190   3.078   3.612  15.144
  683    HE2  MET 190          2HE       MET 190   4.273   2.427  14.581
  684    HE3  MET 190          3HE       MET 190   4.660   3.474  15.953
  685    H    SER 191           H        SER 191   7.013   5.046  17.501
  686    HA   SER 191           HA       SER 191   8.743   3.326  15.805
  687    HB2  SER 191          1HB       SER 191  10.467   3.296  17.569
  688    HB3  SER 191          2HB       SER 191  10.198   4.931  16.969
  689    HG   SER 191           HG       SER 191  10.304   4.853  19.258
  690    HA   PRO 192           HA       PRO 192   6.517   0.092  17.705
  691    HB2  PRO 192          1HB       PRO 192   8.197  -2.050  17.861
  692    HB3  PRO 192          2HB       PRO 192   7.657  -1.343  16.308
  693    HG2  PRO 192          1HG       PRO 192  10.252  -0.828  17.791
  694    HG3  PRO 192          2HG       PRO 192  10.029  -1.207  16.056
  695    HD2  PRO 192          1HD       PRO 192  10.333   1.336  16.994
  696    HD3  PRO 192          2HD       PRO 192   9.298   0.992  15.588
  697    H    THR 193           H        THR 193   5.917  -0.905  19.630
  698    HA   THR 193           HA       THR 193   7.688  -0.966  21.932
  699    HB   THR 193           HB       THR 193   6.832   1.404  21.824
  700    HG1  THR 193          1HG       THR 193   6.649   1.432  24.040
  701   HG21  THR 193          1HG2      THR 193   4.425   0.878  21.323
  702   HG22  THR 193          2HG2      THR 193   4.649   1.888  22.760
  703   HG23  THR 193          3HG2      THR 193   4.275   0.162  22.945
  704    H    GLY 194           H        GLY 194   6.815  -1.925  23.869
  705    HA2  GLY 194          1HA       GLY 194   4.453  -3.235  24.322
  706    HA3  GLY 194          2HA       GLY 194   5.296  -4.340  23.231
  707    H    SER 195           H        SER 195   4.905  -5.646  25.314
  708    HA   SER 195           HA       SER 195   6.701  -5.342  27.550
  709    HB2  SER 195          1HB       SER 195   6.069  -7.727  28.003
  710    HB3  SER 195          2HB       SER 195   4.717  -6.599  27.873
  711    HG   SER 195           HG       SER 195   5.594  -8.084  25.613
  712    H    ALA 196           H        ALA 196   8.594  -6.479  28.074
  713    HA   ALA 196           HA       ALA 196  10.464  -6.705  25.930
  714    HB1  ALA 196          1HB       ALA 196  10.985  -5.854  28.187
  715    HB2  ALA 196          2HB       ALA 196  10.706  -7.475  28.872
  716    HB3  ALA 196          3HB       ALA 196  12.052  -7.199  27.746
  717    H    ARG 197           H        ARG 197   8.464  -9.142  27.338
  718    HA   ARG 197           HA       ARG 197   9.975 -11.523  26.864
  719    HB2  ARG 197          1HB       ARG 197   7.789 -12.672  27.029
  720    HB3  ARG 197          2HB       ARG 197   8.021 -11.484  28.314
  721    HG2  ARG 197          1HG       ARG 197   6.642  -9.849  26.987
  722    HG3  ARG 197          2HG       ARG 197   6.307 -11.125  25.808
  723    HD2  ARG 197          1HD       ARG 197   5.126 -12.423  27.469
  724    HD3  ARG 197          2HD       ARG 197   5.629 -11.317  28.769
  725    HE   ARG 197           HE       ARG 197   4.357  -9.642  26.993
  726   HH11  ARG 197          1HH1      ARG 197   3.244 -12.508  28.683
  727   HH12  ARG 197          2HH1      ARG 197   1.585 -11.972  28.665
  728   HH21  ARG 197          1HH2      ARG 197   2.275  -9.032  26.996
  729   HH22  ARG 197          2HH2      ARG 197   1.049 -10.033  27.729
  730    H    GLY 198           H        GLY 198   9.847 -13.097  25.258
  731    HA2  GLY 198          1HA       GLY 198   9.688 -12.163  22.502
  732    HA3  GLY 198          2HA       GLY 198  10.031 -13.802  23.044
  733    H    ARG 199           H        ARG 199   8.433 -13.236  20.834
  734    HA   ARG 199           HA       ARG 199   5.594 -13.540  21.448
  735    HB2  ARG 199          1HB       ARG 199   6.303 -12.433  19.411
  736    HB3  ARG 199          2HB       ARG 199   7.191 -13.864  18.873
  737    HG2  ARG 199          1HG       ARG 199   5.145 -15.117  18.550
  738    HG3  ARG 199          2HG       ARG 199   4.182 -13.850  19.336
  739    HD2  ARG 199          1HD       ARG 199   4.723 -12.277  17.503
  740    HD3  ARG 199          2HD       ARG 199   5.773 -13.483  16.761
  741    HE   ARG 199           HE       ARG 199   3.943 -14.517  15.819
  742   HH11  ARG 199          1HH1      ARG 199   2.624 -12.443  18.334
  743   HH12  ARG 199          2HH1      ARG 199   0.986 -12.824  17.879
  744   HH21  ARG 199          1HH2      ARG 199   1.927 -14.879  15.273
  745   HH22  ARG 199          2HH2      ARG 199   0.585 -14.204  16.182
  746    H    SER 200           H        SER 200   4.359 -15.313  21.501
  747    HA   SER 200           HA       SER 200   5.485 -18.046  21.128
  748    HB2  SER 200          1HB       SER 200   4.097 -17.024  23.635
  749    HB3  SER 200          2HB       SER 200   4.348 -18.737  23.252
  750    HG   SER 200           HG       SER 200   6.054 -17.883  24.566
  751    H5'    G 201           H5'        G 201   2.777 -13.258  13.696
  752   H5''    G 201           H5"        G 201   2.738 -14.230  12.218
  753    H4'    G 201           H4'        G 201   5.264 -13.403  13.713
  754    H3'    G 201           H3'        G 201   3.740 -11.652  12.219
  755    H2'    G 201           H2'        G 201   3.654 -13.088  10.292
  756   HO2'    G 201           HO2        G 201   5.742 -11.183  10.132
  757    H1'    G 201           H1'        G 201   6.634 -13.480  10.700
  758    H8     G 201          8H          G 201   7.474 -14.753   8.676
  759    H1     G 201          1H          G 201   1.992 -18.092   8.038
  760    H21    G 201          1H2         G 201   0.529 -17.382   9.607
  761    H22    G 201          2H2         G 201   1.003 -16.101  10.708
  762   HO5'    G 201           HO5        G 201   3.808 -15.918  13.401
  763    H5'    U 202           H5'        U 202   5.869  -8.805  10.991
  764   H5''    U 202           H5"        U 202   7.011  -8.250  12.222
  765    H4'    U 202           H4'        U 202   6.034  -6.315  11.239
  766    H3'    U 202           H3'        U 202   6.012  -6.746  13.967
  767    H2'    U 202           H2'        U 202   3.770  -7.436  14.097
  768   HO2'    U 202           HO2        U 202   4.080  -4.899  14.903
  769    H1'    U 202           H1'        U 202   3.001  -5.311  12.094
  770    H3     U 202          3H          U 202  -1.336  -6.571  12.591
  771    H5     U 202          5H          U 202   0.687 -10.243  12.543
  772    H6     U 202          6H          U 202   2.807  -9.026  12.391
  773    H5'    A 203           H5'        A 203   7.391  -3.140  11.844
  774   H5''    A 203           H5"        A 203   8.664  -2.876  13.044
  775    H4'    A 203           H4'        A 203   8.612  -1.065  11.456
  776    H3'    A 203           H3'        A 203   8.614  -0.625  14.208
  777    H2'    A 203           H2'        A 203   6.240  -0.219  14.263
  778   HO2'    A 203           HO2        A 203   7.629   2.248  13.945
  779    H1'    A 203           H1'        A 203   6.794   1.422  11.759
  780    H8     A 203          8H          A 203   3.935  -0.485  13.618
  781    H61    A 203          1H6         A 203   0.386   3.572  10.374
  782    H62    A 203          2H6         A 203   0.314   2.361  11.656
  783    H2     A 203          2H          A 203   4.465   4.050   9.077
  784    H5'    G 204           H5'        G 204   9.940   2.001  10.234
  785   H5''    G 204           H5"        G 204   8.924   0.581   9.924
  786    H4'    G 204           H4'        G 204  10.968  -0.380   8.673
  787    H3'    G 204           H3'        G 204  12.254   1.841   9.711
  788    H2'    G 204           H2'        G 204  11.003   3.372   8.412
  789   HO2'    G 204           HO2        G 204  13.437   2.793   7.172
  790    H1'    G 204           H1'        G 204  11.277   1.477   6.077
  791    H8     G 204          8H          G 204  10.193   2.704   4.066
  792    H1     G 204          1H          G 204   6.039   5.864   7.853
  793    H21    G 204          1H2         G 204   6.395   5.302   9.934
  794    H22    G 204          2H2         G 204   7.585   4.066  10.332
  795    H5'    U 205           H5'        U 205  17.080   1.331   7.319
  796   H5''    U 205           H5"        U 205  16.711   2.883   8.078
  797    H4'    U 205           H4'        U 205  17.873   3.239   5.993
  798    H3'    U 205           H3'        U 205  15.460   4.536   6.559
  799   HO3'    U 205           HO3        U 205  17.292   5.652   5.800
  800    H2'    U 205           H2'        U 205  14.129   3.184   5.155
  801   HO2'    U 205           HO2        U 205  15.140   5.376   3.710
  802    H1'    U 205           H1'        U 205  16.346   3.114   3.108
  803    H3     U 205          3H          U 205  13.615   0.670   0.414
  804    H5     U 205          5H          U 205  12.893  -0.976   4.192
  805    H6     U 205          6H          U 205  14.447   0.643   5.159
  Start of MODEL   14
    1    H1   GLY 105          1H        GLY 105  -6.657  16.902   6.676
    2    H2   GLY 105          2H        GLY 105  -8.000  17.655   6.113
    3    H3   GLY 105          3H        GLY 105  -6.679  17.500   5.154
    4    HA2  GLY 105          1HA       GLY 105  -8.341  15.273   6.138
    5    HA3  GLY 105          2HA       GLY 105  -8.384  15.929   4.490
    6    H    SER 106           H        SER 106  -7.893  13.245   4.929
    7    HA   SER 106           HA       SER 106  -5.041  12.633   4.954
    8    HB2  SER 106          1HB       SER 106  -7.503  10.937   4.442
    9    HB3  SER 106          2HB       SER 106  -5.843  10.313   4.427
   10    HG   SER 106           HG       SER 106  -6.985  11.732   6.620
   11    H    HIS 107           H        HIS 107  -4.656  14.249   3.157
   12    HA   HIS 107           HA       HIS 107  -5.301  13.651   0.417
   13    HB2  HIS 107          1HB       HIS 107  -4.625  15.868   1.234
   14    HB3  HIS 107          2HB       HIS 107  -3.029  15.251   1.664
   15    HD2  HIS 107          2HD       HIS 107  -1.217  15.754  -0.088
   16    HE1  HIS 107          1HE       HIS 107  -3.649  16.312  -3.548
   17    HE2  HIS 107          2HE       HIS 107  -1.270  16.404  -2.643
   18    H    MET 108           H        MET 108  -2.676  12.526   2.492
   19    HA   MET 108           HA       MET 108  -1.008  11.415   0.433
   20    HB2  MET 108          1HB       MET 108   0.167  10.303   2.207
   21    HB3  MET 108          2HB       MET 108  -0.150  11.968   2.671
   22    HG2  MET 108          1HG       MET 108  -1.762   9.564   3.633
   23    HG3  MET 108          2HG       MET 108  -0.405  10.269   4.492
   24    HE1  MET 108          1HE       MET 108  -2.046  10.253   6.617
   25    HE2  MET 108          2HE       MET 108  -3.598  11.119   6.658
   26    HE3  MET 108          3HE       MET 108  -3.402   9.701   5.606
   27    H    LYS 109           H        LYS 109  -0.801   9.337  -0.310
   28    HA   LYS 109           HA       LYS 109  -3.246   7.648  -0.066
   29    HB2  LYS 109          1HB       LYS 109  -1.549   8.298  -2.480
   30    HB3  LYS 109          2HB       LYS 109  -2.820   7.065  -2.482
   31    HG2  LYS 109          1HG       LYS 109  -4.540   8.663  -1.953
   32    HG3  LYS 109          2HG       LYS 109  -3.357   9.942  -1.681
   33    HD2  LYS 109          1HD       LYS 109  -2.637   9.691  -4.113
   34    HD3  LYS 109          2HD       LYS 109  -3.997   8.572  -4.310
   35    HE2  LYS 109          1HE       LYS 109  -4.693  10.768  -5.069
   36    HE3  LYS 109          2HE       LYS 109  -5.563  10.342  -3.597
   37    HZ1  LYS 109          1HZ       LYS 109  -3.851  11.752  -2.380
   38    HZ2  LYS 109          2HZ       LYS 109  -4.888  12.553  -3.333
   39    HZ3  LYS 109          3HZ       LYS 109  -3.340  12.290  -3.845
   40    H    LYS 110           H        LYS 110  -0.647   7.351   1.402
   41    HA   LYS 110           HA       LYS 110   0.315   4.691   0.444
   42    HB2  LYS 110          1HB       LYS 110   1.903   6.591   0.513
   43    HB3  LYS 110          2HB       LYS 110   1.591   6.774   2.239
   44    HG2  LYS 110          1HG       LYS 110   2.516   4.422   2.561
   45    HG3  LYS 110          2HG       LYS 110   2.964   4.429   0.847
   46    HD2  LYS 110          1HD       LYS 110   4.416   6.381   1.189
   47    HD3  LYS 110          2HD       LYS 110   3.834   6.574   2.852
   48    HE2  LYS 110          1HE       LYS 110   4.787   4.337   3.416
   49    HE3  LYS 110          2HE       LYS 110   5.485   4.244   1.791
   50    HZ1  LYS 110          1HZ       LYS 110   6.756   6.279   2.351
   51    HZ2  LYS 110          2HZ       LYS 110   7.088   5.084   3.422
   52    HZ3  LYS 110          3HZ       LYS 110   6.105   6.296   3.859
   53    H    ILE 111           H        ILE 111   0.005   2.898   1.615
   54    HA   ILE 111           HA       ILE 111  -0.688   3.125   4.519
   55    HB   ILE 111           HB       ILE 111  -2.082   1.247   4.452
   56   HG12  ILE 111          1HG1      ILE 111  -1.279   0.733   1.596
   57   HG13  ILE 111          2HG1      ILE 111  -0.834  -0.239   2.990
   58   HG21  ILE 111          1HG2      ILE 111  -2.881   2.782   1.964
   59   HG22  ILE 111          2HG2      ILE 111  -3.925   1.950   3.143
   60   HG23  ILE 111          3HG2      ILE 111  -3.043   3.399   3.629
   61   HD11  ILE 111          1HD1      ILE 111  -3.168  -0.867   3.383
   62   HD12  ILE 111          2HD1      ILE 111  -3.662   0.029   1.928
   63   HD13  ILE 111          3HD1      ILE 111  -2.582  -1.366   1.787
   64    H    PHE 112           H        PHE 112   0.083   1.623   5.888
   65    HA   PHE 112           HA       PHE 112   2.524   0.075   5.204
   66    HB2  PHE 112          1HB       PHE 112   2.565   1.465   7.220
   67    HB3  PHE 112          2HB       PHE 112   1.089   0.726   7.806
   68    HD1  PHE 112          1HD       PHE 112   1.120  -1.517   8.903
   69    HD2  PHE 112          2HD       PHE 112   4.697   0.247   7.272
   70    HE1  PHE 112          1HE       PHE 112   2.501  -3.095  10.202
   71    HE2  PHE 112          2HE       PHE 112   6.068  -1.325   8.582
   72    HZ   PHE 112           HZ       PHE 112   4.986  -3.021  10.041
   73    H    VAL 113           H        VAL 113   2.505  -2.147   5.200
   74    HA   VAL 113           HA       VAL 113  -0.017  -3.600   5.864
   75    HB   VAL 113           HB       VAL 113   1.841  -4.338   3.591
   76   HG11  VAL 113          1HG1      VAL 113   0.041  -5.898   2.996
   77   HG12  VAL 113          2HG1      VAL 113   0.594  -6.225   4.638
   78   HG13  VAL 113          3HG1      VAL 113  -0.929  -5.347   4.382
   79   HG21  VAL 113          1HG2      VAL 113   0.683  -2.269   2.976
   80   HG22  VAL 113          2HG2      VAL 113   0.019  -3.636   2.088
   81   HG23  VAL 113          3HG2      VAL 113  -0.876  -2.968   3.472
   82    H    GLY 114           H        GLY 114   0.445  -4.433   7.786
   83    HA2  GLY 114          1HA       GLY 114   3.157  -5.489   8.397
   84    HA3  GLY 114          2HA       GLY 114   1.876  -5.130   9.546
   85    H    GLY 115           H        GLY 115   3.601  -7.556   9.052
   86    HA2  GLY 115          1HA       GLY 115   3.231  -9.704   9.805
   87    HA3  GLY 115          2HA       GLY 115   1.488  -9.501   9.646
   88    H    LEU 116           H        LEU 116   3.567  -8.852   6.890
   89    HA   LEU 116           HA       LEU 116   2.225 -10.812   5.208
   90    HB2  LEU 116          1HB       LEU 116   4.596  -8.936   4.885
   91    HB3  LEU 116          2HB       LEU 116   4.176 -10.082   3.621
   92    HG   LEU 116           HG       LEU 116   2.078  -8.164   4.696
   93   HD11  LEU 116          1HD1      LEU 116   3.955  -6.764   3.985
   94   HD12  LEU 116          2HD1      LEU 116   2.652  -6.667   2.796
   95   HD13  LEU 116          3HD1      LEU 116   4.083  -7.668   2.461
   96   HD21  LEU 116          1HD2      LEU 116   1.084  -8.524   2.498
   97   HD22  LEU 116          2HD2      LEU 116   1.415 -10.115   3.202
   98   HD23  LEU 116          3HD2      LEU 116   2.498  -9.459   1.967
   99    H    SER 117           H        SER 117   2.840 -12.838   4.638
  100    HA   SER 117           HA       SER 117   4.915 -14.250   6.081
  101    HB2  SER 117          1HB       SER 117   2.901 -15.397   5.209
  102    HB3  SER 117          2HB       SER 117   3.412 -15.028   3.551
  103    HG   SER 117           HG       SER 117   4.632 -16.736   5.462
  104    H    VAL 118           H        VAL 118   6.962 -14.878   5.425
  105    HA   VAL 118           HA       VAL 118   8.400 -13.380   3.472
  106    HB   VAL 118           HB       VAL 118  10.266 -14.725   3.872
  107   HG11  VAL 118          1HG1      VAL 118   8.740 -14.664   6.508
  108   HG12  VAL 118          2HG1      VAL 118  10.493 -14.671   6.266
  109   HG13  VAL 118          3HG1      VAL 118   9.543 -13.265   5.754
  110   HG21  VAL 118          1HG2      VAL 118  10.202 -16.839   5.178
  111   HG22  VAL 118          2HG2      VAL 118   8.428 -16.806   5.128
  112   HG23  VAL 118          3HG2      VAL 118   9.369 -16.987   3.630
  113    H    ASN 119           H        ASN 119   6.287 -16.021   2.956
  114    HA   ASN 119           HA       ASN 119   7.378 -16.928   0.403
  115    HB2  ASN 119          1HB       ASN 119   4.613 -17.192   1.679
  116    HB3  ASN 119          2HB       ASN 119   5.145 -18.029   0.224
  117   HD21  ASN 119          1HD2      ASN 119   5.157 -18.094   3.678
  118   HD22  ASN 119          2HD2      ASN 119   6.120 -19.565   3.818
  119    H    THR 120           H        THR 120   5.291 -14.282   1.415
  120    HA   THR 120           HA       THR 120   3.994 -13.871  -1.128
  121    HB   THR 120           HB       THR 120   4.146 -12.078   1.309
  122    HG1  THR 120          1HG       THR 120   2.281 -13.112   1.915
  123   HG21  THR 120          1HG2      THR 120   1.980 -11.201   0.555
  124   HG22  THR 120          2HG2      THR 120   2.095 -12.150  -0.934
  125   HG23  THR 120          3HG2      THR 120   3.259 -10.850  -0.611
  126    H    THR 121           H        THR 121   4.478 -12.656  -2.800
  127    HA   THR 121           HA       THR 121   6.935 -11.047  -2.765
  128    HB   THR 121           HB       THR 121   7.114 -11.142  -4.996
  129    HG1  THR 121          1HG       THR 121   5.327 -11.662  -6.360
  130   HG21  THR 121          1HG2      THR 121   5.484 -13.670  -4.551
  131   HG22  THR 121          2HG2      THR 121   7.186 -13.460  -4.064
  132   HG23  THR 121          3HG2      THR 121   6.738 -13.379  -5.778
  133    H    VAL 122           H        VAL 122   7.069  -9.000  -4.009
  134    HA   VAL 122           HA       VAL 122   5.205  -7.054  -2.987
  135    HB   VAL 122           HB       VAL 122   7.615  -6.640  -3.574
  136   HG11  VAL 122          1HG1      VAL 122   7.616  -7.607  -5.887
  137   HG12  VAL 122          2HG1      VAL 122   6.576  -6.263  -6.418
  138   HG13  VAL 122          3HG1      VAL 122   8.208  -5.942  -5.812
  139   HG21  VAL 122          1HG2      VAL 122   7.206  -4.330  -4.236
  140   HG22  VAL 122          2HG2      VAL 122   5.551  -4.726  -4.721
  141   HG23  VAL 122          3HG2      VAL 122   6.025  -4.851  -3.014
  142    H    GLU 123           H        GLU 123   5.309  -8.848  -6.018
  143    HA   GLU 123           HA       GLU 123   3.182  -7.323  -7.310
  144    HB2  GLU 123          1HB       GLU 123   4.302 -10.094  -7.907
  145    HB3  GLU 123          2HB       GLU 123   3.141  -9.202  -8.904
  146    HG2  GLU 123          1HG       GLU 123   4.820  -7.347  -9.126
  147    HG3  GLU 123          2HG       GLU 123   5.998  -8.349  -8.273
  148    H    ASP 124           H        ASP 124   3.327 -10.303  -5.304
  149    HA   ASP 124           HA       ASP 124   0.553 -10.962  -5.410
  150    HB2  ASP 124          1HB       ASP 124   2.473 -11.209  -3.074
  151    HB3  ASP 124          2HB       ASP 124   0.852 -11.870  -3.114
  152    H    VAL 125           H        VAL 125   2.258  -8.766  -3.110
  153    HA   VAL 125           HA       VAL 125  -0.110  -7.948  -1.728
  154    HB   VAL 125           HB       VAL 125   2.549  -6.504  -2.088
  155   HG11  VAL 125          1HG1      VAL 125   0.303  -5.970  -0.095
  156   HG12  VAL 125          2HG1      VAL 125   1.924  -5.241  -0.042
  157   HG13  VAL 125          3HG1      VAL 125   0.844  -4.871  -1.386
  158   HG21  VAL 125          1HG2      VAL 125   1.381  -8.318   0.069
  159   HG22  VAL 125          2HG2      VAL 125   2.802  -8.635  -0.941
  160   HG23  VAL 125          3HG2      VAL 125   2.858  -7.366   0.283
  161    H    LYS 126           H        LYS 126   1.514  -6.474  -4.595
  162    HA   LYS 126           HA       LYS 126  -0.304  -4.300  -4.870
  163    HB2  LYS 126          1HB       LYS 126   1.834  -4.465  -6.085
  164    HB3  LYS 126          2HB       LYS 126   1.187  -5.790  -7.077
  165    HG2  LYS 126          1HG       LYS 126  -0.529  -4.266  -8.019
  166    HG3  LYS 126          2HG       LYS 126   0.007  -3.001  -6.906
  167    HD2  LYS 126          1HD       LYS 126   2.345  -3.308  -8.047
  168    HD3  LYS 126          2HD       LYS 126   1.437  -4.084  -9.345
  169    HE2  LYS 126          1HE       LYS 126   0.965  -1.268  -8.238
  170    HE3  LYS 126          2HE       LYS 126   1.916  -1.634  -9.672
  171    HZ1  LYS 126          1HZ       LYS 126  -1.023  -2.134  -9.422
  172    HZ2  LYS 126          2HZ       LYS 126  -0.099  -2.473 -10.742
  173    HZ3  LYS 126          3HZ       LYS 126  -0.323  -0.934 -10.216
  174    H    HIS 127           H        HIS 127  -0.530  -7.557  -6.420
  175    HA   HIS 127           HA       HIS 127  -3.082  -7.083  -7.622
  176    HB2  HIS 127          1HB       HIS 127  -1.599  -9.617  -6.901
  177    HB3  HIS 127          2HB       HIS 127  -3.190  -9.632  -7.661
  178    HD2  HIS 127          2HD       HIS 127   0.233  -9.902  -8.704
  179    HE1  HIS 127          1HE       HIS 127  -1.681  -8.102 -12.061
  180    HE2  HIS 127          2HE       HIS 127   0.418  -9.310 -11.268
  181    H    TYR 128           H        TYR 128  -2.344  -8.487  -4.387
  182    HA   TYR 128           HA       TYR 128  -5.086  -8.884  -3.723
  183    HB2  TYR 128          1HB       TYR 128  -2.549  -8.948  -2.183
  184    HB3  TYR 128          2HB       TYR 128  -4.047  -8.777  -1.320
  185    HD1  TYR 128          1HD       TYR 128  -5.815 -10.494  -1.388
  186    HD2  TYR 128          2HD       TYR 128  -1.971 -11.140  -3.230
  187    HE1  TYR 128          1HE       TYR 128  -6.191 -12.946  -1.315
  188    HE2  TYR 128          2HE       TYR 128  -2.336 -13.594  -3.135
  189    HH   TYR 128           HH       TYR 128  -5.348 -15.028  -1.841
  190    H    PHE 129           H        PHE 129  -3.366  -5.882  -3.754
  191    HA   PHE 129           HA       PHE 129  -5.684  -4.656  -2.383
  192    HB2  PHE 129          1HB       PHE 129  -2.947  -3.564  -2.859
  193    HB3  PHE 129          2HB       PHE 129  -4.316  -2.549  -2.429
  194    HD1  PHE 129          1HD       PHE 129  -1.710  -4.567  -1.098
  195    HD2  PHE 129          2HD       PHE 129  -5.759  -3.318  -0.323
  196    HE1  PHE 129          1HE       PHE 129  -1.465  -5.236   1.276
  197    HE2  PHE 129          2HE       PHE 129  -5.502  -4.000   2.056
  198    HZ   PHE 129           HZ       PHE 129  -3.357  -4.944   2.860
  199    H    GLU 130           H        GLU 130  -4.369  -4.820  -5.584
  200    HA   GLU 130           HA       GLU 130  -5.765  -2.770  -6.868
  201    HB2  GLU 130          1HB       GLU 130  -4.972  -5.544  -7.771
  202    HB3  GLU 130          2HB       GLU 130  -5.735  -4.405  -8.861
  203    HG2  GLU 130          1HG       GLU 130  -3.429  -3.265  -7.349
  204    HG3  GLU 130          2HG       GLU 130  -3.006  -4.632  -8.358
  205    H    GLN 131           H        GLN 131  -7.190  -5.701  -5.567
  206    HA   GLN 131           HA       GLN 131  -9.603  -5.741  -7.079
  207    HB2  GLN 131          1HB       GLN 131 -10.497  -7.119  -5.299
  208    HB3  GLN 131          2HB       GLN 131  -8.857  -7.622  -5.716
  209    HG2  GLN 131          1HG       GLN 131  -7.997  -6.445  -3.697
  210    HG3  GLN 131          2HG       GLN 131  -9.642  -5.976  -3.269
  211   HE21  GLN 131          1HE2      GLN 131  -7.516  -7.862  -2.000
  212   HE22  GLN 131          2HE2      GLN 131  -8.503  -9.279  -1.619
  213    H    PHE 132           H        PHE 132  -8.702  -3.678  -4.334
  214    HA   PHE 132           HA       PHE 132 -11.471  -2.726  -3.923
  215    HB2  PHE 132          1HB       PHE 132  -8.835  -1.746  -2.742
  216    HB3  PHE 132          2HB       PHE 132 -10.454  -1.343  -2.190
  217    HD1  PHE 132          1HD       PHE 132 -11.988  -3.408  -1.498
  218    HD2  PHE 132          2HD       PHE 132  -7.695  -3.565  -1.789
  219    HE1  PHE 132          1HE       PHE 132 -11.956  -5.408  -0.026
  220    HE2  PHE 132          2HE       PHE 132  -7.661  -5.547  -0.300
  221    HZ   PHE 132           HZ       PHE 132  -9.793  -6.482   0.575
  222    H    GLY 133           H        GLY 133  -8.480  -1.635  -5.404
  223    HA2  GLY 133          1HA       GLY 133  -9.474  -0.011  -7.429
  224    HA3  GLY 133          2HA       GLY 133  -9.137   1.070  -6.069
  225    H    LYS 134           H        LYS 134  -7.581   1.373  -8.381
  226    HA   LYS 134           HA       LYS 134  -5.431  -0.529  -8.475
  227    HB2  LYS 134          1HB       LYS 134  -6.086   1.967 -10.030
  228    HB3  LYS 134          2HB       LYS 134  -4.436   1.330 -10.091
  229    HG2  LYS 134          1HG       LYS 134  -5.327  -0.919 -10.598
  230    HG3  LYS 134          2HG       LYS 134  -6.954  -0.268 -10.681
  231    HD2  LYS 134          1HD       LYS 134  -6.362   1.079 -12.627
  232    HD3  LYS 134          2HD       LYS 134  -4.646   0.672 -12.457
  233    HE2  LYS 134          1HE       LYS 134  -6.864  -1.354 -13.001
  234    HE3  LYS 134          2HE       LYS 134  -5.850  -0.628 -14.251
  235    HZ1  LYS 134          1HZ       LYS 134  -4.997  -2.797 -13.560
  236    HZ2  LYS 134          2HZ       LYS 134  -4.810  -2.316 -12.010
  237    HZ3  LYS 134          3HZ       LYS 134  -3.908  -1.638 -13.194
  238    H    VAL 135           H        VAL 135  -3.310  -0.240  -8.477
  239    HA   VAL 135           HA       VAL 135  -2.311   1.366  -6.143
  240    HB   VAL 135           HB       VAL 135  -1.483  -1.351  -7.194
  241   HG11  VAL 135          1HG1      VAL 135  -0.333   0.261  -4.887
  242   HG12  VAL 135          2HG1      VAL 135   0.029  -1.441  -5.226
  243   HG13  VAL 135          3HG1      VAL 135   0.514  -0.197  -6.376
  244   HG21  VAL 135          1HG2      VAL 135  -3.595  -1.371  -5.886
  245   HG22  VAL 135          2HG2      VAL 135  -2.283  -2.187  -5.031
  246   HG23  VAL 135          3HG2      VAL 135  -2.771  -0.541  -4.553
  247    H    ASP 136           H        ASP 136  -0.923   2.886  -6.600
  248    HA   ASP 136           HA       ASP 136   0.205   3.322  -9.268
  249    HB2  ASP 136          1HB       ASP 136  -0.610   5.145  -7.777
  250    HB3  ASP 136          2HB       ASP 136   0.610   4.714  -6.583
  251    H    ASP 137           H        ASP 137   1.348   2.272  -6.080
  252    HA   ASP 137           HA       ASP 137   3.679   0.923  -7.136
  253    HB2  ASP 137          1HB       ASP 137   3.941   3.536  -5.681
  254    HB3  ASP 137          2HB       ASP 137   5.077   2.276  -5.269
  255    H    ALA 138           H        ALA 138   4.522  -0.687  -5.872
  256    HA   ALA 138           HA       ALA 138   3.764  -0.773  -3.010
  257    HB1  ALA 138          1HB       ALA 138   3.644  -3.141  -4.923
  258    HB2  ALA 138          2HB       ALA 138   3.408  -3.209  -3.164
  259    HB3  ALA 138          3HB       ALA 138   2.252  -2.323  -4.177
  260    H    MET 139           H        MET 139   5.352  -1.639  -1.634
  261    HA   MET 139           HA       MET 139   7.823  -2.778  -2.767
  262    HB2  MET 139          1HB       MET 139   9.342  -1.268  -1.710
  263    HB3  MET 139          2HB       MET 139   8.308  -0.380  -2.821
  264    HG2  MET 139          1HG       MET 139   6.960   0.429  -0.874
  265    HG3  MET 139          2HG       MET 139   8.063  -0.424   0.217
  266    HE1  MET 139          1HE       MET 139   8.594   1.675   1.640
  267    HE2  MET 139          2HE       MET 139   9.081   3.244   0.962
  268    HE3  MET 139          3HE       MET 139   7.446   2.620   0.660
  269    H    LEU 140           H        LEU 140   8.817  -4.223  -1.422
  270    HA   LEU 140           HA       LEU 140   7.708  -4.563   1.339
  271    HB2  LEU 140          1HB       LEU 140   9.271  -6.573  -0.312
  272    HB3  LEU 140          2HB       LEU 140   8.612  -6.810   1.307
  273    HG   LEU 140           HG       LEU 140   7.037  -6.472  -1.277
  274   HD11  LEU 140          1HD1      LEU 140   7.274  -8.754   0.722
  275   HD12  LEU 140          2HD1      LEU 140   8.027  -8.702  -0.889
  276   HD13  LEU 140          3HD1      LEU 140   6.260  -8.752  -0.728
  277   HD21  LEU 140          1HD2      LEU 140   5.033  -6.941   0.146
  278   HD22  LEU 140          2HD2      LEU 140   5.736  -5.352   0.422
  279   HD23  LEU 140          3HD2      LEU 140   6.039  -6.664   1.590
  280    H    MET 141           H        MET 141   9.033  -4.503   3.091
  281    HA   MET 141           HA       MET 141  11.663  -3.202   2.635
  282    HB2  MET 141          1HB       MET 141  10.233  -3.682   5.269
  283    HB3  MET 141          2HB       MET 141  11.586  -2.597   4.953
  284    HG2  MET 141          1HG       MET 141   8.689  -2.313   4.157
  285    HG3  MET 141          2HG       MET 141   9.680  -1.217   5.098
  286    HE1  MET 141          1HE       MET 141  11.750  -0.036   4.134
  287    HE2  MET 141          2HE       MET 141  12.348  -1.057   2.819
  288    HE3  MET 141          3HE       MET 141  11.841   0.613   2.476
  289    H    PHE 142           H        PHE 142  13.616  -4.109   3.196
  290    HA   PHE 142           HA       PHE 142  13.554  -6.981   3.819
  291    HB2  PHE 142          1HB       PHE 142  15.350  -5.434   2.044
  292    HB3  PHE 142          2HB       PHE 142  15.910  -6.921   2.780
  293    HD1  PHE 142          1HD       PHE 142  12.935  -5.622   0.848
  294    HD2  PHE 142          2HD       PHE 142  15.523  -8.960   1.710
  295    HE1  PHE 142          1HE       PHE 142  11.755  -6.975  -0.862
  296    HE2  PHE 142          2HE       PHE 142  14.348 -10.310  -0.011
  297    HZ   PHE 142           HZ       PHE 142  12.459  -9.324  -1.295
  298    H    ASP 143           H        ASP 143  14.925  -8.162   5.059
  299    HA   ASP 143           HA       ASP 143  15.932  -6.806   7.456
  300    HB2  ASP 143          1HB       ASP 143  14.980  -9.127   7.456
  301    HB3  ASP 143          2HB       ASP 143  16.321  -9.658   6.436
  302    H    LYS 144           H        LYS 144  17.940  -5.960   7.608
  303    HA   LYS 144           HA       LYS 144  19.437  -5.617   5.186
  304    HB2  LYS 144          1HB       LYS 144  19.677  -4.506   7.987
  305    HB3  LYS 144          2HB       LYS 144  20.942  -4.175   6.796
  306    HG2  LYS 144          1HG       LYS 144  19.437  -3.138   5.271
  307    HG3  LYS 144          2HG       LYS 144  18.007  -3.674   6.163
  308    HD2  LYS 144          1HD       LYS 144  18.437  -2.190   7.983
  309    HD3  LYS 144          2HD       LYS 144  20.058  -1.776   7.372
  310    HE2  LYS 144          1HE       LYS 144  19.176  -0.621   5.476
  311    HE3  LYS 144          2HE       LYS 144  17.562  -1.289   5.716
  312    HZ1  LYS 144          1HZ       LYS 144  17.808   1.048   6.477
  313    HZ2  LYS 144          2HZ       LYS 144  18.812   0.556   7.671
  314    HZ3  LYS 144          3HZ       LYS 144  17.241   0.051   7.628
  315    H    THR 145           H        THR 145  19.623  -8.242   6.905
  316    HA   THR 145           HA       THR 145  22.451  -9.013   6.647
  317    HB   THR 145           HB       THR 145  21.268 -11.306   6.542
  318    HG1  THR 145          1HG       THR 145  19.048 -11.121   7.377
  319   HG21  THR 145          1HG2      THR 145  20.654 -11.338   8.924
  320   HG22  THR 145          2HG2      THR 145  20.570  -9.561   8.947
  321   HG23  THR 145          3HG2      THR 145  22.126 -10.382   8.688
  322    H    THR 146           H        THR 146  19.668  -8.546   4.619
  323    HA   THR 146           HA       THR 146  19.078  -8.812   2.618
  324    HB   THR 146           HB       THR 146  21.534  -9.648   1.228
  325    HG1  THR 146          1HG       THR 146  22.394  -8.174   2.636
  326   HG21  THR 146          1HG2      THR 146  19.425  -7.480   0.851
  327   HG22  THR 146          2HG2      THR 146  19.419  -9.066   0.047
  328   HG23  THR 146          3HG2      THR 146  20.706  -7.899  -0.318
  329    H    ASN 147           H        ASN 147  18.902 -10.874   4.465
  330    HA   ASN 147           HA       ASN 147  19.002 -13.393   2.964
  331    HB2  ASN 147          1HB       ASN 147  17.947 -12.684   5.727
  332    HB3  ASN 147          2HB       ASN 147  17.883 -14.304   5.044
  333   HD21  ASN 147          1HD2      ASN 147  19.173 -14.037   7.391
  334   HD22  ASN 147          2HD2      ASN 147  20.901 -14.222   7.125
  335    H    ARG 148           H        ARG 148  16.259 -11.565   4.366
  336    HA   ARG 148           HA       ARG 148  14.413 -12.390   2.205
  337    HB2  ARG 148          1HB       ARG 148  13.897 -13.083   5.138
  338    HB3  ARG 148          2HB       ARG 148  12.739 -13.256   3.818
  339    HG2  ARG 148          1HG       ARG 148  14.403 -14.846   2.709
  340    HG3  ARG 148          2HG       ARG 148  15.285 -14.859   4.245
  341    HD2  ARG 148          1HD       ARG 148  12.385 -15.690   3.815
  342    HD3  ARG 148          2HD       ARG 148  13.769 -16.769   3.992
  343    HE   ARG 148           HE       ARG 148  13.212 -14.869   6.215
  344   HH11  ARG 148          1HH1      ARG 148  13.037 -18.213   5.152
  345   HH12  ARG 148          2HH1      ARG 148  12.764 -18.794   6.771
  346   HH21  ARG 148          1HH2      ARG 148  12.826 -15.665   8.202
  347   HH22  ARG 148          2HH2      ARG 148  12.661 -17.388   8.459
  348    H    HIS 149           H        HIS 149  12.192 -11.375   2.563
  349    HA   HIS 149           HA       HIS 149  12.498  -8.602   3.363
  350    HB2  HIS 149          1HB       HIS 149  10.392  -8.159   2.611
  351    HB3  HIS 149          2HB       HIS 149  11.014  -9.353   1.495
  352    HD2  HIS 149          2HD       HIS 149   9.243 -11.079   0.844
  353    HE1  HIS 149          1HE       HIS 149   6.566 -10.648   4.123
  354    HE2  HIS 149          2HE       HIS 149   6.916 -11.754   1.862
  355    H    ARG 150           H        ARG 150  11.475  -7.530   5.069
  356    HA   ARG 150           HA       ARG 150  11.830  -8.898   7.572
  357    HB2  ARG 150          1HB       ARG 150  12.607  -6.545   6.673
  358    HB3  ARG 150          2HB       ARG 150  10.994  -6.006   7.144
  359    HG2  ARG 150          1HG       ARG 150  11.473  -6.823   9.456
  360    HG3  ARG 150          2HG       ARG 150  13.072  -7.351   8.922
  361    HD2  ARG 150          1HD       ARG 150  13.930  -5.203   8.899
  362    HD3  ARG 150          2HD       ARG 150  12.392  -4.484   8.397
  363    HE   ARG 150           HE       ARG 150  12.281  -5.571  11.094
  364   HH11  ARG 150          1HH1      ARG 150  13.161  -2.558   9.375
  365   HH12  ARG 150          2HH1      ARG 150  12.517  -1.645  10.722
  366   HH21  ARG 150          1HH2      ARG 150  11.221  -4.137  12.456
  367   HH22  ARG 150          2HH2      ARG 150  11.709  -2.454  12.386
  368    H    GLY 151           H        GLY 151   9.204  -9.237   5.831
  369    HA2  GLY 151          1HA       GLY 151   7.142 -10.037   6.447
  370    HA3  GLY 151          2HA       GLY 151   7.456  -9.602   8.126
  371    H    PHE 152           H        PHE 152   7.816  -6.974   5.874
  372    HA   PHE 152           HA       PHE 152   5.010  -6.225   5.898
  373    HB2  PHE 152          1HB       PHE 152   5.243  -4.101   7.046
  374    HB3  PHE 152          2HB       PHE 152   5.644  -5.420   8.117
  375    HD1  PHE 152          1HD       PHE 152   8.059  -5.868   8.723
  376    HD2  PHE 152          2HD       PHE 152   6.851  -2.387   6.493
  377    HE1  PHE 152          1HE       PHE 152  10.142  -4.737   9.369
  378    HE2  PHE 152          2HE       PHE 152   8.945  -1.241   7.158
  379    HZ   PHE 152           HZ       PHE 152  10.624  -2.428   8.567
  380    H    GLY 153           H        GLY 153   4.623  -4.144   4.797
  381    HA2  GLY 153          1HA       GLY 153   6.734  -2.996   3.130
  382    HA3  GLY 153          2HA       GLY 153   5.555  -3.956   2.234
  383    H    PHE 154           H        PHE 154   5.667  -1.592   1.399
  384    HA   PHE 154           HA       PHE 154   3.324  -0.138   2.490
  385    HB2  PHE 154          1HB       PHE 154   5.807   0.989   1.209
  386    HB3  PHE 154          2HB       PHE 154   4.333   1.914   1.462
  387    HD1  PHE 154          1HD       PHE 154   7.214   0.342   3.111
  388    HD2  PHE 154          2HD       PHE 154   3.508   2.444   3.742
  389    HE1  PHE 154          1HE       PHE 154   7.875   0.791   5.443
  390    HE2  PHE 154          2HE       PHE 154   4.190   2.952   6.063
  391    HZ   PHE 154           HZ       PHE 154   6.376   2.139   6.929
  392    H    VAL 155           H        VAL 155   1.807   0.775   1.175
  393    HA   VAL 155           HA       VAL 155   1.916   0.156  -1.732
  394    HB   VAL 155           HB       VAL 155  -0.559  -0.439  -0.102
  395   HG11  VAL 155          1HG1      VAL 155   0.223  -1.139  -2.947
  396   HG12  VAL 155          2HG1      VAL 155  -1.287  -1.606  -2.136
  397   HG13  VAL 155          3HG1      VAL 155  -0.974   0.096  -2.478
  398   HG21  VAL 155          1HG2      VAL 155  -0.097  -2.818  -0.467
  399   HG22  VAL 155          2HG2      VAL 155   1.488  -2.414  -1.169
  400   HG23  VAL 155          3HG2      VAL 155   1.144  -2.084   0.542
  401    H    THR 156           H        THR 156   1.399   1.764  -2.973
  402    HA   THR 156           HA       THR 156   0.007   4.124  -1.881
  403    HB   THR 156           HB       THR 156   1.731   4.295  -4.319
  404    HG1  THR 156          1HG       THR 156   3.060   3.496  -2.753
  405   HG21  THR 156          1HG2      THR 156   0.258   6.226  -3.809
  406   HG22  THR 156          2HG2      THR 156   1.959   6.636  -3.547
  407   HG23  THR 156          3HG2      THR 156   0.911   6.292  -2.154
  408    H    PHE 157           H        PHE 157  -1.821   4.948  -2.715
  409    HA   PHE 157           HA       PHE 157  -3.136   3.245  -4.687
  410    HB2  PHE 157          1HB       PHE 157  -4.085   4.850  -2.360
  411    HB3  PHE 157          2HB       PHE 157  -5.212   4.263  -3.567
  412    HD1  PHE 157          1HD       PHE 157  -2.656   3.142  -1.080
  413    HD2  PHE 157          2HD       PHE 157  -5.849   1.960  -3.722
  414    HE1  PHE 157          1HE       PHE 157  -2.687   0.902  -0.050
  415    HE2  PHE 157          2HE       PHE 157  -5.954  -0.247  -2.595
  416    HZ   PHE 157           HZ       PHE 157  -4.351  -0.795  -0.770
  417    H    GLU 158           H        GLU 158  -4.764   3.776  -6.019
  418    HA   GLU 158           HA       GLU 158  -4.480   5.844  -7.924
  419    HB2  GLU 158          1HB       GLU 158  -5.657   3.761  -8.317
  420    HB3  GLU 158          2HB       GLU 158  -6.823   4.121  -7.037
  421    HG2  GLU 158          1HG       GLU 158  -7.685   6.027  -8.413
  422    HG3  GLU 158          2HG       GLU 158  -6.551   5.576  -9.693
  423    H    SER 159           H        SER 159  -6.433   5.802  -4.941
  424    HA   SER 159           HA       SER 159  -6.906   8.699  -5.038
  425    HB2  SER 159          1HB       SER 159  -8.727   7.916  -6.449
  426    HB3  SER 159          2HB       SER 159  -9.151   6.667  -5.275
  427    HG   SER 159           HG       SER 159  -9.484   9.474  -5.067
  428    H    GLU 160           H        GLU 160  -7.783   9.537  -3.069
  429    HA   GLU 160           HA       GLU 160  -6.873   8.282  -0.634
  430    HB2  GLU 160          1HB       GLU 160  -8.984  10.474  -0.855
  431    HB3  GLU 160          2HB       GLU 160  -7.905  10.103   0.477
  432    HG2  GLU 160          1HG       GLU 160  -6.958  12.001  -0.343
  433    HG3  GLU 160          2HG       GLU 160  -5.975  10.764  -1.123
  434    H    ASP 161           H        ASP 161  -9.944   8.338  -2.411
  435    HA   ASP 161           HA       ASP 161 -11.619   7.290  -0.340
  436    HB2  ASP 161          1HB       ASP 161 -11.887   7.315  -3.352
  437    HB3  ASP 161          2HB       ASP 161 -13.086   6.577  -2.298
  438    H    ILE 162           H        ILE 162  -9.496   5.593  -2.596
  439    HA   ILE 162           HA       ILE 162 -10.517   2.956  -1.865
  440    HB   ILE 162           HB       ILE 162  -7.738   3.513  -2.934
  441   HG12  ILE 162          1HG1      ILE 162  -9.110   4.583  -4.537
  442   HG13  ILE 162          2HG1      ILE 162  -8.584   3.034  -5.174
  443   HG21  ILE 162          1HG2      ILE 162  -9.583   1.080  -2.964
  444   HG22  ILE 162          2HG2      ILE 162  -8.057   1.186  -3.865
  445   HG23  ILE 162          3HG2      ILE 162  -8.042   1.267  -2.110
  446   HD11  ILE 162          1HD1      ILE 162 -10.912   3.419  -5.793
  447   HD12  ILE 162          2HD1      ILE 162 -10.857   2.080  -4.632
  448   HD13  ILE 162          3HD1      ILE 162 -11.372   3.694  -4.105
  449    H    VAL 163           H        VAL 163  -7.805   5.052  -0.751
  450    HA   VAL 163           HA       VAL 163  -6.674   3.184   1.058
  451    HB   VAL 163           HB       VAL 163  -6.836   6.227   1.327
  452   HG11  VAL 163          1HG1      VAL 163  -4.804   5.977   2.768
  453   HG12  VAL 163          2HG1      VAL 163  -6.268   5.331   3.511
  454   HG13  VAL 163          3HG1      VAL 163  -5.089   4.223   2.787
  455   HG21  VAL 163          1HG2      VAL 163  -4.525   6.120   0.452
  456   HG22  VAL 163          2HG2      VAL 163  -4.711   4.381   0.179
  457   HG23  VAL 163          3HG2      VAL 163  -5.712   5.548  -0.721
  458    H    GLU 164           H        GLU 164  -9.341   5.552   1.606
  459    HA   GLU 164           HA       GLU 164  -9.888   4.759   4.316
  460    HB2  GLU 164          1HB       GLU 164 -11.712   5.914   2.167
  461    HB3  GLU 164          2HB       GLU 164 -12.184   5.725   3.850
  462    HG2  GLU 164          1HG       GLU 164  -9.873   7.452   2.861
  463    HG3  GLU 164          2HG       GLU 164 -11.485   8.031   3.255
  464    H    LYS 165           H        LYS 165 -11.327   3.532   1.250
  465    HA   LYS 165           HA       LYS 165 -13.154   1.669   2.386
  466    HB2  LYS 165          1HB       LYS 165 -13.093   2.435   0.024
  467    HB3  LYS 165          2HB       LYS 165 -11.602   1.538  -0.239
  468    HG2  LYS 165          1HG       LYS 165 -12.779  -0.598   0.214
  469    HG3  LYS 165          2HG       LYS 165 -14.282   0.306   0.501
  470    HD2  LYS 165          1HD       LYS 165 -14.182   1.171  -1.846
  471    HD3  LYS 165          2HD       LYS 165 -12.668   0.298  -2.095
  472    HE2  LYS 165          1HE       LYS 165 -14.417  -0.979  -3.110
  473    HE3  LYS 165          2HE       LYS 165 -13.844  -1.861  -1.693
  474    HZ1  LYS 165          1HZ       LYS 165 -15.799  -1.050  -0.478
  475    HZ2  LYS 165          2HZ       LYS 165 -16.277  -1.823  -1.830
  476    HZ3  LYS 165          3HZ       LYS 165 -16.308  -0.195  -1.778
  477    H    VAL 166           H        VAL 166  -9.805   1.203   1.392
  478    HA   VAL 166           HA       VAL 166  -9.537  -1.577   2.123
  479    HB   VAL 166           HB       VAL 166  -7.462   0.622   1.761
  480   HG11  VAL 166          1HG1      VAL 166  -5.864  -1.228   1.362
  481   HG12  VAL 166          2HG1      VAL 166  -6.470  -1.252   3.023
  482   HG13  VAL 166          3HG1      VAL 166  -7.122  -2.394   1.824
  483   HG21  VAL 166          1HG2      VAL 166  -8.211  -1.602  -0.169
  484   HG22  VAL 166          2HG2      VAL 166  -8.912   0.007  -0.286
  485   HG23  VAL 166          3HG2      VAL 166  -7.176  -0.188  -0.467
  486    H    CYS 167           H        CYS 167  -8.531   1.452   3.820
  487    HA   CYS 167           HA       CYS 167  -7.492   0.128   6.112
  488    HB2  CYS 167          1HB       CYS 167  -8.443   2.978   5.667
  489    HB3  CYS 167          2HB       CYS 167  -7.765   2.418   7.199
  490    HG   CYS 167           HG       CYS 167  -6.457   2.573   4.202
  491    H    GLU 168           H        GLU 168 -10.871   1.134   5.469
  492    HA   GLU 168           HA       GLU 168 -11.895   0.767   8.082
  493    HB2  GLU 168          1HB       GLU 168 -13.046   2.003   6.374
  494    HB3  GLU 168          2HB       GLU 168 -12.979   0.648   5.258
  495    HG2  GLU 168          1HG       GLU 168 -15.177   0.916   5.970
  496    HG3  GLU 168          2HG       GLU 168 -14.576  -0.614   6.586
  497    H    ILE 169           H        ILE 169 -11.058  -1.617   5.606
  498    HA   ILE 169           HA       ILE 169 -12.457  -3.858   6.839
  499    HB   ILE 169           HB       ILE 169 -10.217  -3.679   4.802
  500   HG12  ILE 169          1HG1      ILE 169 -13.114  -4.551   4.381
  501   HG13  ILE 169          2HG1      ILE 169 -12.653  -2.860   4.279
  502   HG21  ILE 169          1HG2      ILE 169 -10.682  -6.078   4.286
  503   HG22  ILE 169          2HG2      ILE 169  -9.980  -5.839   5.873
  504   HG23  ILE 169          3HG2      ILE 169 -11.723  -6.159   5.724
  505   HD11  ILE 169          1HD1      ILE 169 -11.550  -5.051   2.497
  506   HD12  ILE 169          2HD1      ILE 169 -12.725  -3.799   2.062
  507   HD13  ILE 169          3HD1      ILE 169 -11.064  -3.338   2.467
  508    H    HIS 170           H        HIS 170  -9.296  -2.398   7.180
  509    HA   HIS 170           HA       HIS 170  -7.646  -2.478   8.683
  510    HB2  HIS 170          1HB       HIS 170  -9.494  -2.163  10.253
  511    HB3  HIS 170          2HB       HIS 170  -9.592  -3.902  10.499
  512    HD2  HIS 170          2HD       HIS 170  -6.008  -2.561  10.354
  513    HE1  HIS 170          1HE       HIS 170  -6.947  -3.010  14.484
  514    HE2  HIS 170          2HE       HIS 170  -5.068  -2.618  12.810
  515    H    PHE 171           H        PHE 171  -9.114  -5.740   8.901
  516    HA   PHE 171           HA       PHE 171  -6.417  -6.868   8.468
  517    HB2  PHE 171          1HB       PHE 171  -8.592  -7.953  10.163
  518    HB3  PHE 171          2HB       PHE 171  -7.406  -9.017   9.426
  519    HD1  PHE 171          1HD       PHE 171  -7.840  -6.234  11.846
  520    HD2  PHE 171          2HD       PHE 171  -5.064  -9.011  10.059
  521    HE1  PHE 171          1HE       PHE 171  -6.168  -5.699  13.604
  522    HE2  PHE 171          2HE       PHE 171  -3.402  -8.472  11.824
  523    HZ   PHE 171           HZ       PHE 171  -3.943  -6.816  13.591
  524    H    HIS 172           H        HIS 172  -5.853  -7.700   6.703
  525    HA   HIS 172           HA       HIS 172  -7.916  -8.593   4.716
  526    HB2  HIS 172          1HB       HIS 172  -5.196  -7.287   4.341
  527    HB3  HIS 172          2HB       HIS 172  -6.147  -7.984   3.037
  528    HD2  HIS 172          2HD       HIS 172  -6.423  -5.095   5.650
  529    HE1  HIS 172          1HE       HIS 172  -8.893  -4.071   2.352
  530    HE2  HIS 172          2HE       HIS 172  -7.932  -3.245   4.538
  531    H    GLU 173           H        GLU 173  -7.414 -10.395   3.377
  532    HA   GLU 173           HA       GLU 173  -5.423 -12.307   4.531
  533    HB2  GLU 173          1HB       GLU 173  -7.790 -13.018   4.476
  534    HB3  GLU 173          2HB       GLU 173  -7.805 -12.822   2.717
  535    HG2  GLU 173          1HG       GLU 173  -6.035 -14.545   2.508
  536    HG3  GLU 173          2HG       GLU 173  -5.965 -14.699   4.265
  537    H    ILE 174           H        ILE 174  -3.573 -12.618   3.440
  538    HA   ILE 174           HA       ILE 174  -3.477 -12.344   0.466
  539    HB   ILE 174           HB       ILE 174  -1.439 -11.148   2.394
  540   HG12  ILE 174          1HG1      ILE 174  -3.537  -9.907   0.586
  541   HG13  ILE 174          2HG1      ILE 174  -3.334  -9.695   2.319
  542   HG21  ILE 174          1HG2      ILE 174  -1.464 -11.214  -0.654
  543   HG22  ILE 174          2HG2      ILE 174  -0.240 -10.440   0.364
  544   HG23  ILE 174          3HG2      ILE 174  -0.401 -12.190   0.368
  545   HD11  ILE 174          1HD1      ILE 174  -2.636  -7.682   1.254
  546   HD12  ILE 174          2HD1      ILE 174  -1.169  -8.479   1.854
  547   HD13  ILE 174          3HD1      ILE 174  -1.579  -8.538   0.124
  548    H    ASN 175           H        ASN 175  -2.686 -14.189  -0.398
  549    HA   ASN 175           HA       ASN 175  -1.996 -16.333  -0.473
  550    HB2  ASN 175          1HB       ASN 175   0.370 -15.127   0.989
  551    HB3  ASN 175          2HB       ASN 175   0.371 -16.754   0.326
  552   HD21  ASN 175          1HD2      ASN 175   2.068 -14.526  -0.358
  553   HD22  ASN 175          2HD2      ASN 175   1.930 -14.397  -2.118
  554    H    ASN 176           H        ASN 176  -3.868 -15.944   1.500
  555    HA   ASN 176           HA       ASN 176  -4.898 -16.725   3.295
  556    HB2  ASN 176          1HB       ASN 176  -3.069 -19.132   3.174
  557    HB3  ASN 176          2HB       ASN 176  -4.622 -19.021   3.996
  558   HD21  ASN 176          1HD2      ASN 176  -6.460 -18.049   2.321
  559   HD22  ASN 176          2HD2      ASN 176  -6.472 -18.995   0.832
  560    H    LYS 177           H        LYS 177  -1.970 -15.423   3.722
  561    HA   LYS 177           HA       LYS 177  -1.814 -15.742   6.668
  562    HB2  LYS 177          1HB       LYS 177   0.225 -15.499   5.138
  563    HB3  LYS 177          2HB       LYS 177  -0.310 -13.864   4.789
  564    HG2  LYS 177          1HG       LYS 177   1.418 -13.740   6.392
  565    HG3  LYS 177          2HG       LYS 177  -0.068 -13.283   7.220
  566    HD2  LYS 177          1HD       LYS 177  -0.118 -15.321   8.467
  567    HD3  LYS 177          2HD       LYS 177   0.930 -16.149   7.317
  568    HE2  LYS 177          1HE       LYS 177   2.168 -15.743   9.349
  569    HE3  LYS 177          2HE       LYS 177   2.868 -14.833   8.011
  570    HZ1  LYS 177          1HZ       LYS 177   2.719 -13.478  10.007
  571    HZ2  LYS 177          2HZ       LYS 177   1.101 -13.684  10.107
  572    HZ3  LYS 177          3HZ       LYS 177   1.760 -12.838   8.855
  573    H    MET 178           H        MET 178  -2.619 -14.183   8.098
  574    HA   MET 178           HA       MET 178  -4.384 -12.087   6.963
  575    HB2  MET 178          1HB       MET 178  -3.978 -13.001   9.831
  576    HB3  MET 178          2HB       MET 178  -5.037 -11.684   9.329
  577    HG2  MET 178          1HG       MET 178  -5.282 -14.617   8.599
  578    HG3  MET 178          2HG       MET 178  -6.342 -13.691   9.652
  579    HE1  MET 178          1HE       MET 178  -8.025 -11.784   8.785
  580    HE2  MET 178          2HE       MET 178  -6.748 -10.937   7.878
  581    HE3  MET 178          3HE       MET 178  -8.263 -11.381   7.071
  582    H    VAL 179           H        VAL 179  -3.873 -10.033   6.811
  583    HA   VAL 179           HA       VAL 179  -1.447  -9.000   8.186
  584    HB   VAL 179           HB       VAL 179  -0.750  -7.795   6.260
  585   HG11  VAL 179          1HG1      VAL 179  -0.053 -10.152   6.526
  586   HG12  VAL 179          2HG1      VAL 179  -1.337 -10.650   5.395
  587   HG13  VAL 179          3HG1      VAL 179  -0.031  -9.583   4.848
  588   HG21  VAL 179          1HG2      VAL 179  -1.762  -8.006   4.055
  589   HG22  VAL 179          2HG2      VAL 179  -3.100  -8.956   4.730
  590   HG23  VAL 179          3HG2      VAL 179  -2.884  -7.248   5.182
  591    H    GLU 180           H        GLU 180  -1.298  -6.796   8.523
  592    HA   GLU 180           HA       GLU 180  -3.972  -5.535   9.044
  593    HB2  GLU 180          1HB       GLU 180  -2.486  -6.119  10.981
  594    HB3  GLU 180          2HB       GLU 180  -1.305  -4.948  10.375
  595    HG2  GLU 180          1HG       GLU 180  -3.049  -3.159  10.526
  596    HG3  GLU 180          2HG       GLU 180  -4.199  -4.357  11.128
  597    H    CYS 181           H        CYS 181  -4.555  -3.843   7.808
  598    HA   CYS 181           HA       CYS 181  -2.501  -2.196   6.425
  599    HB2  CYS 181          1HB       CYS 181  -4.354  -1.073   5.313
  600    HB3  CYS 181          2HB       CYS 181  -4.354  -2.806   4.997
  601    HG   CYS 181           HG       CYS 181  -6.155  -3.416   6.811
  602    H    LYS 182           H        LYS 182  -2.052  -0.126   6.920
  603    HA   LYS 182           HA       LYS 182  -3.638   1.393   8.930
  604    HB2  LYS 182          1HB       LYS 182  -0.624   1.272   9.168
  605    HB3  LYS 182          2HB       LYS 182  -1.781   1.893  10.334
  606    HG2  LYS 182          1HG       LYS 182  -2.431  -0.431  10.922
  607    HG3  LYS 182          2HG       LYS 182  -1.330  -1.056   9.673
  608    HD2  LYS 182          1HD       LYS 182   0.561   0.152  10.832
  609    HD3  LYS 182          2HD       LYS 182  -0.551   0.481  12.180
  610    HE2  LYS 182          1HE       LYS 182  -0.882  -1.938  12.509
  611    HE3  LYS 182          2HE       LYS 182   0.085  -2.290  11.070
  612    HZ1  LYS 182          1HZ       LYS 182   1.503  -2.569  12.895
  613    HZ2  LYS 182          2HZ       LYS 182   1.054  -1.163  13.626
  614    HZ3  LYS 182          3HZ       LYS 182   1.956  -1.118  12.262
  615    H    LYS 183           H        LYS 183  -3.433   3.691   8.567
  616    HA   LYS 183           HA       LYS 183  -2.313   4.621   6.047
  617    HB2  LYS 183          1HB       LYS 183  -3.146   6.123   8.562
  618    HB3  LYS 183          2HB       LYS 183  -2.565   6.910   7.086
  619    HG2  LYS 183          1HG       LYS 183  -4.401   5.925   5.780
  620    HG3  LYS 183          2HG       LYS 183  -5.006   5.080   7.218
  621    HD2  LYS 183          1HD       LYS 183  -5.430   7.224   8.345
  622    HD3  LYS 183          2HD       LYS 183  -4.757   8.112   6.961
  623    HE2  LYS 183          1HE       LYS 183  -6.513   7.198   5.492
  624    HE3  LYS 183          2HE       LYS 183  -7.184   6.264   6.836
  625    HZ1  LYS 183          1HZ       LYS 183  -7.726   8.336   7.952
  626    HZ2  LYS 183          2HZ       LYS 183  -8.356   8.384   6.434
  627    HZ3  LYS 183          3HZ       LYS 183  -7.008   9.234   6.777
  628    H    ALA 184           H        ALA 184  -0.301   5.459   5.540
  629    HA   ALA 184           HA       ALA 184   1.828   4.504   7.178
  630    HB1  ALA 184          1HB       ALA 184   1.942   6.346   4.776
  631    HB2  ALA 184          2HB       ALA 184   3.317   5.476   5.506
  632    HB3  ALA 184          3HB       ALA 184   1.990   4.561   4.771
  633    H    GLN 185           H        GLN 185   3.071   5.379   8.642
  634    HA   GLN 185           HA       GLN 185   3.040   8.262   9.333
  635    HB2  GLN 185          1HB       GLN 185   2.291   5.858  11.039
  636    HB3  GLN 185          2HB       GLN 185   2.789   7.368  11.767
  637    HG2  GLN 185          1HG       GLN 185   0.373   7.031   9.954
  638    HG3  GLN 185          2HG       GLN 185   0.349   7.124  11.708
  639   HE21  GLN 185          1HE2      GLN 185   0.886   9.013   8.729
  640   HE22  GLN 185          2HE2      GLN 185   0.789  10.581   9.538
  641    HA   PRO 186           HA       PRO 186   7.306   7.805   9.848
  642    HB2  PRO 186          1HB       PRO 186   8.020   9.678  11.698
  643    HB3  PRO 186          2HB       PRO 186   7.281  10.107  10.126
  644    HG2  PRO 186          1HG       PRO 186   5.904   9.823  12.813
  645    HG3  PRO 186          2HG       PRO 186   5.769  11.169  11.637
  646    HD2  PRO 186          1HD       PRO 186   3.963   9.130  11.784
  647    HD3  PRO 186          2HD       PRO 186   4.349   9.904  10.232
  648    H    LYS 187           H        LYS 187   9.158   7.313  11.309
  649    HA   LYS 187           HA       LYS 187   8.775   5.016  12.847
  650    HB2  LYS 187          1HB       LYS 187  10.785   5.773  11.567
  651    HB3  LYS 187          2HB       LYS 187  11.118   6.977  12.822
  652    HG2  LYS 187          1HG       LYS 187  11.518   5.220  14.458
  653    HG3  LYS 187          2HG       LYS 187  10.959   3.990  13.293
  654    HD2  LYS 187          1HD       LYS 187  12.880   4.453  11.840
  655    HD3  LYS 187          2HD       LYS 187  13.385   5.792  12.878
  656    HE2  LYS 187          1HE       LYS 187  14.772   3.820  13.263
  657    HE3  LYS 187          2HE       LYS 187  13.875   4.257  14.721
  658    HZ1  LYS 187          1HZ       LYS 187  12.965   2.164  12.821
  659    HZ2  LYS 187          2HZ       LYS 187  12.347   2.466  14.296
  660    HZ3  LYS 187          3HZ       LYS 187  13.852   1.826  14.168
  661    H    GLU 188           H        GLU 188   8.165   8.117  13.909
  662    HA   GLU 188           HA       GLU 188   8.680   7.918  16.753
  663    HB2  GLU 188          1HB       GLU 188   6.573   9.513  15.236
  664    HB3  GLU 188          2HB       GLU 188   7.034   9.778  16.911
  665    HG2  GLU 188          1HG       GLU 188   8.829  10.168  14.474
  666    HG3  GLU 188          2HG       GLU 188   8.014  11.434  15.377
  667    H    VAL 189           H        VAL 189   6.112   6.600  14.707
  668    HA   VAL 189           HA       VAL 189   4.344   6.139  16.971
  669    HB   VAL 189           HB       VAL 189   2.647   5.525  15.594
  670   HG11  VAL 189          1HG1      VAL 189   4.168   7.576  13.939
  671   HG12  VAL 189          2HG1      VAL 189   2.410   7.359  14.079
  672   HG13  VAL 189          3HG1      VAL 189   3.338   7.930  15.470
  673   HG21  VAL 189          1HG2      VAL 189   4.527   5.196  13.225
  674   HG22  VAL 189          2HG2      VAL 189   3.726   3.875  14.094
  675   HG23  VAL 189          3HG2      VAL 189   2.764   5.057  13.208
  676    H    MET 190           H        MET 190   6.960   4.636  16.806
  677    HA   MET 190           HA       MET 190   6.176   1.822  16.861
  678    HB2  MET 190          1HB       MET 190   8.771   3.225  17.600
  679    HB3  MET 190          2HB       MET 190   8.525   1.469  17.639
  680    HG2  MET 190          1HG       MET 190   7.920   1.488  15.248
  681    HG3  MET 190          2HG       MET 190   8.227   3.218  15.185
  682    HE1  MET 190          1HE       MET 190  11.306  -0.194  15.274
  683    HE2  MET 190          2HE       MET 190  10.258   0.032  16.696
  684    HE3  MET 190          3HE       MET 190   9.545  -0.313  15.106
  685    H    SER 191           H        SER 191   4.416   2.981  18.516
  686    HA   SER 191           HA       SER 191   5.175   2.820  21.314
  687    HB2  SER 191          1HB       SER 191   2.735   2.990  21.719
  688    HB3  SER 191          2HB       SER 191   3.351   4.259  20.653
  689    HG   SER 191           HG       SER 191   1.394   3.329  19.882
  690    HA   PRO 192           HA       PRO 192   4.888  -1.554  21.827
  691    HB2  PRO 192          1HB       PRO 192   4.018  -1.894  24.406
  692    HB3  PRO 192          2HB       PRO 192   5.638  -1.264  23.977
  693    HG2  PRO 192          1HG       PRO 192   3.154   0.328  24.699
  694    HG3  PRO 192          2HG       PRO 192   4.815   0.511  25.351
  695    HD2  PRO 192          1HD       PRO 192   3.895   2.097  23.354
  696    HD3  PRO 192          2HD       PRO 192   5.586   1.518  23.355
  697    H    THR 193           H        THR 193   3.554  -3.162  21.306
  698    HA   THR 193           HA       THR 193   0.656  -2.991  21.840
  699    HB   THR 193           HB       THR 193  -0.104  -3.428  19.757
  700    HG1  THR 193          1HG       THR 193   1.173  -5.106  19.158
  701   HG21  THR 193          1HG2      THR 193   0.870  -1.127  19.796
  702   HG22  THR 193          2HG2      THR 193   0.830  -1.854  18.183
  703   HG23  THR 193          3HG2      THR 193   2.363  -1.777  19.071
  704    H    GLY 194           H        GLY 194   2.892  -4.603  23.026
  705    HA2  GLY 194          1HA       GLY 194   2.907  -6.694  24.102
  706    HA3  GLY 194          2HA       GLY 194   1.548  -7.240  23.126
  707    H    SER 195           H        SER 195   3.450  -9.031  23.449
  708    HA   SER 195           HA       SER 195   5.740  -8.891  21.739
  709    HB2  SER 195          1HB       SER 195   5.600 -10.298  23.752
  710    HB3  SER 195          2HB       SER 195   4.352 -11.291  22.984
  711    HG   SER 195           HG       SER 195   7.089 -11.015  22.240
  712    H    ALA 196           H        ALA 196   2.541 -10.384  21.224
  713    HA   ALA 196           HA       ALA 196   2.847 -10.389  18.322
  714    HB1  ALA 196          1HB       ALA 196   2.606 -13.026  19.857
  715    HB2  ALA 196          2HB       ALA 196   2.535 -12.842  18.090
  716    HB3  ALA 196          3HB       ALA 196   4.036 -12.484  18.952
  717    H    ARG 197           H        ARG 197   0.841 -11.234  17.254
  718    HA   ARG 197           HA       ARG 197  -1.598 -10.270  18.473
  719    HB2  ARG 197          1HB       ARG 197  -2.701 -11.104  16.458
  720    HB3  ARG 197          2HB       ARG 197  -1.274 -10.149  16.071
  721    HG2  ARG 197          1HG       ARG 197  -0.007 -12.111  15.447
  722    HG3  ARG 197          2HG       ARG 197  -1.198 -13.192  16.175
  723    HD2  ARG 197          1HD       ARG 197  -1.469 -13.320  13.837
  724    HD3  ARG 197          2HD       ARG 197  -2.882 -12.491  14.491
  725    HE   ARG 197           HE       ARG 197  -1.493 -10.336  13.799
  726   HH11  ARG 197          1HH1      ARG 197  -1.829 -13.270  11.872
  727   HH12  ARG 197          2HH1      ARG 197  -1.641 -12.353  10.380
  728   HH21  ARG 197          1HH2      ARG 197  -1.252  -9.332  11.836
  729   HH22  ARG 197          2HH2      ARG 197  -1.324 -10.299  10.359
  730    H    GLY 198           H        GLY 198  -0.062 -13.309  18.793
  731    HA2  GLY 198          1HA       GLY 198  -0.629 -15.088  20.182
  732    HA3  GLY 198          2HA       GLY 198  -2.213 -14.382  20.469
  733    H    ARG 199           H        ARG 199  -2.228 -16.970  20.252
  734    HA   ARG 199           HA       ARG 199  -2.601 -17.980  17.525
  735    HB2  ARG 199          1HB       ARG 199  -1.544 -19.419  19.052
  736    HB3  ARG 199          2HB       ARG 199  -2.771 -19.198  20.286
  737    HG2  ARG 199          1HG       ARG 199  -2.705 -21.432  19.074
  738    HG3  ARG 199          2HG       ARG 199  -4.268 -20.671  19.290
  739    HD2  ARG 199          1HD       ARG 199  -3.999 -21.748  17.081
  740    HD3  ARG 199          2HD       ARG 199  -4.412 -20.045  17.003
  741    HE   ARG 199           HE       ARG 199  -1.572 -20.938  16.705
  742   HH11  ARG 199          1HH1      ARG 199  -4.367 -19.376  15.152
  743   HH12  ARG 199          2HH1      ARG 199  -3.373 -18.843  13.823
  744   HH21  ARG 199          1HH2      ARG 199  -0.436 -20.178  14.974
  745   HH22  ARG 199          2HH2      ARG 199  -1.238 -19.274  13.725
  746    H    SER 200           H        SER 200  -4.186 -16.763  16.655
  747    HA   SER 200           HA       SER 200  -6.953 -16.707  17.534
  748    HB2  SER 200          1HB       SER 200  -5.704 -16.334  14.780
  749    HB3  SER 200          2HB       SER 200  -7.396 -15.997  15.188
  750    HG   SER 200           HG       SER 200  -6.723 -14.400  16.635
  751    H5'    G 201           H5'        G 201   5.655 -12.695   8.561
  752   H5''    G 201           H5"        G 201   7.281 -12.780   7.863
  753    H4'    G 201           H4'        G 201   6.506 -13.465  10.732
  754    H3'    G 201           H3'        G 201   7.005 -10.928   9.637
  755    H2'    G 201           H2'        G 201   9.248 -11.415   9.065
  756   HO2'    G 201           HO2        G 201   9.186 -10.415  11.727
  757    H1'    G 201           H1'        G 201   9.413 -12.947  11.687
  758    H8     G 201          8H          G 201  10.698 -13.056   7.992
  759    H1     G 201          1H          G 201  14.896 -14.905  12.526
  760    H21    G 201          1H2         G 201  13.900 -14.727  14.542
  761    H22    G 201          2H2         G 201  12.237 -14.170  14.642
  762   HO5'    G 201           HO5        G 201   7.175 -15.105   8.569
  763    H5'    U 202           H5'        U 202   5.641  -8.865   9.949
  764   H5''    U 202           H5"        U 202   7.253  -8.697  10.655
  765    H4'    U 202           H4'        U 202   6.595  -6.535  10.085
  766    H3'    U 202           H3'        U 202   7.142  -7.023  12.745
  767    H2'    U 202           H2'        U 202   4.918  -7.126  13.452
  768   HO2'    U 202           HO2        U 202   6.018  -4.936  14.181
  769    H1'    U 202           H1'        U 202   4.062  -4.873  11.616
  770    H3     U 202          3H          U 202  -0.291  -5.520  12.810
  771    H5     U 202          5H          U 202   1.220  -9.429  12.608
  772    H6     U 202          6H          U 202   3.420  -8.520  12.114
  773    H5'    A 203           H5'        A 203   8.020  -3.016  10.590
  774   H5''    A 203           H5"        A 203   9.597  -2.585  11.253
  775    H4'    A 203           H4'        A 203   8.675  -0.704  10.159
  776    H3'    A 203           H3'        A 203   9.039  -0.486  13.071
  777    H2'    A 203           H2'        A 203   6.916   0.400  13.344
  778   HO2'    A 203           HO2        A 203   8.607   2.353  12.706
  779    H1'    A 203           H1'        A 203   7.039   1.194  10.416
  780    H8     A 203          8H          A 203   4.471  -0.266  12.995
  781    H61    A 203          1H6         A 203   0.691   3.714   9.874
  782    H62    A 203          2H6         A 203   0.693   2.633  11.276
  783    H2     A 203          2H          A 203   4.553   3.875   8.078
  784    H5'    G 204           H5'        G 204  10.760   1.760   9.093
  785   H5''    G 204           H5"        G 204   9.553   0.526   8.727
  786    H4'    G 204           H4'        G 204  11.494  -0.666   7.450
  787    H3'    G 204           H3'        G 204  13.085   1.317   8.492
  788    H2'    G 204           H2'        G 204  11.836   3.136   7.642
  789   HO2'    G 204           HO2        G 204  13.927   2.450   5.888
  790    H1'    G 204           H1'        G 204  11.571   1.830   4.956
  791    H8     G 204          8H          G 204  10.054   3.268   3.543
  792    H1     G 204          1H          G 204   6.562   5.232   8.602
  793    H21    G 204          1H2         G 204   7.303   4.155  10.435
  794    H22    G 204          2H2         G 204   8.746   3.173  10.357
  795    H5'    U 205           H5'        U 205  13.796  -1.099   4.535
  796   H5''    U 205           H5"        U 205  14.029  -2.713   5.232
  797    H4'    U 205           H4'        U 205  16.123  -2.989   4.037
  798    H3'    U 205           H3'        U 205  16.244  -0.140   3.850
  799   HO3'    U 205           HO3        U 205  18.037  -0.866   2.329
  800    H2'    U 205           H2'        U 205  14.812  -0.045   2.009
  801   HO2'    U 205           HO2        U 205  16.090   0.143   0.087
  802    H1'    U 205           H1'        U 205  16.091  -2.676   1.167
  803    H3     U 205          3H          U 205  13.365  -4.275  -2.082
  804    H5     U 205          5H          U 205  11.561  -0.643  -1.058
  805    H6     U 205          6H          U 205  13.200  -0.351   0.697
  Start of MODEL   15
    1    H1   GLY 105          1H        GLY 105 -11.202  15.234   8.687
    2    H2   GLY 105          2H        GLY 105 -10.245  13.919   8.896
    3    H3   GLY 105          3H        GLY 105 -11.158  14.060   7.543
    4    HA2  GLY 105          1HA       GLY 105  -9.895  15.967   6.804
    5    HA3  GLY 105          2HA       GLY 105  -8.917  15.834   8.276
    6    H    SER 106           H        SER 106  -8.073  15.695   5.459
    7    HA   SER 106           HA       SER 106  -7.340  12.983   4.770
    8    HB2  SER 106          1HB       SER 106  -5.888  14.127   3.097
    9    HB3  SER 106          2HB       SER 106  -7.590  14.614   3.035
   10    HG   SER 106           HG       SER 106  -6.146  16.406   2.920
   11    H    HIS 107           H        HIS 107  -5.211  12.149   4.578
   12    HA   HIS 107           HA       HIS 107  -3.083  13.289   6.334
   13    HB2  HIS 107          1HB       HIS 107  -4.124  11.681   7.763
   14    HB3  HIS 107          2HB       HIS 107  -4.196  10.474   6.479
   15    HD2  HIS 107          2HD       HIS 107  -2.309   8.717   6.520
   16    HE1  HIS 107          1HE       HIS 107   0.660  10.856   8.711
   17    HE2  HIS 107          2HE       HIS 107   0.112   8.648   7.565
   18    H    MET 108           H        MET 108  -3.453  10.329   4.316
   19    HA   MET 108           HA       MET 108  -1.506  11.186   2.350
   20    HB2  MET 108          1HB       MET 108   0.001  10.754   4.296
   21    HB3  MET 108          2HB       MET 108  -0.656   9.129   4.440
   22    HG2  MET 108          1HG       MET 108   1.518   9.113   3.343
   23    HG3  MET 108          2HG       MET 108   0.263   8.496   2.286
   24    HE1  MET 108          1HE       MET 108   2.744  11.410   3.067
   25    HE2  MET 108          2HE       MET 108   2.404  12.586   1.780
   26    HE3  MET 108          3HE       MET 108   1.221  12.330   3.077
   27    H    LYS 109           H        LYS 109  -1.439   9.818   0.573
   28    HA   LYS 109           HA       LYS 109  -3.488   7.763   0.294
   29    HB2  LYS 109          1HB       LYS 109  -1.391   8.807  -1.640
   30    HB3  LYS 109          2HB       LYS 109  -2.591   7.570  -2.029
   31    HG2  LYS 109          1HG       LYS 109  -4.371   9.243  -1.254
   32    HG3  LYS 109          2HG       LYS 109  -3.119  10.486  -1.423
   33    HD2  LYS 109          1HD       LYS 109  -4.001   8.498  -3.565
   34    HD3  LYS 109          2HD       LYS 109  -4.569  10.169  -3.475
   35    HE2  LYS 109          1HE       LYS 109  -2.536  11.077  -4.135
   36    HE3  LYS 109          2HE       LYS 109  -1.596   9.689  -3.576
   37    HZ1  LYS 109          1HZ       LYS 109  -1.779   9.780  -6.029
   38    HZ2  LYS 109          2HZ       LYS 109  -3.407   9.544  -5.921
   39    HZ3  LYS 109          3HZ       LYS 109  -2.368   8.391  -5.397
   40    H    LYS 110           H        LYS 110  -1.676   6.890   2.306
   41    HA   LYS 110           HA       LYS 110  -0.393   4.528   1.001
   42    HB2  LYS 110          1HB       LYS 110   1.176   6.528   1.133
   43    HB3  LYS 110          2HB       LYS 110   1.118   6.361   2.887
   44    HG2  LYS 110          1HG       LYS 110   2.051   4.022   2.629
   45    HG3  LYS 110          2HG       LYS 110   2.127   4.304   0.878
   46    HD2  LYS 110          1HD       LYS 110   3.567   6.379   1.405
   47    HD3  LYS 110          2HD       LYS 110   3.590   5.831   3.081
   48    HE2  LYS 110          1HE       LYS 110   5.626   5.093   2.129
   49    HE3  LYS 110          2HE       LYS 110   4.616   3.663   2.291
   50    HZ1  LYS 110          1HZ       LYS 110   5.115   5.207  -0.202
   51    HZ2  LYS 110          2HZ       LYS 110   4.042   3.989  -0.147
   52    HZ3  LYS 110          3HZ       LYS 110   5.641   3.697   0.105
   53    H    ILE 111           H        ILE 111  -0.328   2.706   2.128
   54    HA   ILE 111           HA       ILE 111  -1.100   2.740   5.017
   55    HB   ILE 111           HB       ILE 111  -2.443   0.844   4.834
   56   HG12  ILE 111          1HG1      ILE 111  -1.424   0.442   2.026
   57   HG13  ILE 111          2HG1      ILE 111  -1.165  -0.595   3.421
   58   HG21  ILE 111          1HG2      ILE 111  -3.208   2.469   2.388
   59   HG22  ILE 111          2HG2      ILE 111  -4.271   1.551   3.481
   60   HG23  ILE 111          3HG2      ILE 111  -3.434   2.985   4.082
   61   HD11  ILE 111          1HD1      ILE 111  -3.569  -1.159   3.494
   62   HD12  ILE 111          2HD1      ILE 111  -3.821  -0.208   2.012
   63   HD13  ILE 111          3HD1      ILE 111  -2.778  -1.637   1.980
   64    H    PHE 112           H        PHE 112  -0.320   1.175   6.279
   65    HA   PHE 112           HA       PHE 112   2.226  -0.221   5.636
   66    HB2  PHE 112          1HB       PHE 112   1.782   1.102   7.798
   67    HB3  PHE 112          2HB       PHE 112   0.501  -0.035   8.156
   68    HD1  PHE 112          1HD       PHE 112   1.030  -2.396   8.808
   69    HD2  PHE 112          2HD       PHE 112   4.125   0.491   7.996
   70    HE1  PHE 112          1HE       PHE 112   2.685  -3.810  10.006
   71    HE2  PHE 112          2HE       PHE 112   5.763  -0.937   9.165
   72    HZ   PHE 112           HZ       PHE 112   5.049  -3.071  10.212
   73    H    VAL 113           H        VAL 113   2.203  -2.465   5.502
   74    HA   VAL 113           HA       VAL 113  -0.328  -4.005   5.949
   75    HB   VAL 113           HB       VAL 113   1.685  -4.475   3.717
   76   HG11  VAL 113          1HG1      VAL 113  -0.958  -5.859   4.335
   77   HG12  VAL 113          2HG1      VAL 113   0.119  -6.197   2.958
   78   HG13  VAL 113          3HG1      VAL 113   0.652  -6.567   4.593
   79   HG21  VAL 113          1HG2      VAL 113  -1.168  -3.421   3.581
   80   HG22  VAL 113          2HG2      VAL 113   0.314  -2.526   3.175
   81   HG23  VAL 113          3HG2      VAL 113  -0.169  -3.904   2.190
   82    H    GLY 114           H        GLY 114   0.067  -5.148   7.767
   83    HA2  GLY 114          1HA       GLY 114   2.846  -6.163   8.311
   84    HA3  GLY 114          2HA       GLY 114   1.660  -5.716   9.524
   85    H    GLY 115           H        GLY 115   3.214  -8.217   9.096
   86    HA2  GLY 115          1HA       GLY 115   2.697 -10.346   9.917
   87    HA3  GLY 115          2HA       GLY 115   0.990 -10.126   9.532
   88    H    LEU 116           H        LEU 116   3.412  -9.450   7.085
   89    HA   LEU 116           HA       LEU 116   2.306 -11.371   5.209
   90    HB2  LEU 116          1HB       LEU 116   4.827  -9.665   5.159
   91    HB3  LEU 116          2HB       LEU 116   4.278 -10.626   3.797
   92    HG   LEU 116           HG       LEU 116   2.525  -8.452   5.030
   93   HD11  LEU 116          1HD1      LEU 116   4.451  -8.229   2.682
   94   HD12  LEU 116          2HD1      LEU 116   4.681  -7.478   4.266
   95   HD13  LEU 116          3HD1      LEU 116   3.323  -6.970   3.248
   96   HD21  LEU 116          1HD2      LEU 116   1.498 -10.202   3.460
   97   HD22  LEU 116          2HD2      LEU 116   2.608  -9.617   2.217
   98   HD23  LEU 116          3HD2      LEU 116   1.389  -8.523   2.889
   99    H    SER 117           H        SER 117   2.951 -13.380   4.715
  100    HA   SER 117           HA       SER 117   4.767 -14.902   6.319
  101    HB2  SER 117          1HB       SER 117   2.927 -15.963   5.132
  102    HB3  SER 117          2HB       SER 117   3.573 -15.422   3.574
  103    HG   SER 117           HG       SER 117   4.398 -17.516   5.213
  104    H    VAL 118           H        VAL 118   6.766 -15.833   5.808
  105    HA   VAL 118           HA       VAL 118   8.728 -14.323   4.357
  106    HB   VAL 118           HB       VAL 118  10.237 -16.130   4.776
  107   HG11  VAL 118          1HG1      VAL 118  10.115 -16.335   7.185
  108   HG12  VAL 118          2HG1      VAL 118   9.642 -14.701   6.696
  109   HG13  VAL 118          3HG1      VAL 118   8.402 -15.877   7.191
  110   HG21  VAL 118          1HG2      VAL 118   9.544 -18.263   5.811
  111   HG22  VAL 118          2HG2      VAL 118   7.840 -17.819   5.590
  112   HG23  VAL 118          3HG2      VAL 118   8.893 -18.084   4.181
  113    H    ASN 119           H        ASN 119   6.374 -16.611   3.234
  114    HA   ASN 119           HA       ASN 119   7.749 -17.268   0.726
  115    HB2  ASN 119          1HB       ASN 119   6.154 -18.793   1.920
  116    HB3  ASN 119          2HB       ASN 119   4.859 -17.627   1.646
  117   HD21  ASN 119          1HD2      ASN 119   3.537 -18.421   0.042
  118   HD22  ASN 119          2HD2      ASN 119   4.123 -19.218  -1.410
  119    H    THR 120           H        THR 120   5.632 -14.697   1.861
  120    HA   THR 120           HA       THR 120   4.518 -13.980  -0.694
  121    HB   THR 120           HB       THR 120   4.613 -12.402   1.893
  122    HG1  THR 120          1HG       THR 120   2.628 -13.351   2.246
  123   HG21  THR 120          1HG2      THR 120   2.436 -11.458   0.980
  124   HG22  THR 120          2HG2      THR 120   2.895 -12.105  -0.597
  125   HG23  THR 120          3HG2      THR 120   3.907 -10.877   0.187
  126    H    THR 121           H        THR 121   4.956 -12.428  -2.105
  127    HA   THR 121           HA       THR 121   7.262 -10.628  -1.622
  128    HB   THR 121           HB       THR 121   7.839 -12.518  -3.167
  129    HG1  THR 121          1HG       THR 121   9.048 -11.098  -4.383
  130   HG21  THR 121          1HG2      THR 121   5.767 -12.461  -4.589
  131   HG22  THR 121          2HG2      THR 121   7.261 -12.275  -5.519
  132   HG23  THR 121          3HG2      THR 121   6.249 -10.857  -5.186
  133    H    VAL 122           H        VAL 122   7.374  -8.749  -3.090
  134    HA   VAL 122           HA       VAL 122   5.255  -7.071  -2.380
  135    HB   VAL 122           HB       VAL 122   7.661  -6.490  -2.865
  136   HG11  VAL 122          1HG1      VAL 122   8.310  -5.732  -5.058
  137   HG12  VAL 122          2HG1      VAL 122   7.820  -7.427  -5.176
  138   HG13  VAL 122          3HG1      VAL 122   6.730  -6.138  -5.744
  139   HG21  VAL 122          1HG2      VAL 122   5.948  -4.803  -2.350
  140   HG22  VAL 122          2HG2      VAL 122   7.155  -4.207  -3.510
  141   HG23  VAL 122          3HG2      VAL 122   5.546  -4.680  -4.078
  142    H    GLU 123           H        GLU 123   5.675  -8.707  -5.484
  143    HA   GLU 123           HA       GLU 123   3.571  -7.303  -6.862
  144    HB2  GLU 123          1HB       GLU 123   4.789 -10.054  -7.361
  145    HB3  GLU 123          2HB       GLU 123   3.702  -9.191  -8.464
  146    HG2  GLU 123          1HG       GLU 123   5.351  -7.297  -8.540
  147    HG3  GLU 123          2HG       GLU 123   6.471  -8.273  -7.583
  148    H    ASP 124           H        ASP 124   3.507 -10.077  -4.652
  149    HA   ASP 124           HA       ASP 124   0.785 -10.940  -5.252
  150    HB2  ASP 124          1HB       ASP 124   2.205 -11.123  -2.566
  151    HB3  ASP 124          2HB       ASP 124   0.863 -12.092  -3.135
  152    H    VAL 125           H        VAL 125   2.321  -8.791  -2.807
  153    HA   VAL 125           HA       VAL 125  -0.090  -7.980  -1.530
  154    HB   VAL 125           HB       VAL 125   2.550  -6.473  -1.673
  155   HG11  VAL 125          1HG1      VAL 125   1.838  -5.525   0.508
  156   HG12  VAL 125          2HG1      VAL 125   0.726  -5.068  -0.783
  157   HG13  VAL 125          3HG1      VAL 125   0.273  -6.356   0.358
  158   HG21  VAL 125          1HG2      VAL 125   2.986  -8.696  -0.826
  159   HG22  VAL 125          2HG2      VAL 125   2.930  -7.608   0.562
  160   HG23  VAL 125          3HG2      VAL 125   1.540  -8.645   0.206
  161    H    LYS 126           H        LYS 126   1.687  -6.413  -4.228
  162    HA   LYS 126           HA       LYS 126  -0.159  -4.247  -4.569
  163    HB2  LYS 126          1HB       LYS 126   2.098  -4.318  -5.525
  164    HB3  LYS 126          2HB       LYS 126   1.629  -5.619  -6.625
  165    HG2  LYS 126          1HG       LYS 126   0.194  -4.182  -7.883
  166    HG3  LYS 126          2HG       LYS 126   0.171  -2.952  -6.608
  167    HD2  LYS 126          1HD       LYS 126   2.629  -2.582  -6.958
  168    HD3  LYS 126          2HD       LYS 126   2.577  -3.683  -8.336
  169    HE2  LYS 126          1HE       LYS 126   0.971  -1.093  -8.061
  170    HE3  LYS 126          2HE       LYS 126   2.510  -1.240  -8.914
  171    HZ1  LYS 126          1HZ       LYS 126   0.705  -1.392 -10.472
  172    HZ2  LYS 126          2HZ       LYS 126  -0.031  -2.595  -9.665
  173    HZ3  LYS 126          3HZ       LYS 126   1.412  -2.864 -10.409
  174    H    HIS 127           H        HIS 127  -0.168  -7.510  -6.101
  175    HA   HIS 127           HA       HIS 127  -2.571  -7.191  -7.619
  176    HB2  HIS 127          1HB       HIS 127  -1.122  -9.019  -8.084
  177    HB3  HIS 127          2HB       HIS 127  -1.169  -9.594  -6.421
  178    HD2  HIS 127          2HD       HIS 127  -3.053 -11.218  -5.704
  179    HE1  HIS 127          1HE       HIS 127  -5.264 -11.324  -9.353
  180    HE2  HIS 127          2HE       HIS 127  -5.003 -12.387  -7.053
  181    H    TYR 128           H        TYR 128  -2.192  -8.414  -4.232
  182    HA   TYR 128           HA       TYR 128  -4.969  -8.797  -3.862
  183    HB2  TYR 128          1HB       TYR 128  -2.631  -8.708  -2.011
  184    HB3  TYR 128          2HB       TYR 128  -4.254  -8.708  -1.376
  185    HD1  TYR 128          1HD       TYR 128  -5.914 -10.544  -2.232
  186    HD2  TYR 128          2HD       TYR 128  -1.623 -10.825  -2.471
  187    HE1  TYR 128          1HE       TYR 128  -6.077 -13.026  -2.319
  188    HE2  TYR 128          2HE       TYR 128  -1.783 -13.300  -2.601
  189    HH   TYR 128           HH       TYR 128  -4.920 -15.014  -2.492
  190    H    PHE 129           H        PHE 129  -3.103  -5.843  -3.275
  191    HA   PHE 129           HA       PHE 129  -5.514  -4.583  -2.215
  192    HB2  PHE 129          1HB       PHE 129  -2.713  -3.590  -2.427
  193    HB3  PHE 129          2HB       PHE 129  -4.062  -2.532  -2.035
  194    HD1  PHE 129          1HD       PHE 129  -1.710  -4.847  -0.664
  195    HD2  PHE 129          2HD       PHE 129  -5.691  -3.301  -0.103
  196    HE1  PHE 129          1HE       PHE 129  -1.706  -5.676   1.668
  197    HE2  PHE 129          2HE       PHE 129  -5.680  -4.163   2.234
  198    HZ   PHE 129           HZ       PHE 129  -3.690  -5.335   3.124
  199    H    GLU 130           H        GLU 130  -4.101  -4.617  -5.387
  200    HA   GLU 130           HA       GLU 130  -5.469  -2.415  -6.525
  201    HB2  GLU 130          1HB       GLU 130  -4.494  -5.065  -7.587
  202    HB3  GLU 130          2HB       GLU 130  -5.429  -3.982  -8.628
  203    HG2  GLU 130          1HG       GLU 130  -3.862  -2.166  -8.312
  204    HG3  GLU 130          2HG       GLU 130  -2.915  -3.113  -7.171
  205    H    GLN 131           H        GLN 131  -6.843  -5.379  -5.396
  206    HA   GLN 131           HA       GLN 131  -9.158  -5.582  -7.039
  207    HB2  GLN 131          1HB       GLN 131  -8.882  -6.424  -4.111
  208    HB3  GLN 131          2HB       GLN 131  -9.979  -7.083  -5.341
  209    HG2  GLN 131          1HG       GLN 131  -7.842  -7.637  -6.677
  210    HG3  GLN 131          2HG       GLN 131  -6.948  -7.323  -5.205
  211   HE21  GLN 131          1HE2      GLN 131  -6.340  -9.669  -5.882
  212   HE22  GLN 131          2HE2      GLN 131  -7.297 -10.917  -5.088
  213    H    PHE 132           H        PHE 132  -8.503  -3.676  -4.188
  214    HA   PHE 132           HA       PHE 132 -11.244  -2.693  -3.839
  215    HB2  PHE 132          1HB       PHE 132  -8.611  -1.829  -2.588
  216    HB3  PHE 132          2HB       PHE 132 -10.200  -1.259  -2.099
  217    HD1  PHE 132          1HD       PHE 132  -7.719  -3.757  -1.574
  218    HD2  PHE 132          2HD       PHE 132 -11.987  -3.132  -1.477
  219    HE1  PHE 132          1HE       PHE 132  -7.983  -5.781  -0.175
  220    HE2  PHE 132          2HE       PHE 132 -12.251  -5.192  -0.115
  221    HZ   PHE 132           HZ       PHE 132 -10.249  -6.515   0.548
  222    H    GLY 133           H        GLY 133  -8.467  -1.599  -5.589
  223    HA2  GLY 133          1HA       GLY 133  -9.510   0.256  -7.299
  224    HA3  GLY 133          2HA       GLY 133  -9.197   1.204  -5.840
  225    H    LYS 134           H        LYS 134  -7.804   1.817  -8.138
  226    HA   LYS 134           HA       LYS 134  -5.520   0.295  -8.711
  227    HB2  LYS 134          1HB       LYS 134  -6.433   1.849 -10.297
  228    HB3  LYS 134          2HB       LYS 134  -6.090   3.227  -9.247
  229    HG2  LYS 134          1HG       LYS 134  -3.668   2.867  -9.491
  230    HG3  LYS 134          2HG       LYS 134  -3.956   1.386 -10.423
  231    HD2  LYS 134          1HD       LYS 134  -4.993   2.679 -12.228
  232    HD3  LYS 134          2HD       LYS 134  -4.847   4.174 -11.280
  233    HE2  LYS 134          1HE       LYS 134  -2.377   3.918 -11.249
  234    HE3  LYS 134          2HE       LYS 134  -2.515   2.434 -12.201
  235    HZ1  LYS 134          1HZ       LYS 134  -3.362   5.132 -13.119
  236    HZ2  LYS 134          2HZ       LYS 134  -3.495   3.761 -14.001
  237    HZ3  LYS 134          3HZ       LYS 134  -2.022   4.345 -13.613
  238    H    VAL 135           H        VAL 135  -3.574   0.135  -8.061
  239    HA   VAL 135           HA       VAL 135  -2.574   1.621  -5.665
  240    HB   VAL 135           HB       VAL 135  -1.891  -1.067  -6.895
  241   HG11  VAL 135          1HG1      VAL 135  -0.516   0.324  -4.579
  242   HG12  VAL 135          2HG1      VAL 135  -0.336  -1.389  -4.986
  243   HG13  VAL 135          3HG1      VAL 135   0.224  -0.155  -6.118
  244   HG21  VAL 135          1HG2      VAL 135  -2.695  -1.939  -4.740
  245   HG22  VAL 135          2HG2      VAL 135  -2.982  -0.285  -4.151
  246   HG23  VAL 135          3HG2      VAL 135  -3.956  -0.935  -5.479
  247    H    ASP 136           H        ASP 136  -1.001   3.039  -5.931
  248    HA   ASP 136           HA       ASP 136   0.206   3.514  -8.564
  249    HB2  ASP 136          1HB       ASP 136   0.234   5.033  -5.958
  250    HB3  ASP 136          2HB       ASP 136   1.351   5.411  -7.263
  251    H    ASP 137           H        ASP 137   1.284   2.189  -5.458
  252    HA   ASP 137           HA       ASP 137   3.612   0.981  -6.730
  253    HB2  ASP 137          1HB       ASP 137   4.290   3.435  -6.213
  254    HB3  ASP 137          2HB       ASP 137   4.093   3.033  -4.511
  255    H    ALA 138           H        ALA 138   4.703  -0.501  -5.246
  256    HA   ALA 138           HA       ALA 138   3.712  -0.770  -2.496
  257    HB1  ALA 138          1HB       ALA 138   3.347  -3.194  -2.699
  258    HB2  ALA 138          2HB       ALA 138   2.254  -2.308  -3.782
  259    HB3  ALA 138          3HB       ALA 138   3.700  -3.116  -4.437
  260    H    MET 139           H        MET 139   5.207  -1.776  -1.091
  261    HA   MET 139           HA       MET 139   7.868  -2.609  -2.086
  262    HB2  MET 139          1HB       MET 139   9.042  -0.889  -0.762
  263    HB3  MET 139          2HB       MET 139   8.104  -0.212  -2.091
  264    HG2  MET 139          1HG       MET 139   6.258   0.295  -0.425
  265    HG3  MET 139          2HG       MET 139   7.374  -0.162   0.861
  266    HE1  MET 139          1HE       MET 139   9.281   1.414   1.789
  267    HE2  MET 139          2HE       MET 139  10.083   0.940   0.274
  268    HE3  MET 139          3HE       MET 139  10.056   2.645   0.766
  269    H    LEU 140           H        LEU 140   8.828  -4.086  -0.745
  270    HA   LEU 140           HA       LEU 140   7.731  -4.438   2.021
  271    HB2  LEU 140          1HB       LEU 140   9.268  -6.491   0.411
  272    HB3  LEU 140          2HB       LEU 140   8.550  -6.694   2.005
  273    HG   LEU 140           HG       LEU 140   7.098  -6.391  -0.650
  274   HD11  LEU 140          1HD1      LEU 140   7.996  -8.633  -0.110
  275   HD12  LEU 140          2HD1      LEU 140   6.221  -8.620  -0.079
  276   HD13  LEU 140          3HD1      LEU 140   7.133  -8.601   1.443
  277   HD21  LEU 140          1HD2      LEU 140   5.003  -6.749   0.692
  278   HD22  LEU 140          2HD2      LEU 140   5.733  -5.166   0.899
  279   HD23  LEU 140          3HD2      LEU 140   5.951  -6.403   2.161
  280    H    MET 141           H        MET 141   9.163  -4.638   3.768
  281    HA   MET 141           HA       MET 141  11.625  -3.059   3.273
  282    HB2  MET 141          1HB       MET 141  10.228  -3.610   5.904
  283    HB3  MET 141          2HB       MET 141  11.551  -2.481   5.594
  284    HG2  MET 141          1HG       MET 141   8.667  -2.294   4.743
  285    HG3  MET 141          2HG       MET 141   9.619  -1.153   5.686
  286    HE1  MET 141          1HE       MET 141  11.809   0.607   2.975
  287    HE2  MET 141          2HE       MET 141  11.613   0.234   4.695
  288    HE3  MET 141          3HE       MET 141  12.316  -0.972   3.620
  289    H    PHE 142           H        PHE 142  13.394  -4.110   2.901
  290    HA   PHE 142           HA       PHE 142  13.897  -6.728   4.011
  291    HB2  PHE 142          1HB       PHE 142  15.281  -5.149   1.898
  292    HB3  PHE 142          2HB       PHE 142  15.994  -6.585   2.595
  293    HD1  PHE 142          1HD       PHE 142  12.925  -5.364   0.835
  294    HD2  PHE 142          2HD       PHE 142  15.339  -8.761   1.914
  295    HE1  PHE 142          1HE       PHE 142  11.516  -6.818  -0.601
  296    HE2  PHE 142          2HE       PHE 142  13.918 -10.224   0.484
  297    HZ   PHE 142           HZ       PHE 142  12.001  -9.253  -0.767
  298    H    ASP 143           H        ASP 143  15.636  -7.555   5.047
  299    HA   ASP 143           HA       ASP 143  17.047  -5.741   6.906
  300    HB2  ASP 143          1HB       ASP 143  16.510  -8.714   6.928
  301    HB3  ASP 143          2HB       ASP 143  17.756  -7.992   7.936
  302    H    LYS 144           H        LYS 144  19.296  -6.365   7.450
  303    HA   LYS 144           HA       LYS 144  20.869  -6.066   5.057
  304    HB2  LYS 144          1HB       LYS 144  22.792  -5.796   6.564
  305    HB3  LYS 144          2HB       LYS 144  21.417  -4.871   7.157
  306    HG2  LYS 144          1HG       LYS 144  20.919  -6.630   8.832
  307    HG3  LYS 144          2HG       LYS 144  22.270  -7.605   8.220
  308    HD2  LYS 144          1HD       LYS 144  23.842  -5.752   8.785
  309    HD3  LYS 144          2HD       LYS 144  22.504  -4.829   9.475
  310    HE2  LYS 144          1HE       LYS 144  23.450  -7.575  10.428
  311    HE3  LYS 144          2HE       LYS 144  23.917  -6.037  11.156
  312    HZ1  LYS 144          1HZ       LYS 144  22.093  -7.020  12.377
  313    HZ2  LYS 144          2HZ       LYS 144  21.143  -7.096  11.057
  314    HZ3  LYS 144          3HZ       LYS 144  21.566  -5.644  11.685
  315    H    THR 145           H        THR 145  19.602  -8.816   5.873
  316    HA   THR 145           HA       THR 145  21.698 -10.753   5.191
  317    HB   THR 145           HB       THR 145  19.637 -12.020   4.382
  318    HG1  THR 145          1HG       THR 145  17.665 -10.954   5.347
  319   HG21  THR 145          1HG2      THR 145  19.379 -10.925   7.220
  320   HG22  THR 145          2HG2      THR 145  20.440 -12.266   6.733
  321   HG23  THR 145          3HG2      THR 145  18.683 -12.442   6.601
  322    H    THR 146           H        THR 146  19.729  -8.371   3.614
  323    HA   THR 146           HA       THR 146  19.330  -7.636   1.607
  324    HB   THR 146           HB       THR 146  20.781  -7.334  -0.054
  325    HG1  THR 146          1HG       THR 146  22.455  -8.701  -0.588
  326   HG21  THR 146          1HG2      THR 146  22.969  -6.895   0.872
  327   HG22  THR 146          2HG2      THR 146  22.709  -8.046   2.198
  328   HG23  THR 146          3HG2      THR 146  21.760  -6.543   2.116
  329    H    ASN 147           H        ASN 147  18.441 -10.200   2.570
  330    HA   ASN 147           HA       ASN 147  17.239 -11.300   0.038
  331    HB2  ASN 147          1HB       ASN 147  18.940 -12.770   2.086
  332    HB3  ASN 147          2HB       ASN 147  17.811 -13.615   1.036
  333   HD21  ASN 147          1HD2      ASN 147  20.898 -11.900   1.098
  334   HD22  ASN 147          2HD2      ASN 147  21.308 -12.333  -0.553
  335    H    ARG 148           H        ARG 148  16.644 -10.639   3.410
  336    HA   ARG 148           HA       ARG 148  13.931 -11.898   3.147
  337    HB2  ARG 148          1HB       ARG 148  15.680 -11.850   5.634
  338    HB3  ARG 148          2HB       ARG 148  14.031 -12.442   5.571
  339    HG2  ARG 148          1HG       ARG 148  16.330 -13.713   4.008
  340    HG3  ARG 148          2HG       ARG 148  15.846 -14.180   5.628
  341    HD2  ARG 148          1HD       ARG 148  14.859 -15.747   4.144
  342    HD3  ARG 148          2HD       ARG 148  13.568 -14.736   4.808
  343    HE   ARG 148           HE       ARG 148  14.681 -13.876   2.208
  344   HH11  ARG 148          1HH1      ARG 148  12.124 -15.784   3.623
  345   HH12  ARG 148          2HH1      ARG 148  11.014 -15.438   2.314
  346   HH21  ARG 148          1HH2      ARG 148  13.322 -13.543   0.573
  347   HH22  ARG 148          2HH2      ARG 148  11.728 -14.264   0.567
  348    H    HIS 149           H        HIS 149  12.211 -10.873   4.015
  349    HA   HIS 149           HA       HIS 149  12.620  -8.034   4.817
  350    HB2  HIS 149          1HB       HIS 149  10.348  -7.614   4.075
  351    HB3  HIS 149          2HB       HIS 149  11.338  -8.270   2.783
  352    HD2  HIS 149          2HD       HIS 149  10.177 -10.091   1.395
  353    HE1  HIS 149          1HE       HIS 149   7.112 -11.250   4.117
  354    HE2  HIS 149          2HE       HIS 149   8.013 -11.552   1.750
  355    H    ARG 150           H        ARG 150  11.225  -7.091   6.377
  356    HA   ARG 150           HA       ARG 150  11.171  -8.663   8.818
  357    HB2  ARG 150          1HB       ARG 150  10.449  -5.787   8.168
  358    HB3  ARG 150          2HB       ARG 150  10.278  -6.467   9.798
  359    HG2  ARG 150          1HG       ARG 150  12.691  -7.197   9.649
  360    HG3  ARG 150          2HG       ARG 150  12.831  -6.221   8.191
  361    HD2  ARG 150          1HD       ARG 150  11.951  -5.157  10.924
  362    HD3  ARG 150          2HD       ARG 150  13.628  -5.209  10.418
  363    HE   ARG 150           HE       ARG 150  11.786  -3.146   9.806
  364   HH11  ARG 150          1HH1      ARG 150  14.413  -4.843   8.177
  365   HH12  ARG 150          2HH1      ARG 150  14.551  -3.608   6.957
  366   HH21  ARG 150          1HH2      ARG 150  12.240  -1.544   8.576
  367   HH22  ARG 150          2HH2      ARG 150  13.388  -1.673   7.238
  368    H    GLY 151           H        GLY 151   9.046  -9.214   6.562
  369    HA2  GLY 151          1HA       GLY 151   6.948 -10.164   6.607
  370    HA3  GLY 151          2HA       GLY 151   6.921 -10.019   8.367
  371    H    PHE 152           H        PHE 152   7.465  -7.121   6.434
  372    HA   PHE 152           HA       PHE 152   4.625  -6.459   6.324
  373    HB2  PHE 152          1HB       PHE 152   4.657  -4.576   7.729
  374    HB3  PHE 152          2HB       PHE 152   5.483  -5.779   8.681
  375    HD1  PHE 152          1HD       PHE 152   5.781  -2.644   6.766
  376    HD2  PHE 152          2HD       PHE 152   7.891  -5.495   9.217
  377    HE1  PHE 152          1HE       PHE 152   7.650  -1.049   7.002
  378    HE2  PHE 152          2HE       PHE 152   9.763  -3.881   9.458
  379    HZ   PHE 152           HZ       PHE 152   9.662  -1.675   8.299
  380    H    GLY 153           H        GLY 153   4.358  -4.370   5.206
  381    HA2  GLY 153          1HA       GLY 153   6.612  -3.058   3.902
  382    HA3  GLY 153          2HA       GLY 153   5.578  -3.959   2.788
  383    H    PHE 154           H        PHE 154   5.496  -1.666   1.991
  384    HA   PHE 154           HA       PHE 154   3.061  -0.344   3.066
  385    HB2  PHE 154          1HB       PHE 154   5.434   0.985   1.741
  386    HB3  PHE 154          2HB       PHE 154   3.901   1.764   2.094
  387    HD1  PHE 154          1HD       PHE 154   3.201   2.252   4.416
  388    HD2  PHE 154          2HD       PHE 154   7.021   0.465   3.521
  389    HE1  PHE 154          1HE       PHE 154   3.969   2.735   6.722
  390    HE2  PHE 154          2HE       PHE 154   7.785   0.940   5.819
  391    HZ   PHE 154           HZ       PHE 154   6.262   2.053   7.442
  392    H    VAL 155           H        VAL 155   1.580   0.554   1.666
  393    HA   VAL 155           HA       VAL 155   1.904   0.065  -1.247
  394    HB   VAL 155           HB       VAL 155  -0.690  -0.553   0.187
  395   HG11  VAL 155          1HG1      VAL 155  -0.991   0.225  -2.136
  396   HG12  VAL 155          2HG1      VAL 155   0.197  -0.983  -2.684
  397   HG13  VAL 155          3HG1      VAL 155  -1.357  -1.494  -1.990
  398   HG21  VAL 155          1HG2      VAL 155  -0.283  -2.902  -0.397
  399   HG22  VAL 155          2HG2      VAL 155   1.340  -2.485  -0.998
  400   HG23  VAL 155          3HG2      VAL 155   0.942  -2.314   0.725
  401    H    THR 156           H        THR 156   1.524   1.760  -2.424
  402    HA   THR 156           HA       THR 156   0.163   4.119  -1.277
  403    HB   THR 156           HB       THR 156   1.905   4.326  -3.685
  404    HG1  THR 156          1HG       THR 156   3.650   4.587  -2.484
  405   HG21  THR 156          1HG2      THR 156   1.270   6.245  -1.403
  406   HG22  THR 156          2HG2      THR 156   0.551   6.299  -3.029
  407   HG23  THR 156          3HG2      THR 156   2.282   6.600  -2.819
  408    H    PHE 157           H        PHE 157  -1.513   5.202  -2.326
  409    HA   PHE 157           HA       PHE 157  -2.867   3.538  -4.358
  410    HB2  PHE 157          1HB       PHE 157  -3.894   5.084  -2.004
  411    HB3  PHE 157          2HB       PHE 157  -4.944   4.505  -3.287
  412    HD1  PHE 157          1HD       PHE 157  -2.528   3.361  -0.676
  413    HD2  PHE 157          2HD       PHE 157  -5.627   2.218  -3.442
  414    HE1  PHE 157          1HE       PHE 157  -2.591   1.104   0.319
  415    HE2  PHE 157          2HE       PHE 157  -5.715  -0.038  -2.408
  416    HZ   PHE 157           HZ       PHE 157  -4.188  -0.605  -0.526
  417    H    GLU 158           H        GLU 158  -4.302   4.347  -5.862
  418    HA   GLU 158           HA       GLU 158  -3.522   6.795  -7.190
  419    HB2  GLU 158          1HB       GLU 158  -4.393   4.890  -8.370
  420    HB3  GLU 158          2HB       GLU 158  -5.941   4.986  -7.547
  421    HG2  GLU 158          1HG       GLU 158  -4.849   7.310  -9.196
  422    HG3  GLU 158          2HG       GLU 158  -5.618   5.939  -9.976
  423    H    SER 159           H        SER 159  -6.098   6.028  -4.867
  424    HA   SER 159           HA       SER 159  -6.568   8.925  -4.422
  425    HB2  SER 159          1HB       SER 159  -8.325   8.277  -5.953
  426    HB3  SER 159          2HB       SER 159  -8.745   6.876  -4.941
  427    HG   SER 159           HG       SER 159 -10.040   8.873  -4.676
  428    H    GLU 160           H        GLU 160  -7.092   9.494  -2.357
  429    HA   GLU 160           HA       GLU 160  -6.466   7.674  -0.198
  430    HB2  GLU 160          1HB       GLU 160  -6.143  10.225  -0.345
  431    HB3  GLU 160          2HB       GLU 160  -7.866  10.361   0.033
  432    HG2  GLU 160          1HG       GLU 160  -7.514   9.165   2.155
  433    HG3  GLU 160          2HG       GLU 160  -5.832   8.834   1.719
  434    H    ASP 161           H        ASP 161  -9.423   8.394  -1.945
  435    HA   ASP 161           HA       ASP 161 -11.274   7.423   0.048
  436    HB2  ASP 161          1HB       ASP 161 -11.458   7.602  -2.967
  437    HB3  ASP 161          2HB       ASP 161 -12.738   6.940  -1.963
  438    H    ILE 162           H        ILE 162  -9.128   5.723  -2.166
  439    HA   ILE 162           HA       ILE 162 -10.328   3.104  -1.605
  440    HB   ILE 162           HB       ILE 162  -7.526   3.622  -2.638
  441   HG12  ILE 162          1HG1      ILE 162  -8.872   4.731  -4.229
  442   HG13  ILE 162          2HG1      ILE 162  -8.407   3.169  -4.886
  443   HG21  ILE 162          1HG2      ILE 162  -7.852   1.354  -1.878
  444   HG22  ILE 162          2HG2      ILE 162  -9.394   1.212  -2.742
  445   HG23  ILE 162          3HG2      ILE 162  -7.866   1.333  -3.637
  446   HD11  ILE 162          1HD1      ILE 162 -11.157   3.923  -3.786
  447   HD12  ILE 162          2HD1      ILE 162 -10.722   3.635  -5.479
  448   HD13  ILE 162          3HD1      ILE 162 -10.704   2.292  -4.322
  449    H    VAL 163           H        VAL 163  -7.590   5.058  -0.335
  450    HA   VAL 163           HA       VAL 163  -6.537   3.105   1.431
  451    HB   VAL 163           HB       VAL 163  -6.690   6.144   1.745
  452   HG11  VAL 163          1HG1      VAL 163  -5.194   4.141   3.442
  453   HG12  VAL 163          2HG1      VAL 163  -4.802   5.875   3.380
  454   HG13  VAL 163          3HG1      VAL 163  -6.373   5.343   3.985
  455   HG21  VAL 163          1HG2      VAL 163  -4.316   5.988   1.102
  456   HG22  VAL 163          2HG2      VAL 163  -4.501   4.244   0.850
  457   HG23  VAL 163          3HG2      VAL 163  -5.403   5.397  -0.169
  458    H    GLU 164           H        GLU 164  -9.185   5.491   1.993
  459    HA   GLU 164           HA       GLU 164  -9.840   4.522   4.624
  460    HB2  GLU 164          1HB       GLU 164 -11.621   5.886   2.569
  461    HB3  GLU 164          2HB       GLU 164 -12.051   5.628   4.253
  462    HG2  GLU 164          1HG       GLU 164  -9.762   7.364   3.252
  463    HG3  GLU 164          2HG       GLU 164 -11.332   7.930   3.796
  464    H    LYS 165           H        LYS 165 -11.206   3.553   1.439
  465    HA   LYS 165           HA       LYS 165 -13.137   1.684   2.367
  466    HB2  LYS 165          1HB       LYS 165 -12.847   2.560   0.022
  467    HB3  LYS 165          2HB       LYS 165 -11.432   1.519  -0.153
  468    HG2  LYS 165          1HG       LYS 165 -13.007  -0.455   0.419
  469    HG3  LYS 165          2HG       LYS 165 -14.334   0.687   0.188
  470    HD2  LYS 165          1HD       LYS 165 -12.221  -0.136  -1.849
  471    HD3  LYS 165          2HD       LYS 165 -13.912  -0.647  -1.822
  472    HE2  LYS 165          1HE       LYS 165 -14.607   1.734  -2.184
  473    HE3  LYS 165          2HE       LYS 165 -12.902   2.198  -2.278
  474    HZ1  LYS 165          1HZ       LYS 165 -14.286   0.329  -4.129
  475    HZ2  LYS 165          2HZ       LYS 165 -12.685   0.659  -4.196
  476    HZ3  LYS 165          3HZ       LYS 165 -13.789   1.838  -4.494
  477    H    VAL 166           H        VAL 166  -9.731   1.169   1.561
  478    HA   VAL 166           HA       VAL 166  -9.587  -1.645   2.178
  479    HB   VAL 166           HB       VAL 166  -7.438   0.504   2.034
  480   HG11  VAL 166          1HG1      VAL 166  -7.212  -2.520   2.062
  481   HG12  VAL 166          2HG1      VAL 166  -5.884  -1.411   1.655
  482   HG13  VAL 166          3HG1      VAL 166  -6.563  -1.408   3.288
  483   HG21  VAL 166          1HG2      VAL 166  -8.767   0.013  -0.126
  484   HG22  VAL 166          2HG2      VAL 166  -7.028  -0.210  -0.206
  485   HG23  VAL 166          3HG2      VAL 166  -8.103  -1.616  -0.039
  486    H    CYS 167           H        CYS 167  -8.592   1.275   4.060
  487    HA   CYS 167           HA       CYS 167  -7.665  -0.168   6.312
  488    HB2  CYS 167          1HB       CYS 167  -8.612   2.700   6.012
  489    HB3  CYS 167          2HB       CYS 167  -7.983   2.039   7.534
  490    HG   CYS 167           HG       CYS 167  -6.561   2.371   4.599
  491    H    GLU 168           H        GLU 168 -11.021   0.965   5.680
  492    HA   GLU 168           HA       GLU 168 -12.097   0.485   8.217
  493    HB2  GLU 168          1HB       GLU 168 -13.038   1.707   6.274
  494    HB3  GLU 168          2HB       GLU 168 -13.366   0.192   5.447
  495    HG2  GLU 168          1HG       GLU 168 -14.435   0.823   8.225
  496    HG3  GLU 168          2HG       GLU 168 -15.183   1.486   6.778
  497    H    ILE 169           H        ILE 169 -11.230  -1.858   5.727
  498    HA   ILE 169           HA       ILE 169 -12.731  -4.098   6.814
  499    HB   ILE 169           HB       ILE 169 -10.435  -3.881   4.845
  500   HG12  ILE 169          1HG1      ILE 169 -13.343  -4.655   4.310
  501   HG13  ILE 169          2HG1      ILE 169 -12.854  -2.969   4.331
  502   HG21  ILE 169          1HG2      ILE 169 -12.031  -6.363   5.594
  503   HG22  ILE 169          2HG2      ILE 169 -10.966  -6.231   4.177
  504   HG23  ILE 169          3HG2      ILE 169 -10.282  -6.100   5.784
  505   HD11  ILE 169          1HD1      ILE 169 -11.735  -5.051   2.436
  506   HD12  ILE 169          2HD1      ILE 169 -12.897  -3.769   2.057
  507   HD13  ILE 169          3HD1      ILE 169 -11.244  -3.341   2.525
  508    H    HIS 170           H        HIS 170  -9.553  -2.764   7.365
  509    HA   HIS 170           HA       HIS 170  -7.972  -2.979   8.922
  510    HB2  HIS 170          1HB       HIS 170  -9.935  -2.852  10.429
  511    HB3  HIS 170          2HB       HIS 170  -9.930  -4.604  10.549
  512    HD2  HIS 170          2HD       HIS 170  -6.433  -3.045  10.612
  513    HE1  HIS 170          1HE       HIS 170  -7.432  -3.906  14.661
  514    HE2  HIS 170          2HE       HIS 170  -5.541  -3.269  13.070
  515    H    PHE 171           H        PHE 171  -9.457  -6.192   8.532
  516    HA   PHE 171           HA       PHE 171  -6.738  -7.293   8.187
  517    HB2  PHE 171          1HB       PHE 171  -8.913  -8.504   9.802
  518    HB3  PHE 171          2HB       PHE 171  -7.715  -9.513   9.012
  519    HD1  PHE 171          1HD       PHE 171  -5.378  -9.538   9.666
  520    HD2  PHE 171          2HD       PHE 171  -8.192  -6.911  11.612
  521    HE1  PHE 171          1HE       PHE 171  -3.743  -9.137  11.494
  522    HE2  PHE 171          2HE       PHE 171  -6.554  -6.515  13.435
  523    HZ   PHE 171           HZ       PHE 171  -4.328  -7.628  13.378
  524    H    HIS 172           H        HIS 172  -6.123  -8.193   6.459
  525    HA   HIS 172           HA       HIS 172  -8.152  -8.884   4.354
  526    HB2  HIS 172          1HB       HIS 172  -5.452  -7.502   4.143
  527    HB3  HIS 172          2HB       HIS 172  -6.385  -8.072   2.768
  528    HD2  HIS 172          2HD       HIS 172  -6.656  -5.418   5.626
  529    HE1  HIS 172          1HE       HIS 172  -9.131  -4.126   2.434
  530    HE2  HIS 172          2HE       HIS 172  -8.143  -3.483   4.666
  531    H    GLU 173           H        GLU 173  -7.670 -10.587   2.909
  532    HA   GLU 173           HA       GLU 173  -5.775 -12.614   3.937
  533    HB2  GLU 173          1HB       GLU 173  -8.030 -13.325   3.395
  534    HB3  GLU 173          2HB       GLU 173  -7.847 -12.742   1.731
  535    HG2  GLU 173          1HG       GLU 173  -6.016 -14.381   1.356
  536    HG3  GLU 173          2HG       GLU 173  -6.175 -14.941   3.022
  537    H    ILE 174           H        ILE 174  -3.851 -13.045   3.066
  538    HA   ILE 174           HA       ILE 174  -3.227 -12.460   0.233
  539    HB   ILE 174           HB       ILE 174  -1.519 -11.498   2.571
  540   HG12  ILE 174          1HG1      ILE 174  -2.998 -10.086   0.326
  541   HG13  ILE 174          2HG1      ILE 174  -3.221  -9.897   2.061
  542   HG21  ILE 174          1HG2      ILE 174   0.168 -10.838   0.891
  543   HG22  ILE 174          2HG2      ILE 174  -0.055 -12.569   0.890
  544   HG23  ILE 174          3HG2      ILE 174  -0.796 -11.588  -0.393
  545   HD11  ILE 174          1HD1      ILE 174  -0.918  -8.872   0.381
  546   HD12  ILE 174          2HD1      ILE 174  -2.132  -7.950   1.270
  547   HD13  ILE 174          3HD1      ILE 174  -0.905  -8.876   2.162
  548    H    ASN 175           H        ASN 175  -2.407 -14.293  -0.645
  549    HA   ASN 175           HA       ASN 175  -1.636 -16.421  -0.835
  550    HB2  ASN 175          1HB       ASN 175   0.457 -15.240   1.025
  551    HB3  ASN 175          2HB       ASN 175   0.648 -16.779   0.198
  552   HD21  ASN 175          1HD2      ASN 175   2.347 -14.501  -0.072
  553   HD22  ASN 175          2HD2      ASN 175   2.347 -14.147  -1.803
  554    H    ASN 176           H        ASN 176  -3.782 -16.482   0.819
  555    HA   ASN 176           HA       ASN 176  -4.939 -17.643   2.338
  556    HB2  ASN 176          1HB       ASN 176  -4.037 -19.496   0.897
  557    HB3  ASN 176          2HB       ASN 176  -2.784 -19.764   2.108
  558   HD21  ASN 176          1HD2      ASN 176  -3.427 -21.841   2.741
  559   HD22  ASN 176          2HD2      ASN 176  -4.993 -22.161   3.474
  560    H    LYS 177           H        LYS 177  -2.739 -15.838   3.342
  561    HA   LYS 177           HA       LYS 177  -3.007 -16.555   6.236
  562    HB2  LYS 177          1HB       LYS 177  -0.767 -14.962   4.906
  563    HB3  LYS 177          2HB       LYS 177  -0.934 -15.244   6.634
  564    HG2  LYS 177          1HG       LYS 177  -0.428 -17.399   4.542
  565    HG3  LYS 177          2HG       LYS 177   0.777 -16.657   5.596
  566    HD2  LYS 177          1HD       LYS 177  -0.359 -17.548   7.591
  567    HD3  LYS 177          2HD       LYS 177  -1.596 -18.306   6.563
  568    HE2  LYS 177          1HE       LYS 177   0.171 -19.626   5.420
  569    HE3  LYS 177          2HE       LYS 177   1.393 -18.896   6.468
  570    HZ1  LYS 177          1HZ       LYS 177   0.684 -21.063   7.310
  571    HZ2  LYS 177          2HZ       LYS 177  -0.871 -20.581   7.407
  572    HZ3  LYS 177          3HZ       LYS 177   0.258 -19.906   8.379
  573    H    MET 178           H        MET 178  -2.957 -14.548   7.601
  574    HA   MET 178           HA       MET 178  -4.660 -12.431   6.346
  575    HB2  MET 178          1HB       MET 178  -4.537 -13.308   9.244
  576    HB3  MET 178          2HB       MET 178  -5.478 -11.951   8.627
  577    HG2  MET 178          1HG       MET 178  -5.834 -14.882   7.922
  578    HG3  MET 178          2HG       MET 178  -6.901 -13.904   8.915
  579    HE1  MET 178          1HE       MET 178  -8.637 -11.546   6.292
  580    HE2  MET 178          2HE       MET 178  -8.519 -12.019   8.001
  581    HE3  MET 178          3HE       MET 178  -7.173 -11.155   7.218
  582    H    VAL 179           H        VAL 179  -4.178 -10.333   6.484
  583    HA   VAL 179           HA       VAL 179  -1.770  -9.458   8.009
  584    HB   VAL 179           HB       VAL 179  -1.109  -7.969   6.237
  585   HG11  VAL 179          1HG1      VAL 179  -0.256  -9.550   4.647
  586   HG12  VAL 179          2HG1      VAL 179  -0.193 -10.246   6.277
  587   HG13  VAL 179          3HG1      VAL 179  -1.446 -10.777   5.125
  588   HG21  VAL 179          1HG2      VAL 179  -3.307  -9.144   4.506
  589   HG22  VAL 179          2HG2      VAL 179  -3.258  -7.484   5.149
  590   HG23  VAL 179          3HG2      VAL 179  -2.043  -8.016   3.994
  591    H    GLU 180           H        GLU 180  -1.699  -7.364   8.703
  592    HA   GLU 180           HA       GLU 180  -4.365  -6.090   9.152
  593    HB2  GLU 180          1HB       GLU 180  -2.822  -6.617  11.098
  594    HB3  GLU 180          2HB       GLU 180  -1.710  -5.407  10.451
  595    HG2  GLU 180          1HG       GLU 180  -3.652  -3.739  10.560
  596    HG3  GLU 180          2HG       GLU 180  -4.587  -4.991  11.372
  597    H    CYS 181           H        CYS 181  -4.935  -4.262   8.058
  598    HA   CYS 181           HA       CYS 181  -2.829  -2.637   6.709
  599    HB2  CYS 181          1HB       CYS 181  -4.655  -1.474   5.578
  600    HB3  CYS 181          2HB       CYS 181  -4.646  -3.206   5.227
  601    HG   CYS 181           HG       CYS 181  -6.431  -1.662   7.543
  602    H    LYS 182           H        LYS 182  -2.258  -0.688   7.430
  603    HA   LYS 182           HA       LYS 182  -3.941   0.819   9.385
  604    HB2  LYS 182          1HB       LYS 182  -0.952   0.313   9.730
  605    HB3  LYS 182          2HB       LYS 182  -1.916   1.415  10.701
  606    HG2  LYS 182          1HG       LYS 182  -3.185  -0.407  11.655
  607    HG3  LYS 182          2HG       LYS 182  -2.412  -1.591  10.592
  608    HD2  LYS 182          1HD       LYS 182  -0.776   0.095  12.523
  609    HD3  LYS 182          2HD       LYS 182  -1.555  -1.415  13.012
  610    HE2  LYS 182          1HE       LYS 182  -0.398  -2.655  11.246
  611    HE3  LYS 182          2HE       LYS 182   0.404  -1.180  10.684
  612    HZ1  LYS 182          1HZ       LYS 182   1.702  -1.111  12.646
  613    HZ2  LYS 182          2HZ       LYS 182   1.684  -2.707  12.241
  614    HZ3  LYS 182          3HZ       LYS 182   0.734  -2.184  13.446
  615    H    LYS 183           H        LYS 183  -3.649   3.145   9.193
  616    HA   LYS 183           HA       LYS 183  -2.593   4.111   6.659
  617    HB2  LYS 183          1HB       LYS 183  -3.388   5.567   9.205
  618    HB3  LYS 183          2HB       LYS 183  -2.729   6.387   7.782
  619    HG2  LYS 183          1HG       LYS 183  -4.551   5.453   6.375
  620    HG3  LYS 183          2HG       LYS 183  -5.259   4.685   7.807
  621    HD2  LYS 183          1HD       LYS 183  -5.539   6.936   8.860
  622    HD3  LYS 183          2HD       LYS 183  -4.794   7.681   7.441
  623    HE2  LYS 183          1HE       LYS 183  -7.148   7.959   7.198
  624    HE3  LYS 183          2HE       LYS 183  -6.630   6.760   6.012
  625    HZ1  LYS 183          1HZ       LYS 183  -7.926   6.143   8.615
  626    HZ2  LYS 183          2HZ       LYS 183  -7.482   5.025   7.496
  627    HZ3  LYS 183          3HZ       LYS 183  -8.667   6.109   7.158
  628    H    ALA 184           H        ALA 184  -0.641   4.914   6.082
  629    HA   ALA 184           HA       ALA 184   1.625   4.022   7.651
  630    HB1  ALA 184          1HB       ALA 184   1.572   3.924   5.193
  631    HB2  ALA 184          2HB       ALA 184   1.490   5.701   5.117
  632    HB3  ALA 184          3HB       ALA 184   2.934   4.903   5.770
  633    H    GLN 185           H        GLN 185   2.394   5.076   9.377
  634    HA   GLN 185           HA       GLN 185   2.382   8.057   9.447
  635    HB2  GLN 185          1HB       GLN 185   2.681   5.992  11.641
  636    HB3  GLN 185          2HB       GLN 185   2.936   7.719  11.899
  637    HG2  GLN 185          1HG       GLN 185   0.342   6.398  11.009
  638    HG3  GLN 185          2HG       GLN 185   0.699   7.020  12.618
  639   HE21  GLN 185          1HE2      GLN 185  -1.571   7.854  11.076
  640   HE22  GLN 185          2HE2      GLN 185  -1.325   9.550  10.683
  641    HA   PRO 186           HA       PRO 186   6.718   8.177   8.700
  642    HB2  PRO 186          1HB       PRO 186   7.045  10.228  10.864
  643    HB3  PRO 186          2HB       PRO 186   7.480  10.329   9.133
  644    HG2  PRO 186          1HG       PRO 186   5.299  11.633  10.104
  645    HG3  PRO 186          2HG       PRO 186   5.255  10.823   8.504
  646    HD2  PRO 186          1HD       PRO 186   4.197   9.789  11.154
  647    HD3  PRO 186          2HD       PRO 186   3.430   9.794   9.544
  648    H    LYS 187           H        LYS 187   8.747   7.327   9.465
  649    HA   LYS 187           HA       LYS 187   8.625   5.712  11.863
  650    HB2  LYS 187          1HB       LYS 187  10.973   5.146  11.430
  651    HB3  LYS 187          2HB       LYS 187   9.944   4.884  10.029
  652    HG2  LYS 187          1HG       LYS 187  10.809   6.800   8.884
  653    HG3  LYS 187          2HG       LYS 187  11.616   7.410  10.344
  654    HD2  LYS 187          1HD       LYS 187  13.190   5.584  10.351
  655    HD3  LYS 187          2HD       LYS 187  12.328   4.750   9.046
  656    HE2  LYS 187          1HE       LYS 187  12.868   6.508   7.459
  657    HE3  LYS 187          2HE       LYS 187  13.553   7.521   8.738
  658    HZ1  LYS 187          1HZ       LYS 187  14.690   4.899   7.863
  659    HZ2  LYS 187          2HZ       LYS 187  15.308   5.861   9.031
  660    HZ3  LYS 187          3HZ       LYS 187  15.283   6.367   7.481
  661    H    GLU 188           H        GLU 188   9.581   8.916  11.358
  662    HA   GLU 188           HA       GLU 188  10.990   9.400  13.838
  663    HB2  GLU 188          1HB       GLU 188   9.318  11.292  12.111
  664    HB3  GLU 188          2HB       GLU 188  10.403  11.751  13.413
  665    HG2  GLU 188          1HG       GLU 188  11.706  12.148  11.572
  666    HG3  GLU 188          2HG       GLU 188  12.287  10.580  12.114
  667    H    VAL 189           H        VAL 189   7.566   9.084  13.058
  668    HA   VAL 189           HA       VAL 189   6.674  10.036  15.729
  669    HB   VAL 189           HB       VAL 189   5.076   9.012  13.353
  670   HG11  VAL 189          1HG1      VAL 189   3.125   9.992  14.522
  671   HG12  VAL 189          2HG1      VAL 189   3.825   8.653  15.430
  672   HG13  VAL 189          3HG1      VAL 189   4.147  10.328  15.937
  673   HG21  VAL 189          1HG2      VAL 189   5.513  11.851  14.377
  674   HG22  VAL 189          2HG2      VAL 189   6.150  11.186  12.860
  675   HG23  VAL 189          3HG2      VAL 189   4.408  11.378  13.068
  676    H    MET 190           H        MET 190   6.655   7.054  13.753
  677    HA   MET 190           HA       MET 190   5.549   5.400  15.853
  678    HB2  MET 190          1HB       MET 190   6.980   4.674  13.265
  679    HB3  MET 190          2HB       MET 190   6.120   3.535  14.296
  680    HG2  MET 190          1HG       MET 190   4.940   5.865  12.758
  681    HG3  MET 190          2HG       MET 190   4.711   4.155  12.437
  682    HE1  MET 190          1HE       MET 190   2.373   3.029  15.400
  683    HE2  MET 190          2HE       MET 190   3.300   2.522  13.972
  684    HE3  MET 190          3HE       MET 190   4.146   2.993  15.463
  685    H    SER 191           H        SER 191   8.769   6.388  15.205
  686    HA   SER 191           HA       SER 191  10.770   6.041  16.052
  687    HB2  SER 191          1HB       SER 191   9.826   5.994  18.287
  688    HB3  SER 191          2HB       SER 191   9.566   4.243  18.159
  689    HG   SER 191           HG       SER 191  11.538   4.783  19.222
  690    HA   PRO 192           HA       PRO 192  11.710   2.583  13.430
  691    HB2  PRO 192          1HB       PRO 192  14.463   2.570  13.505
  692    HB3  PRO 192          2HB       PRO 192  13.488   3.760  12.589
  693    HG2  PRO 192          1HG       PRO 192  14.685   4.072  15.361
  694    HG3  PRO 192          2HG       PRO 192  14.765   5.219  13.985
  695    HD2  PRO 192          1HD       PRO 192  12.940   5.516  15.964
  696    HD3  PRO 192          2HD       PRO 192  12.498   5.850  14.263
  697    H    THR 193           H        THR 193  11.886   0.420  13.697
  698    HA   THR 193           HA       THR 193  13.025  -0.871  16.015
  699    HB   THR 193           HB       THR 193  11.039   0.336  16.996
  700    HG1  THR 193          1HG       THR 193  10.589  -1.392  18.293
  701   HG21  THR 193          1HG2      THR 193   8.844  -0.713  16.817
  702   HG22  THR 193          2HG2      THR 193   9.432  -1.848  15.588
  703   HG23  THR 193          3HG2      THR 193   9.352  -0.100  15.242
  704    H    GLY 194           H        GLY 194  12.014  -3.189  16.303
  705    HA2  GLY 194          1HA       GLY 194  10.799  -4.457  14.071
  706    HA3  GLY 194          2HA       GLY 194  12.529  -4.799  14.015
  707    H    SER 195           H        SER 195  10.369  -6.698  14.417
  708    HA   SER 195           HA       SER 195  10.076  -7.564  17.086
  709    HB2  SER 195          1HB       SER 195   8.768  -8.461  15.224
  710    HB3  SER 195          2HB       SER 195  10.213  -9.266  14.574
  711    HG   SER 195           HG       SER 195   8.901 -10.655  15.882
  712    H    ALA 196           H        ALA 196  11.272  -8.680  18.536
  713    HA   ALA 196           HA       ALA 196  14.113  -8.627  18.234
  714    HB1  ALA 196          1HB       ALA 196  12.916  -8.137  20.333
  715    HB2  ALA 196          2HB       ALA 196  12.366  -9.829  20.428
  716    HB3  ALA 196          3HB       ALA 196  14.095  -9.443  20.560
  717    H    ARG 197           H        ARG 197  11.821 -11.290  17.899
  718    HA   ARG 197           HA       ARG 197  13.891 -13.086  16.862
  719    HB2  ARG 197          1HB       ARG 197  14.100 -13.427  19.302
  720    HB3  ARG 197          2HB       ARG 197  12.382 -13.805  19.418
  721    HG2  ARG 197          1HG       ARG 197  12.682 -15.824  18.061
  722    HG3  ARG 197          2HG       ARG 197  14.382 -15.426  17.770
  723    HD2  ARG 197          1HD       ARG 197  13.153 -15.977  20.502
  724    HD3  ARG 197          2HD       ARG 197  13.996 -17.183  19.515
  725    HE   ARG 197           HE       ARG 197  15.808 -15.080  19.742
  726   HH11  ARG 197          1HH1      ARG 197  14.248 -17.215  22.043
  727   HH12  ARG 197          2HH1      ARG 197  15.550 -17.074  23.194
  728   HH21  ARG 197          1HH2      ARG 197  17.430 -14.943  21.256
  729   HH22  ARG 197          2HH2      ARG 197  17.303 -15.824  22.749
  730    H    GLY 198           H        GLY 198  13.097 -14.629  15.512
  731    HA2  GLY 198          1HA       GLY 198  10.376 -15.569  15.471
  732    HA3  GLY 198          2HA       GLY 198  10.660 -14.401  14.174
  733    H    ARG 199           H        ARG 199   9.955 -16.877  13.515
  734    HA   ARG 199           HA       ARG 199  10.312 -18.711  12.267
  735    HB2  ARG 199          1HB       ARG 199  11.438 -17.064  10.810
  736    HB3  ARG 199          2HB       ARG 199  12.983 -17.476  11.530
  737    HG2  ARG 199          1HG       ARG 199  11.568 -19.886  10.559
  738    HG3  ARG 199          2HG       ARG 199  11.719 -18.661   9.311
  739    HD2  ARG 199          1HD       ARG 199  13.632 -20.013   9.067
  740    HD3  ARG 199          2HD       ARG 199  14.189 -18.515   9.792
  741    HE   ARG 199           HE       ARG 199  14.687 -19.640  11.814
  742   HH11  ARG 199          1HH1      ARG 199  13.211 -21.953   9.613
  743   HH12  ARG 199          2HH1      ARG 199  13.873 -23.306  10.488
  744   HH21  ARG 199          1HH2      ARG 199  15.442 -21.331  12.840
  745   HH22  ARG 199          2HH2      ARG 199  15.124 -22.972  12.294
  746    H    SER 200           H        SER 200  13.407 -18.144  13.925
  747    HA   SER 200           HA       SER 200  13.876 -21.012  14.418
  748    HB2  SER 200          1HB       SER 200  15.378 -18.503  15.254
  749    HB3  SER 200          2HB       SER 200  15.900 -20.162  15.612
  750    HG   SER 200           HG       SER 200  16.809 -19.260  13.633
  751    H5'    G 201           H5'        G 201   7.730 -13.254   7.574
  752   H5''    G 201           H5"        G 201   8.036 -11.792   8.509
  753    H4'    G 201           H4'        G 201   5.813 -12.594   8.988
  754    H3'    G 201           H3'        G 201   7.534 -11.917  10.984
  755    H2'    G 201           H2'        G 201   8.347 -14.126  11.343
  756   HO2'    G 201           HO2        G 201   7.102 -13.238  13.326
  757    H1'    G 201           H1'        G 201   5.523 -15.188  11.205
  758    H8     G 201          8H          G 201   9.005 -15.931   9.594
  759    H1     G 201          1H          G 201   6.019 -20.950  12.333
  760    H21    G 201          1H2         G 201   4.090 -20.225  13.249
  761    H22    G 201          2H2         G 201   3.649 -18.531  13.117
  762   HO5'    G 201           HO5        G 201   9.858 -13.134   8.582
  763    H5'    U 202           H5'        U 202   5.708  -9.708  10.191
  764   H5''    U 202           H5"        U 202   6.973  -9.451  11.400
  765    H4'    U 202           H4'        U 202   6.337  -7.365  10.272
  766    H3'    U 202           H3'        U 202   6.789  -7.639  12.970
  767    H2'    U 202           H2'        U 202   4.474  -7.846  13.523
  768   HO2'    U 202           HO2        U 202   5.502  -5.404  14.113
  769    H1'    U 202           H1'        U 202   3.912  -5.579  11.597
  770    H3     U 202          3H          U 202  -0.497  -5.571  12.752
  771    H5     U 202          5H          U 202   0.461  -9.650  12.772
  772    H6     U 202          6H          U 202   2.764  -9.080  12.198
  773    H5'    A 203           H5'        A 203   9.559  -2.718  12.940
  774   H5''    A 203           H5"        A 203   7.965  -2.255  13.572
  775    H4'    A 203           H4'        A 203   8.965  -1.689  10.754
  776    H3'    A 203           H3'        A 203   9.729  -0.230  13.009
  777    H2'    A 203           H2'        A 203   7.428   0.317  13.566
  778   HO2'    A 203           HO2        A 203   8.695   2.306  12.014
  779    H1'    A 203           H1'        A 203   7.158   0.775  10.572
  780    H8     A 203          8H          A 203   4.769  -0.870  13.187
  781    H61    A 203          1H6         A 203   0.660   3.043  10.410
  782    H62    A 203          2H6         A 203   0.744   1.823  11.688
  783    H2     A 203          2H          A 203   4.512   3.799   8.767
  784    H5'    G 204           H5'        G 204   9.996   2.572   8.537
  785   H5''    G 204           H5"        G 204   9.744   0.827   8.473
  786    H4'    G 204           H4'        G 204  11.658   0.545   6.996
  787    H3'    G 204           H3'        G 204  12.748   2.868   7.891
  788    H2'    G 204           H2'        G 204  10.927   4.212   7.090
  789   HO2'    G 204           HO2        G 204  13.031   4.335   5.172
  790    H1'    G 204           H1'        G 204  11.166   2.722   4.475
  791    H8     G 204          8H          G 204   9.493   3.801   2.839
  792    H1     G 204          1H          G 204   5.613   5.733   7.619
  793    H21    G 204          1H2         G 204   6.416   4.983   9.517
  794    H22    G 204          2H2         G 204   7.905   4.043   9.556
  795    H5'    U 205           H5'        U 205  14.938   0.270   7.055
  796   H5''    U 205           H5"        U 205  16.652   0.674   7.182
  797    H4'    U 205           H4'        U 205  16.243  -1.690   6.516
  798    H3'    U 205           H3'        U 205  18.157  -0.046   5.367
  799   HO3'    U 205           HO3        U 205  18.756  -2.189   4.311
  800    H2'    U 205           H2'        U 205  16.941   0.515   3.461
  801   HO2'    U 205           HO2        U 205  18.764  -0.518   2.555
  802    H1'    U 205           H1'        U 205  15.896  -2.318   3.308
  803    H3     U 205          3H          U 205  12.934  -1.708  -0.029
  804    H5     U 205          5H          U 205  13.725   2.216   1.186
  805    H6     U 205          6H          U 205  15.033   1.346   3.044
  Start of MODEL   16
    1    H1   GLY 105          1H        GLY 105  -8.231  13.873   6.202
    2    H2   GLY 105          2H        GLY 105  -8.839  13.592   4.705
    3    H3   GLY 105          3H        GLY 105  -8.202  15.056   5.068
    4    HA2  GLY 105          1HA       GLY 105  -6.003  14.117   5.320
    5    HA3  GLY 105          2HA       GLY 105  -6.689  12.523   4.953
    6    H    SER 106           H        SER 106  -4.595  14.137   3.547
    7    HA   SER 106           HA       SER 106  -5.579  13.809   0.796
    8    HB2  SER 106          1HB       SER 106  -6.277  16.106   1.334
    9    HB3  SER 106          2HB       SER 106  -4.623  16.503   1.836
   10    HG   SER 106           HG       SER 106  -5.112  17.147  -0.333
   11    H    HIS 107           H        HIS 107  -3.971  13.456  -0.648
   12    HA   HIS 107           HA       HIS 107  -2.030  12.922  -1.603
   13    HB2  HIS 107          1HB       HIS 107  -1.549  15.303  -1.119
   14    HB3  HIS 107          2HB       HIS 107  -0.700  14.817   0.347
   15    HD2  HIS 107          2HD       HIS 107  -0.407  14.668  -3.503
   16    HE1  HIS 107          1HE       HIS 107   3.432  13.657  -1.938
   17    HE2  HIS 107          2HE       HIS 107   2.121  14.163  -4.062
   18    H    MET 108           H        MET 108  -1.881  12.488   1.883
   19    HA   MET 108           HA       MET 108   0.236  10.514   1.882
   20    HB2  MET 108          1HB       MET 108  -1.883  11.172   3.958
   21    HB3  MET 108          2HB       MET 108  -0.466  10.156   4.230
   22    HG2  MET 108          1HG       MET 108  -0.381  13.115   3.513
   23    HG3  MET 108          2HG       MET 108  -0.216  12.425   5.116
   24    HE1  MET 108          1HE       MET 108   3.073  12.904   1.993
   25    HE2  MET 108          2HE       MET 108   1.516  12.254   1.458
   26    HE3  MET 108          3HE       MET 108   1.594  13.859   2.215
   27    H    LYS 109           H        LYS 109  -1.106   9.572  -0.099
   28    HA   LYS 109           HA       LYS 109  -3.258   7.739   0.461
   29    HB2  LYS 109          1HB       LYS 109  -1.509   8.158  -1.986
   30    HB3  LYS 109          2HB       LYS 109  -2.912   7.089  -1.956
   31    HG2  LYS 109          1HG       LYS 109  -4.434   8.895  -1.537
   32    HG3  LYS 109          2HG       LYS 109  -3.120  10.071  -1.394
   33    HD2  LYS 109          1HD       LYS 109  -2.429   9.398  -3.773
   34    HD3  LYS 109          2HD       LYS 109  -3.934   8.457  -3.843
   35    HE2  LYS 109          1HE       LYS 109  -5.252  10.502  -3.489
   36    HE3  LYS 109          2HE       LYS 109  -3.775  11.457  -3.336
   37    HZ1  LYS 109          1HZ       LYS 109  -3.248  10.884  -5.647
   38    HZ2  LYS 109          2HZ       LYS 109  -4.720  11.591  -5.576
   39    HZ3  LYS 109          3HZ       LYS 109  -4.602   9.971  -5.783
   40    H    LYS 110           H        LYS 110  -1.022   7.002   2.134
   41    HA   LYS 110           HA       LYS 110  -0.129   4.396   0.939
   42    HB2  LYS 110          1HB       LYS 110   1.612   6.211   1.094
   43    HB3  LYS 110          2HB       LYS 110   1.467   6.124   2.849
   44    HG2  LYS 110          1HG       LYS 110   2.159   3.696   2.736
   45    HG3  LYS 110          2HG       LYS 110   2.267   3.842   0.981
   46    HD2  LYS 110          1HD       LYS 110   4.496   4.029   1.784
   47    HD3  LYS 110          2HD       LYS 110   4.016   5.667   1.323
   48    HE2  LYS 110          1HE       LYS 110   3.473   6.146   3.729
   49    HE3  LYS 110          2HE       LYS 110   3.973   4.499   4.145
   50    HZ1  LYS 110          1HZ       LYS 110   6.224   5.052   3.421
   51    HZ2  LYS 110          2HZ       LYS 110   5.730   6.065   4.582
   52    HZ3  LYS 110          3HZ       LYS 110   5.768   6.580   3.021
   53    H    ILE 111           H        ILE 111  -0.287   2.571   2.048
   54    HA   ILE 111           HA       ILE 111  -1.006   2.667   4.955
   55    HB   ILE 111           HB       ILE 111  -2.287   0.709   4.824
   56   HG12  ILE 111          1HG1      ILE 111  -1.407   0.397   1.955
   57   HG13  ILE 111          2HG1      ILE 111  -1.030  -0.661   3.305
   58   HG21  ILE 111          1HG2      ILE 111  -3.358   2.846   4.152
   59   HG22  ILE 111          2HG2      ILE 111  -3.194   2.357   2.444
   60   HG23  ILE 111          3HG2      ILE 111  -4.189   1.401   3.570
   61   HD11  ILE 111          1HD1      ILE 111  -3.783  -0.337   2.071
   62   HD12  ILE 111          2HD1      ILE 111  -2.691  -1.722   1.925
   63   HD13  ILE 111          3HD1      ILE 111  -3.398  -1.323   3.500
   64    H    PHE 112           H        PHE 112  -0.196   1.143   6.240
   65    HA   PHE 112           HA       PHE 112   2.312  -0.282   5.537
   66    HB2  PHE 112          1HB       PHE 112   2.219   1.079   7.611
   67    HB3  PHE 112          2HB       PHE 112   0.788   0.225   8.125
   68    HD1  PHE 112          1HD       PHE 112   0.909  -2.170   8.858
   69    HD2  PHE 112          2HD       PHE 112   4.430   0.119   7.901
   70    HE1  PHE 112          1HE       PHE 112   2.305  -3.744  10.183
   71    HE2  PHE 112          2HE       PHE 112   5.812  -1.468   9.182
   72    HZ   PHE 112           HZ       PHE 112   4.767  -3.403  10.342
   73    H    VAL 113           H        VAL 113   2.308  -2.515   5.436
   74    HA   VAL 113           HA       VAL 113  -0.194  -4.020   6.072
   75    HB   VAL 113           HB       VAL 113   1.683  -4.672   3.782
   76   HG11  VAL 113          1HG1      VAL 113  -0.075  -6.286   3.162
   77   HG12  VAL 113          2HG1      VAL 113   0.550  -6.637   4.775
   78   HG13  VAL 113          3HG1      VAL 113  -1.023  -5.826   4.595
   79   HG21  VAL 113          1HG2      VAL 113  -0.168  -4.024   2.291
   80   HG22  VAL 113          2HG2      VAL 113  -1.093  -3.422   3.687
   81   HG23  VAL 113          3HG2      VAL 113   0.433  -2.646   3.204
   82    H    GLY 114           H        GLY 114   0.174  -5.249   7.794
   83    HA2  GLY 114          1HA       GLY 114   2.973  -6.171   8.390
   84    HA3  GLY 114          2HA       GLY 114   1.761  -5.744   9.585
   85    H    GLY 115           H        GLY 115   3.399  -8.221   9.032
   86    HA2  GLY 115          1HA       GLY 115   3.008 -10.370   9.838
   87    HA3  GLY 115          2HA       GLY 115   1.263 -10.149   9.689
   88    H    LEU 116           H        LEU 116   3.351  -9.442   6.954
   89    HA   LEU 116           HA       LEU 116   2.025 -11.312   5.172
   90    HB2  LEU 116          1HB       LEU 116   4.560  -9.637   4.987
   91    HB3  LEU 116          2HB       LEU 116   4.013 -10.646   3.661
   92    HG   LEU 116           HG       LEU 116   2.162  -8.541   4.842
   93   HD11  LEU 116          1HD1      LEU 116   4.214  -8.172   2.624
   94   HD12  LEU 116          2HD1      LEU 116   4.247  -7.386   4.215
   95   HD13  LEU 116          3HD1      LEU 116   2.949  -7.003   3.074
   96   HD21  LEU 116          1HD2      LEU 116   2.436  -9.691   2.027
   97   HD22  LEU 116          2HD2      LEU 116   1.155  -8.619   2.627
   98   HD23  LEU 116          3HD2      LEU 116   1.272 -10.290   3.216
   99    H    SER 117           H        SER 117   2.679 -13.318   4.444
  100    HA   SER 117           HA       SER 117   4.575 -14.895   5.956
  101    HB2  SER 117          1HB       SER 117   2.778 -16.012   4.806
  102    HB3  SER 117          2HB       SER 117   3.294 -15.353   3.241
  103    HG   SER 117           HG       SER 117   3.984 -17.579   3.797
  104    H    VAL 118           H        VAL 118   6.699 -15.430   5.530
  105    HA   VAL 118           HA       VAL 118   8.293 -13.650   3.957
  106    HB   VAL 118           HB       VAL 118   8.941 -14.955   6.045
  107   HG11  VAL 118          1HG1      VAL 118   8.442 -17.238   5.162
  108   HG12  VAL 118          2HG1      VAL 118   9.778 -17.057   4.000
  109   HG13  VAL 118          3HG1      VAL 118  10.105 -17.056   5.742
  110   HG21  VAL 118          1HG2      VAL 118  11.295 -14.873   5.496
  111   HG22  VAL 118          2HG2      VAL 118  10.937 -14.822   3.758
  112   HG23  VAL 118          3HG2      VAL 118  10.460 -13.469   4.812
  113    H    ASN 119           H        ASN 119   6.490 -16.370   2.964
  114    HA   ASN 119           HA       ASN 119   8.006 -16.930   0.515
  115    HB2  ASN 119          1HB       ASN 119   6.608 -18.616   1.744
  116    HB3  ASN 119          2HB       ASN 119   5.169 -17.665   1.369
  117   HD21  ASN 119          1HD2      ASN 119   4.042 -18.708  -0.244
  118   HD22  ASN 119          2HD2      ASN 119   4.798 -19.478  -1.630
  119    H    THR 120           H        THR 120   5.506 -14.641   1.484
  120    HA   THR 120           HA       THR 120   4.423 -14.076  -1.129
  121    HB   THR 120           HB       THR 120   4.417 -12.416   1.418
  122    HG1  THR 120          1HG       THR 120   2.519 -13.435   1.826
  123   HG21  THR 120          1HG2      THR 120   3.718 -10.963  -0.366
  124   HG22  THR 120          2HG2      THR 120   2.271 -11.485   0.509
  125   HG23  THR 120          3HG2      THR 120   2.667 -12.217  -1.052
  126    H    THR 121           H        THR 121   4.867 -12.560  -2.603
  127    HA   THR 121           HA       THR 121   7.185 -10.762  -2.117
  128    HB   THR 121           HB       THR 121   7.649 -12.578  -3.762
  129    HG1  THR 121          1HG       THR 121   8.792 -11.126  -4.999
  130   HG21  THR 121          1HG2      THR 121   5.518 -12.495  -5.055
  131   HG22  THR 121          2HG2      THR 121   6.937 -12.224  -6.075
  132   HG23  THR 121          3HG2      THR 121   5.917 -10.851  -5.603
  133    H    VAL 122           H        VAL 122   7.264  -8.795  -3.391
  134    HA   VAL 122           HA       VAL 122   5.168  -7.138  -2.560
  135    HB   VAL 122           HB       VAL 122   7.570  -6.557  -3.007
  136   HG11  VAL 122          1HG1      VAL 122   6.675  -6.081  -5.882
  137   HG12  VAL 122          2HG1      VAL 122   8.253  -5.721  -5.165
  138   HG13  VAL 122          3HG1      VAL 122   7.744  -7.404  -5.353
  139   HG21  VAL 122          1HG2      VAL 122   5.878  -4.861  -2.449
  140   HG22  VAL 122          2HG2      VAL 122   7.113  -4.247  -3.569
  141   HG23  VAL 122          3HG2      VAL 122   5.506  -4.667  -4.179
  142    H    GLU 123           H        GLU 123   5.546  -8.623  -5.743
  143    HA   GLU 123           HA       GLU 123   3.443  -7.117  -7.018
  144    HB2  GLU 123          1HB       GLU 123   4.647  -9.835  -7.704
  145    HB3  GLU 123          2HB       GLU 123   3.551  -8.901  -8.739
  146    HG2  GLU 123          1HG       GLU 123   5.205  -7.010  -8.713
  147    HG3  GLU 123          2HG       GLU 123   6.332  -8.046  -7.830
  148    H    ASP 124           H        ASP 124   3.384 -10.061  -5.016
  149    HA   ASP 124           HA       ASP 124   0.669 -10.891  -5.651
  150    HB2  ASP 124          1HB       ASP 124   2.110 -11.183  -2.986
  151    HB3  ASP 124          2HB       ASP 124   0.755 -12.127  -3.565
  152    H    VAL 125           H        VAL 125   2.187  -8.745  -3.249
  153    HA   VAL 125           HA       VAL 125  -0.199  -8.043  -1.832
  154    HB   VAL 125           HB       VAL 125   2.433  -6.524  -1.993
  155   HG11  VAL 125          1HG1      VAL 125   1.773  -5.626   0.213
  156   HG12  VAL 125          2HG1      VAL 125   0.621  -5.153  -1.038
  157   HG13  VAL 125          3HG1      VAL 125   0.212  -6.468   0.090
  158   HG21  VAL 125          1HG2      VAL 125   2.851  -8.795  -1.210
  159   HG22  VAL 125          2HG2      VAL 125   2.903  -7.706   0.175
  160   HG23  VAL 125          3HG2      VAL 125   1.467  -8.709  -0.100
  161    H    LYS 126           H        LYS 126   1.567  -6.258  -4.436
  162    HA   LYS 126           HA       LYS 126  -0.394  -4.172  -4.656
  163    HB2  LYS 126          1HB       LYS 126   1.787  -3.874  -5.600
  164    HB3  LYS 126          2HB       LYS 126   1.596  -5.255  -6.690
  165    HG2  LYS 126          1HG       LYS 126   0.018  -4.131  -8.052
  166    HG3  LYS 126          2HG       LYS 126  -0.343  -2.929  -6.812
  167    HD2  LYS 126          1HD       LYS 126   1.872  -1.890  -7.106
  168    HD3  LYS 126          2HD       LYS 126   2.291  -3.115  -8.328
  169    HE2  LYS 126          1HE       LYS 126   0.376  -2.389  -9.721
  170    HE3  LYS 126          2HE       LYS 126  -0.079  -1.186  -8.516
  171    HZ1  LYS 126          1HZ       LYS 126   1.215  -0.266 -10.380
  172    HZ2  LYS 126          2HZ       LYS 126   2.515  -1.166  -9.973
  173    HZ3  LYS 126          3HZ       LYS 126   1.962   0.020  -8.974
  174    H    HIS 127           H        HIS 127  -0.191  -7.267  -6.513
  175    HA   HIS 127           HA       HIS 127  -2.523  -6.887  -8.057
  176    HB2  HIS 127          1HB       HIS 127  -0.776  -8.636  -8.369
  177    HB3  HIS 127          2HB       HIS 127  -1.383  -9.485  -6.945
  178    HD2  HIS 127          2HD       HIS 127  -2.192  -8.680 -10.585
  179    HE1  HIS 127          1HE       HIS 127  -5.101 -11.557  -9.356
  180    HE2  HIS 127          2HE       HIS 127  -4.163 -10.277 -11.351
  181    H    TYR 128           H        TYR 128  -2.251  -8.325  -4.755
  182    HA   TYR 128           HA       TYR 128  -5.038  -8.836  -4.518
  183    HB2  TYR 128          1HB       TYR 128  -3.607 -10.027  -3.096
  184    HB3  TYR 128          2HB       TYR 128  -2.879  -8.558  -2.455
  185    HD1  TYR 128          1HD       TYR 128  -5.825 -10.756  -2.332
  186    HD2  TYR 128          2HD       TYR 128  -4.036  -7.144  -0.787
  187    HE1  TYR 128          1HE       TYR 128  -7.556 -10.658  -0.539
  188    HE2  TYR 128          2HE       TYR 128  -5.768  -7.044   0.983
  189    HH   TYR 128           HH       TYR 128  -7.753  -7.938   1.752
  190    H    PHE 129           H        PHE 129  -3.226  -5.928  -3.451
  191    HA   PHE 129           HA       PHE 129  -5.644  -4.716  -2.494
  192    HB2  PHE 129          1HB       PHE 129  -2.870  -3.642  -2.789
  193    HB3  PHE 129          2HB       PHE 129  -4.223  -2.623  -2.324
  194    HD1  PHE 129          1HD       PHE 129  -1.713  -4.780  -1.057
  195    HD2  PHE 129          2HD       PHE 129  -5.763  -3.515  -0.339
  196    HE1  PHE 129          1HE       PHE 129  -1.558  -5.607   1.278
  197    HE2  PHE 129          2HE       PHE 129  -5.595  -4.350   2.000
  198    HZ   PHE 129           HZ       PHE 129  -3.498  -5.386   2.810
  199    H    GLU 130           H        GLU 130  -4.279  -4.635  -5.682
  200    HA   GLU 130           HA       GLU 130  -5.726  -2.449  -6.750
  201    HB2  GLU 130          1HB       GLU 130  -4.615  -4.998  -7.917
  202    HB3  GLU 130          2HB       GLU 130  -5.611  -3.926  -8.910
  203    HG2  GLU 130          1HG       GLU 130  -4.141  -2.021  -8.416
  204    HG3  GLU 130          2HG       GLU 130  -3.097  -3.064  -7.454
  205    H    GLN 131           H        GLN 131  -7.050  -5.451  -5.657
  206    HA   GLN 131           HA       GLN 131  -9.412  -5.660  -7.248
  207    HB2  GLN 131          1HB       GLN 131  -8.878  -6.362  -4.317
  208    HB3  GLN 131          2HB       GLN 131 -10.296  -6.882  -5.242
  209    HG2  GLN 131          1HG       GLN 131  -8.842  -7.964  -6.877
  210    HG3  GLN 131          2HG       GLN 131  -7.404  -7.567  -5.949
  211   HE21  GLN 131          1HE2      GLN 131  -7.484  -8.281  -3.558
  212   HE22  GLN 131          2HE2      GLN 131  -8.244  -9.837  -3.217
  213    H    PHE 132           H        PHE 132  -8.780  -3.961  -4.263
  214    HA   PHE 132           HA       PHE 132 -11.432  -2.861  -3.878
  215    HB2  PHE 132          1HB       PHE 132  -8.769  -1.924  -2.729
  216    HB3  PHE 132          2HB       PHE 132 -10.365  -1.486  -2.137
  217    HD1  PHE 132          1HD       PHE 132  -7.667  -3.754  -1.765
  218    HD2  PHE 132          2HD       PHE 132 -11.960  -3.535  -1.509
  219    HE1  PHE 132          1HE       PHE 132  -7.681  -5.789  -0.341
  220    HE2  PHE 132          2HE       PHE 132 -11.978  -5.608  -0.137
  221    HZ   PHE 132           HZ       PHE 132  -9.838  -6.732   0.457
  222    H    GLY 133           H        GLY 133  -8.529  -1.617  -5.418
  223    HA2  GLY 133          1HA       GLY 133  -9.650   0.055  -7.309
  224    HA3  GLY 133          2HA       GLY 133  -9.389   1.092  -5.902
  225    H    LYS 134           H        LYS 134  -7.982   1.647  -8.195
  226    HA   LYS 134           HA       LYS 134  -5.700   0.151  -8.722
  227    HB2  LYS 134          1HB       LYS 134  -6.648   1.746 -10.297
  228    HB3  LYS 134          2HB       LYS 134  -6.236   3.090  -9.243
  229    HG2  LYS 134          1HG       LYS 134  -4.673   3.031 -11.047
  230    HG3  LYS 134          2HG       LYS 134  -3.801   2.602  -9.584
  231    HD2  LYS 134          1HD       LYS 134  -4.003   0.166 -10.238
  232    HD3  LYS 134          2HD       LYS 134  -4.803   0.659 -11.730
  233    HE2  LYS 134          1HE       LYS 134  -1.983   1.460 -10.866
  234    HE3  LYS 134          2HE       LYS 134  -2.362   0.127 -11.957
  235    HZ1  LYS 134          1HZ       LYS 134  -2.953   2.991 -12.504
  236    HZ2  LYS 134          2HZ       LYS 134  -3.350   1.750 -13.496
  237    HZ3  LYS 134          3HZ       LYS 134  -1.785   2.101 -13.213
  238    H    VAL 135           H        VAL 135  -3.705   0.070  -8.176
  239    HA   VAL 135           HA       VAL 135  -2.666   1.552  -5.788
  240    HB   VAL 135           HB       VAL 135  -1.976  -1.169  -6.934
  241   HG11  VAL 135          1HG1      VAL 135  -0.483  -1.461  -4.990
  242   HG12  VAL 135          2HG1      VAL 135   0.089  -0.180  -6.060
  243   HG13  VAL 135          3HG1      VAL 135  -0.737   0.231  -4.543
  244   HG21  VAL 135          1HG2      VAL 135  -3.186  -0.379  -4.248
  245   HG22  VAL 135          2HG2      VAL 135  -4.089  -1.083  -5.600
  246   HG23  VAL 135          3HG2      VAL 135  -2.829  -2.031  -4.799
  247    H    ASP 136           H        ASP 136  -0.962   2.833  -6.070
  248    HA   ASP 136           HA       ASP 136   0.195   3.330  -8.716
  249    HB2  ASP 136          1HB       ASP 136  -0.250   5.213  -7.263
  250    HB3  ASP 136          2HB       ASP 136   0.668   4.484  -5.953
  251    H    ASP 137           H        ASP 137   1.467   2.206  -5.540
  252    HA   ASP 137           HA       ASP 137   3.602   0.624  -6.844
  253    HB2  ASP 137          1HB       ASP 137   4.300   3.105  -6.708
  254    HB3  ASP 137          2HB       ASP 137   4.228   2.943  -4.955
  255    H    ALA 138           H        ALA 138   4.900  -0.525  -5.209
  256    HA   ALA 138           HA       ALA 138   3.917  -0.704  -2.469
  257    HB1  ALA 138          1HB       ALA 138   3.515  -3.158  -2.579
  258    HB2  ALA 138          2HB       ALA 138   2.379  -2.258  -3.599
  259    HB3  ALA 138          3HB       ALA 138   3.749  -3.113  -4.340
  260    H    MET 139           H        MET 139   5.411  -1.764  -1.053
  261    HA   MET 139           HA       MET 139   7.959  -2.794  -2.117
  262    HB2  MET 139          1HB       MET 139   9.335  -1.176  -0.891
  263    HB3  MET 139          2HB       MET 139   8.465  -0.471  -2.246
  264    HG2  MET 139          1HG       MET 139   6.810   0.509  -0.673
  265    HG3  MET 139          2HG       MET 139   7.692  -0.195   0.684
  266    HE1  MET 139          1HE       MET 139   7.014   2.753   0.872
  267    HE2  MET 139          2HE       MET 139   8.117   1.968   2.030
  268    HE3  MET 139          3HE       MET 139   8.569   3.512   1.279
  269    H    LEU 140           H        LEU 140   8.845  -4.310  -0.824
  270    HA   LEU 140           HA       LEU 140   7.791  -4.631   1.959
  271    HB2  LEU 140          1HB       LEU 140   9.236  -6.684   0.258
  272    HB3  LEU 140          2HB       LEU 140   8.537  -6.923   1.858
  273    HG   LEU 140           HG       LEU 140   7.034  -6.415  -0.742
  274   HD11  LEU 140          1HD1      LEU 140   7.886  -8.713  -0.395
  275   HD12  LEU 140          2HD1      LEU 140   6.114  -8.654  -0.320
  276   HD13  LEU 140          3HD1      LEU 140   7.060  -8.778   1.177
  277   HD21  LEU 140          1HD2      LEU 140   4.967  -6.794   0.636
  278   HD22  LEU 140          2HD2      LEU 140   5.770  -5.262   0.952
  279   HD23  LEU 140          3HD2      LEU 140   5.968  -6.611   2.098
  280    H    MET 141           H        MET 141   9.134  -4.639   3.711
  281    HA   MET 141           HA       MET 141  11.738  -3.326   3.237
  282    HB2  MET 141          1HB       MET 141  10.174  -3.840   5.779
  283    HB3  MET 141          2HB       MET 141  11.721  -2.993   5.699
  284    HG2  MET 141          1HG       MET 141   9.098  -2.104   4.453
  285    HG3  MET 141          2HG       MET 141   9.935  -1.397   5.824
  286    HE1  MET 141          1HE       MET 141  10.308  -0.146   1.546
  287    HE2  MET 141          2HE       MET 141  10.279  -1.898   1.806
  288    HE3  MET 141          3HE       MET 141   8.959  -0.886   2.436
  289    H    PHE 142           H        PHE 142  13.604  -4.302   3.208
  290    HA   PHE 142           HA       PHE 142  13.808  -7.070   4.091
  291    HB2  PHE 142          1HB       PHE 142  15.440  -5.521   2.189
  292    HB3  PHE 142          2HB       PHE 142  16.120  -6.927   2.983
  293    HD1  PHE 142          1HD       PHE 142  13.020  -5.898   1.086
  294    HD2  PHE 142          2HD       PHE 142  15.753  -9.073   2.110
  295    HE1  PHE 142          1HE       PHE 142  11.819  -7.425  -0.453
  296    HE2  PHE 142          2HE       PHE 142  14.551 -10.599   0.562
  297    HZ   PHE 142           HZ       PHE 142  12.577  -9.782  -0.713
  298    H    ASP 143           H        ASP 143  15.256  -8.097   5.315
  299    HA   ASP 143           HA       ASP 143  16.188  -6.759   7.716
  300    HB2  ASP 143          1HB       ASP 143  15.358  -9.094   7.626
  301    HB3  ASP 143          2HB       ASP 143  16.664  -9.525   6.519
  302    H    LYS 144           H        LYS 144  18.244  -6.107   8.130
  303    HA   LYS 144           HA       LYS 144  19.701  -5.148   5.883
  304    HB2  LYS 144          1HB       LYS 144  20.538  -5.197   8.825
  305    HB3  LYS 144          2HB       LYS 144  21.299  -4.205   7.588
  306    HG2  LYS 144          1HG       LYS 144  18.396  -3.938   8.493
  307    HG3  LYS 144          2HG       LYS 144  19.746  -2.934   9.019
  308    HD2  LYS 144          1HD       LYS 144  20.102  -2.167   6.678
  309    HD3  LYS 144          2HD       LYS 144  18.693  -3.123   6.157
  310    HE2  LYS 144          1HE       LYS 144  17.222  -1.857   7.642
  311    HE3  LYS 144          2HE       LYS 144  18.594  -0.965   8.311
  312    HZ1  LYS 144          1HZ       LYS 144  17.366   0.271   6.612
  313    HZ2  LYS 144          2HZ       LYS 144  17.753  -0.843   5.465
  314    HZ3  LYS 144          3HZ       LYS 144  18.936   0.061   6.160
  315    H    THR 145           H        THR 145  20.215  -8.116   7.503
  316    HA   THR 145           HA       THR 145  22.818  -8.607   6.398
  317    HB   THR 145           HB       THR 145  20.982 -10.885   6.871
  318    HG1  THR 145          1HG       THR 145  21.191 -10.696   9.068
  319   HG21  THR 145          1HG2      THR 145  23.840 -10.294   7.775
  320   HG22  THR 145          2HG2      THR 145  23.386 -11.318   6.397
  321   HG23  THR 145          3HG2      THR 145  22.961 -11.818   8.037
  322    H    THR 146           H        THR 146  20.074  -8.039   4.731
  323    HA   THR 146           HA       THR 146  19.228  -8.377   2.773
  324    HB   THR 146           HB       THR 146  20.300  -8.391   0.837
  325    HG1  THR 146          1HG       THR 146  22.261  -9.355   0.424
  326   HG21  THR 146          1HG2      THR 146  22.311  -7.061   1.028
  327   HG22  THR 146          2HG2      THR 146  22.589  -7.607   2.695
  328   HG23  THR 146          3HG2      THR 146  21.193  -6.573   2.311
  329    H    ASN 147           H        ASN 147  19.111 -10.374   4.737
  330    HA   ASN 147           HA       ASN 147  19.188 -12.991   3.477
  331    HB2  ASN 147          1HB       ASN 147  19.796 -12.552   5.829
  332    HB3  ASN 147          2HB       ASN 147  18.136 -12.078   6.190
  333   HD21  ASN 147          1HD2      ASN 147  18.123 -13.735   7.840
  334   HD22  ASN 147          2HD2      ASN 147  17.956 -15.423   7.380
  335    H    ARG 148           H        ARG 148  16.447 -11.013   4.655
  336    HA   ARG 148           HA       ARG 148  14.488 -12.176   2.837
  337    HB2  ARG 148          1HB       ARG 148  13.041 -13.059   4.766
  338    HB3  ARG 148          2HB       ARG 148  14.401 -14.027   4.251
  339    HG2  ARG 148          1HG       ARG 148  14.311 -14.179   6.604
  340    HG3  ARG 148          2HG       ARG 148  15.724 -13.236   6.196
  341    HD2  ARG 148          1HD       ARG 148  14.114 -11.170   6.676
  342    HD3  ARG 148          2HD       ARG 148  13.160 -12.366   7.537
  343    HE   ARG 148           HE       ARG 148  15.920 -11.391   8.158
  344   HH11  ARG 148          1HH1      ARG 148  13.344 -13.508   9.302
  345   HH12  ARG 148          2HH1      ARG 148  14.050 -13.557  10.904
  346   HH21  ARG 148          1HH2      ARG 148  16.708 -11.511  10.033
  347   HH22  ARG 148          2HH2      ARG 148  15.989 -12.482  11.315
  348    H    HIS 149           H        HIS 149  12.231 -11.295   3.325
  349    HA   HIS 149           HA       HIS 149  12.458  -8.505   4.276
  350    HB2  HIS 149          1HB       HIS 149  10.293  -8.095   3.502
  351    HB3  HIS 149          2HB       HIS 149  11.174  -8.934   2.242
  352    HD2  HIS 149          2HD       HIS 149   9.828 -10.766   1.076
  353    HE1  HIS 149          1HE       HIS 149   6.718 -11.293   3.935
  354    HE2  HIS 149          2HE       HIS 149   7.523 -11.900   1.585
  355    H    ARG 150           H        ARG 150  11.249  -7.632   5.965
  356    HA   ARG 150           HA       ARG 150  11.163  -9.380   8.320
  357    HB2  ARG 150          1HB       ARG 150  11.063  -6.417   7.810
  358    HB3  ARG 150          2HB       ARG 150  10.522  -7.028   9.377
  359    HG2  ARG 150          1HG       ARG 150  12.610  -8.100   9.832
  360    HG3  ARG 150          2HG       ARG 150  13.245  -7.713   8.227
  361    HD2  ARG 150          1HD       ARG 150  12.334  -5.567  10.197
  362    HD3  ARG 150          2HD       ARG 150  13.981  -6.214  10.188
  363    HE   ARG 150           HE       ARG 150  13.774  -5.570   7.612
  364   HH11  ARG 150          1HH1      ARG 150  12.734  -3.389  10.246
  365   HH12  ARG 150          2HH1      ARG 150  13.247  -2.022   9.276
  366   HH21  ARG 150          1HH2      ARG 150  14.568  -3.756   6.727
  367   HH22  ARG 150          2HH2      ARG 150  14.178  -2.206   7.494
  368    H    GLY 151           H        GLY 151   8.987  -9.689   6.200
  369    HA2  GLY 151          1HA       GLY 151   6.796 -10.372   6.273
  370    HA3  GLY 151          2HA       GLY 151   6.866 -10.313   8.033
  371    H    PHE 152           H        PHE 152   7.545  -7.369   6.184
  372    HA   PHE 152           HA       PHE 152   4.770  -6.471   6.270
  373    HB2  PHE 152          1HB       PHE 152   5.017  -4.681   7.767
  374    HB3  PHE 152          2HB       PHE 152   5.754  -6.023   8.598
  375    HD1  PHE 152          1HD       PHE 152   8.254  -6.054   8.937
  376    HD2  PHE 152          2HD       PHE 152   6.260  -2.751   7.023
  377    HE1  PHE 152          1HE       PHE 152  10.291  -4.640   9.233
  378    HE2  PHE 152          2HE       PHE 152   8.258  -1.337   7.374
  379    HZ   PHE 152           HZ       PHE 152  10.293  -2.298   8.444
  380    H    GLY 153           H        GLY 153   4.558  -4.347   5.274
  381    HA2  GLY 153          1HA       GLY 153   6.756  -3.013   3.947
  382    HA3  GLY 153          2HA       GLY 153   5.804  -3.984   2.819
  383    H    PHE 154           H        PHE 154   5.580  -1.804   1.911
  384    HA   PHE 154           HA       PHE 154   3.195  -0.392   2.982
  385    HB2  PHE 154          1HB       PHE 154   5.639   0.803   1.663
  386    HB3  PHE 154          2HB       PHE 154   4.148   1.678   1.985
  387    HD1  PHE 154          1HD       PHE 154   7.175   0.247   3.478
  388    HD2  PHE 154          2HD       PHE 154   3.388   2.124   4.317
  389    HE1  PHE 154          1HE       PHE 154   7.908   0.670   5.802
  390    HE2  PHE 154          2HE       PHE 154   4.127   2.564   6.641
  391    HZ   PHE 154           HZ       PHE 154   6.385   1.825   7.397
  392    H    VAL 155           H        VAL 155   1.702   0.485   1.594
  393    HA   VAL 155           HA       VAL 155   1.949  -0.080  -1.314
  394    HB   VAL 155           HB       VAL 155  -0.589  -0.706   0.214
  395   HG11  VAL 155          1HG1      VAL 155  -1.279  -1.762  -1.909
  396   HG12  VAL 155          2HG1      VAL 155  -0.986  -0.037  -2.114
  397   HG13  VAL 155          3HG1      VAL 155   0.231  -1.212  -2.669
  398   HG21  VAL 155          1HG2      VAL 155   1.440  -2.655  -0.935
  399   HG22  VAL 155          2HG2      VAL 155   1.090  -2.407   0.790
  400   HG23  VAL 155          3HG2      VAL 155  -0.158  -3.063  -0.262
  401    H    THR 156           H        THR 156   1.415   1.560  -2.553
  402    HA   THR 156           HA       THR 156   0.063   3.910  -1.356
  403    HB   THR 156           HB       THR 156   1.876   4.189  -3.718
  404    HG1  THR 156          1HG       THR 156   3.147   3.285  -2.152
  405   HG21  THR 156          1HG2      THR 156   0.998   6.082  -1.491
  406   HG22  THR 156          2HG2      THR 156   0.440   6.114  -3.183
  407   HG23  THR 156          3HG2      THR 156   2.129   6.476  -2.803
  408    H    PHE 157           H        PHE 157  -1.670   4.855  -2.259
  409    HA   PHE 157           HA       PHE 157  -2.950   3.319  -4.411
  410    HB2  PHE 157          1HB       PHE 157  -4.012   4.826  -2.043
  411    HB3  PHE 157          2HB       PHE 157  -5.044   4.249  -3.341
  412    HD1  PHE 157          1HD       PHE 157  -5.687   1.953  -3.530
  413    HD2  PHE 157          2HD       PHE 157  -2.628   3.104  -0.723
  414    HE1  PHE 157          1HE       PHE 157  -5.799  -0.291  -2.475
  415    HE2  PHE 157          2HE       PHE 157  -2.682   0.845   0.259
  416    HZ   PHE 157           HZ       PHE 157  -4.274  -0.863  -0.592
  417    H    GLU 158           H        GLU 158  -4.485   4.195  -5.824
  418    HA   GLU 158           HA       GLU 158  -3.677   6.632  -7.171
  419    HB2  GLU 158          1HB       GLU 158  -4.652   4.743  -8.367
  420    HB3  GLU 158          2HB       GLU 158  -6.119   4.843  -7.400
  421    HG2  GLU 158          1HG       GLU 158  -6.570   5.706  -9.575
  422    HG3  GLU 158          2HG       GLU 158  -6.693   7.013  -8.412
  423    H    SER 159           H        SER 159  -6.196   5.926  -4.748
  424    HA   SER 159           HA       SER 159  -6.637   8.843  -4.384
  425    HB2  SER 159          1HB       SER 159  -8.417   8.081  -5.902
  426    HB3  SER 159          2HB       SER 159  -8.845   6.797  -4.757
  427    HG   SER 159           HG       SER 159  -9.194   9.593  -4.529
  428    H    GLU 160           H        GLU 160  -7.237   9.486  -2.339
  429    HA   GLU 160           HA       GLU 160  -6.569   7.899  -0.044
  430    HB2  GLU 160          1HB       GLU 160  -8.406  10.343  -0.222
  431    HB3  GLU 160          2HB       GLU 160  -7.647   9.678   1.216
  432    HG2  GLU 160          1HG       GLU 160  -6.324  11.461   0.806
  433    HG3  GLU 160          2HG       GLU 160  -5.401  10.145   0.092
  434    H    ASP 161           H        ASP 161  -9.537   8.373  -1.875
  435    HA   ASP 161           HA       ASP 161 -11.389   7.233  -0.018
  436    HB2  ASP 161          1HB       ASP 161 -11.467   7.427  -3.035
  437    HB3  ASP 161          2HB       ASP 161 -12.753   6.694  -2.090
  438    H    ILE 162           H        ILE 162  -9.186   5.586  -2.249
  439    HA   ILE 162           HA       ILE 162 -10.330   2.953  -1.657
  440    HB   ILE 162           HB       ILE 162  -7.556   3.485  -2.749
  441   HG12  ILE 162          1HG1      ILE 162  -8.967   4.573  -4.315
  442   HG13  ILE 162          2HG1      ILE 162  -8.487   3.018  -4.978
  443   HG21  ILE 162          1HG2      ILE 162  -7.916   1.176  -3.719
  444   HG22  ILE 162          2HG2      ILE 162  -7.850   1.221  -1.962
  445   HG23  ILE 162          3HG2      ILE 162  -9.415   1.060  -2.775
  446   HD11  ILE 162          1HD1      ILE 162 -10.758   2.097  -4.324
  447   HD12  ILE 162          2HD1      ILE 162 -11.216   3.734  -3.814
  448   HD13  ILE 162          3HD1      ILE 162 -10.817   3.419  -5.509
  449    H    VAL 163           H        VAL 163  -7.606   4.943  -0.409
  450    HA   VAL 163           HA       VAL 163  -6.522   2.970   1.319
  451    HB   VAL 163           HB       VAL 163  -6.688   6.006   1.712
  452   HG11  VAL 163          1HG1      VAL 163  -5.092   3.958   3.259
  453   HG12  VAL 163          2HG1      VAL 163  -4.734   5.699   3.263
  454   HG13  VAL 163          3HG1      VAL 163  -6.268   5.111   3.906
  455   HG21  VAL 163          1HG2      VAL 163  -4.350   5.947   0.962
  456   HG22  VAL 163          2HG2      VAL 163  -4.480   4.201   0.675
  457   HG23  VAL 163          3HG2      VAL 163  -5.454   5.347  -0.281
  458    H    GLU 164           H        GLU 164  -9.180   5.336   1.920
  459    HA   GLU 164           HA       GLU 164  -9.840   4.399   4.557
  460    HB2  GLU 164          1HB       GLU 164 -11.593   5.685   2.429
  461    HB3  GLU 164          2HB       GLU 164 -12.096   5.417   4.091
  462    HG2  GLU 164          1HG       GLU 164  -9.779   7.189   3.211
  463    HG3  GLU 164          2HG       GLU 164 -11.388   7.741   3.650
  464    H    LYS 165           H        LYS 165 -11.218   3.402   1.387
  465    HA   LYS 165           HA       LYS 165 -13.103   1.500   2.290
  466    HB2  LYS 165          1HB       LYS 165 -12.885   2.402   0.004
  467    HB3  LYS 165          2HB       LYS 165 -11.373   1.535  -0.218
  468    HG2  LYS 165          1HG       LYS 165 -12.545  -0.632  -0.072
  469    HG3  LYS 165          2HG       LYS 165 -14.086   0.225   0.172
  470    HD2  LYS 165          1HD       LYS 165 -13.789   1.361  -2.025
  471    HD3  LYS 165          2HD       LYS 165 -12.250   0.510  -2.258
  472    HE2  LYS 165          1HE       LYS 165 -13.451  -1.666  -2.194
  473    HE3  LYS 165          2HE       LYS 165 -14.985  -0.813  -1.970
  474    HZ1  LYS 165          1HZ       LYS 165 -14.650   0.241  -4.137
  475    HZ2  LYS 165          2HZ       LYS 165 -14.595  -1.379  -4.314
  476    HZ3  LYS 165          3HZ       LYS 165 -13.206  -0.507  -4.341
  477    H    VAL 166           H        VAL 166  -9.712   0.986   1.462
  478    HA   VAL 166           HA       VAL 166  -9.560  -1.834   2.105
  479    HB   VAL 166           HB       VAL 166  -7.405   0.298   1.912
  480   HG11  VAL 166          1HG1      VAL 166  -6.503  -1.655   3.085
  481   HG12  VAL 166          2HG1      VAL 166  -7.164  -2.719   1.819
  482   HG13  VAL 166          3HG1      VAL 166  -5.860  -1.574   1.443
  483   HG21  VAL 166          1HG2      VAL 166  -8.115  -1.763  -0.195
  484   HG22  VAL 166          2HG2      VAL 166  -8.808  -0.145  -0.220
  485   HG23  VAL 166          3HG2      VAL 166  -7.068  -0.332  -0.340
  486    H    CYS 167           H        CYS 167  -8.636   1.126   3.940
  487    HA   CYS 167           HA       CYS 167  -7.556  -0.275   6.175
  488    HB2  CYS 167          1HB       CYS 167  -7.009   2.053   5.565
  489    HB3  CYS 167          2HB       CYS 167  -8.661   2.554   5.966
  490    HG   CYS 167           HG       CYS 167  -6.319   1.243   7.923
  491    H    GLU 168           H        GLU 168 -10.900   0.920   5.619
  492    HA   GLU 168           HA       GLU 168 -11.915   0.292   8.220
  493    HB2  GLU 168          1HB       GLU 168 -13.190   0.573   5.485
  494    HB3  GLU 168          2HB       GLU 168 -14.153   0.178   6.897
  495    HG2  GLU 168          1HG       GLU 168 -12.376   2.649   6.719
  496    HG3  GLU 168          2HG       GLU 168 -14.081   2.619   6.277
  497    H    ILE 169           H        ILE 169 -11.157  -1.884   5.582
  498    HA   ILE 169           HA       ILE 169 -12.713  -4.144   6.598
  499    HB   ILE 169           HB       ILE 169 -10.391  -3.936   4.663
  500   HG12  ILE 169          1HG1      ILE 169 -13.325  -4.613   4.117
  501   HG13  ILE 169          2HG1      ILE 169 -12.728  -2.961   4.072
  502   HG21  ILE 169          1HG2      ILE 169 -10.915  -6.278   3.986
  503   HG22  ILE 169          2HG2      ILE 169 -10.301  -6.166   5.619
  504   HG23  ILE 169          3HG2      ILE 169 -12.044  -6.399   5.354
  505   HD11  ILE 169          1HD1      ILE 169 -11.095  -3.580   2.302
  506   HD12  ILE 169          2HD1      ILE 169 -11.814  -5.208   2.256
  507   HD13  ILE 169          3HD1      ILE 169 -12.790  -3.794   1.829
  508    H    HIS 170           H        HIS 170  -9.497  -2.859   7.105
  509    HA   HIS 170           HA       HIS 170  -7.946  -3.032   8.696
  510    HB2  HIS 170          1HB       HIS 170  -9.926  -2.758  10.144
  511    HB3  HIS 170          2HB       HIS 170 -10.008  -4.503  10.346
  512    HD2  HIS 170          2HD       HIS 170  -6.451  -3.103  10.442
  513    HE1  HIS 170          1HE       HIS 170  -7.606  -3.711  14.496
  514    HE2  HIS 170          2HE       HIS 170  -5.643  -3.241  12.933
  515    H    PHE 171           H        PHE 171  -9.507  -6.230   8.513
  516    HA   PHE 171           HA       PHE 171  -6.809  -7.420   8.312
  517    HB2  PHE 171          1HB       PHE 171  -9.131  -8.542   9.777
  518    HB3  PHE 171          2HB       PHE 171  -7.880  -9.577   9.108
  519    HD1  PHE 171          1HD       PHE 171  -5.568  -9.529   9.904
  520    HD2  PHE 171          2HD       PHE 171  -8.562  -6.947  11.623
  521    HE1  PHE 171          1HE       PHE 171  -4.062  -9.060  11.824
  522    HE2  PHE 171          2HE       PHE 171  -7.049  -6.469  13.533
  523    HZ   PHE 171           HZ       PHE 171  -4.795  -7.523  13.635
  524    H    HIS 172           H        HIS 172  -6.110  -8.414   6.721
  525    HA   HIS 172           HA       HIS 172  -7.878  -9.019   4.374
  526    HB2  HIS 172          1HB       HIS 172  -5.237  -7.532   4.624
  527    HB3  HIS 172          2HB       HIS 172  -5.821  -8.158   3.099
  528    HD2  HIS 172          2HD       HIS 172  -6.710  -5.483   5.775
  529    HE1  HIS 172          1HE       HIS 172  -8.850  -4.445   2.263
  530    HE2  HIS 172          2HE       HIS 172  -8.212  -3.694   4.574
  531    H    GLU 173           H        GLU 173  -6.609 -10.464   2.716
  532    HA   GLU 173           HA       GLU 173  -4.835 -12.399   4.118
  533    HB2  GLU 173          1HB       GLU 173  -7.129 -13.139   4.521
  534    HB3  GLU 173          2HB       GLU 173  -7.438 -13.175   2.777
  535    HG2  GLU 173          1HG       GLU 173  -5.694 -14.926   2.509
  536    HG3  GLU 173          2HG       GLU 173  -5.359 -14.856   4.241
  537    H    ILE 174           H        ILE 174  -3.154 -12.950   2.973
  538    HA   ILE 174           HA       ILE 174  -3.203 -12.856  -0.012
  539    HB   ILE 174           HB       ILE 174  -0.997 -11.616   1.676
  540   HG12  ILE 174          1HG1      ILE 174  -3.338 -10.249   0.301
  541   HG13  ILE 174          2HG1      ILE 174  -2.960 -10.241   2.022
  542   HG21  ILE 174          1HG2      ILE 174  -0.191 -10.745  -0.478
  543   HG22  ILE 174          2HG2      ILE 174  -0.340 -12.491  -0.577
  544   HG23  ILE 174          3HG2      ILE 174  -1.585 -11.457  -1.321
  545   HD11  ILE 174          1HD1      ILE 174  -0.850  -8.981   1.514
  546   HD12  ILE 174          2HD1      ILE 174  -1.432  -8.814  -0.163
  547   HD13  ILE 174          3HD1      ILE 174  -2.360  -8.117   1.171
  548    H    ASN 175           H        ASN 175  -2.207 -14.587  -0.915
  549    HA   ASN 175           HA       ASN 175  -1.478 -16.734  -1.008
  550    HB2  ASN 175          1HB       ASN 175   0.796 -15.551   0.615
  551    HB3  ASN 175          2HB       ASN 175   0.858 -17.111  -0.195
  552   HD21  ASN 175          1HD2      ASN 175   2.361 -14.546  -0.566
  553   HD22  ASN 175          2HD2      ASN 175   2.325 -14.314  -2.319
  554    H    ASN 176           H        ASN 176  -3.464 -16.505   0.810
  555    HA   ASN 176           HA       ASN 176  -4.582 -17.434   2.486
  556    HB2  ASN 176          1HB       ASN 176  -2.594 -19.709   2.248
  557    HB3  ASN 176          2HB       ASN 176  -4.141 -19.784   3.079
  558   HD21  ASN 176          1HD2      ASN 176  -3.367 -21.490   0.919
  559   HD22  ASN 176          2HD2      ASN 176  -4.513 -21.174  -0.378
  560    H    LYS 177           H        LYS 177  -1.903 -15.884   3.231
  561    HA   LYS 177           HA       LYS 177  -2.066 -16.449   6.160
  562    HB2  LYS 177          1HB       LYS 177   0.205 -16.422   5.258
  563    HB3  LYS 177          2HB       LYS 177  -0.061 -14.839   4.529
  564    HG2  LYS 177          1HG       LYS 177   1.287 -14.658   6.538
  565    HG3  LYS 177          2HG       LYS 177  -0.245 -13.810   6.754
  566    HD2  LYS 177          1HD       LYS 177  -1.115 -15.686   8.122
  567    HD3  LYS 177          2HD       LYS 177   0.315 -16.648   7.748
  568    HE2  LYS 177          1HE       LYS 177   0.434 -15.742  10.000
  569    HE3  LYS 177          2HE       LYS 177   1.741 -15.119   8.983
  570    HZ1  LYS 177          1HZ       LYS 177   0.646 -13.038   8.811
  571    HZ2  LYS 177          2HZ       LYS 177   0.582 -13.415  10.399
  572    HZ3  LYS 177          3HZ       LYS 177  -0.755 -13.560   9.453
  573    H    MET 178           H        MET 178  -2.990 -14.983   7.542
  574    HA   MET 178           HA       MET 178  -4.497 -12.762   6.365
  575    HB2  MET 178          1HB       MET 178  -5.737 -14.135   7.825
  576    HB3  MET 178          2HB       MET 178  -4.524 -14.044   9.105
  577    HG2  MET 178          1HG       MET 178  -5.085 -11.884   9.710
  578    HG3  MET 178          2HG       MET 178  -5.761 -11.476   8.137
  579    HE1  MET 178          1HE       MET 178  -7.917 -13.369   7.291
  580    HE2  MET 178          2HE       MET 178  -9.340 -12.684   8.105
  581    HE3  MET 178          3HE       MET 178  -8.113 -11.606   7.404
  582    H    VAL 179           H        VAL 179  -4.127 -10.662   6.697
  583    HA   VAL 179           HA       VAL 179  -1.742  -9.813   8.231
  584    HB   VAL 179           HB       VAL 179  -0.963  -8.404   6.431
  585   HG11  VAL 179          1HG1      VAL 179  -1.416 -11.178   5.284
  586   HG12  VAL 179          2HG1      VAL 179  -0.087 -10.040   4.963
  587   HG13  VAL 179          3HG1      VAL 179  -0.242 -10.782   6.563
  588   HG21  VAL 179          1HG2      VAL 179  -1.857  -8.534   4.137
  589   HG22  VAL 179          2HG2      VAL 179  -3.230  -9.493   4.725
  590   HG23  VAL 179          3HG2      VAL 179  -3.007  -7.808   5.263
  591    H    GLU 180           H        GLU 180  -1.626  -7.521   8.648
  592    HA   GLU 180           HA       GLU 180  -4.347  -6.287   9.007
  593    HB2  GLU 180          1HB       GLU 180  -3.044  -6.847  11.068
  594    HB3  GLU 180          2HB       GLU 180  -1.795  -5.709  10.541
  595    HG2  GLU 180          1HG       GLU 180  -3.492  -3.878  10.556
  596    HG3  GLU 180          2HG       GLU 180  -4.716  -5.034  11.087
  597    H    CYS 181           H        CYS 181  -4.841  -4.427   7.945
  598    HA   CYS 181           HA       CYS 181  -2.660  -2.836   6.680
  599    HB2  CYS 181          1HB       CYS 181  -4.420  -1.597   5.543
  600    HB3  CYS 181          2HB       CYS 181  -4.487  -3.319   5.159
  601    HG   CYS 181           HG       CYS 181  -6.906  -2.261   5.318
  602    H    LYS 182           H        LYS 182  -2.102  -0.851   7.383
  603    HA   LYS 182           HA       LYS 182  -3.740   0.557   9.446
  604    HB2  LYS 182          1HB       LYS 182  -0.731   0.199   9.744
  605    HB3  LYS 182          2HB       LYS 182  -1.833   0.999  10.862
  606    HG2  LYS 182          1HG       LYS 182  -2.959  -1.223  11.246
  607    HG3  LYS 182          2HG       LYS 182  -1.717  -1.984  10.235
  608    HD2  LYS 182          1HD       LYS 182  -1.178  -0.478  12.828
  609    HD3  LYS 182          2HD       LYS 182  -1.295  -2.236  12.656
  610    HE2  LYS 182          1HE       LYS 182   0.570  -2.150  10.973
  611    HE3  LYS 182          2HE       LYS 182   0.774  -0.432  11.332
  612    HZ1  LYS 182          1HZ       LYS 182   1.086  -1.245  13.733
  613    HZ2  LYS 182          2HZ       LYS 182   2.302  -1.531  12.686
  614    HZ3  LYS 182          3HZ       LYS 182   1.270  -2.753  13.087
  615    H    LYS 183           H        LYS 183  -3.543   2.854   9.337
  616    HA   LYS 183           HA       LYS 183  -2.583   3.983   6.837
  617    HB2  LYS 183          1HB       LYS 183  -3.557   5.194   9.438
  618    HB3  LYS 183          2HB       LYS 183  -2.870   6.198   8.153
  619    HG2  LYS 183          1HG       LYS 183  -4.513   5.454   6.544
  620    HG3  LYS 183          2HG       LYS 183  -5.182   4.268   7.674
  621    HD2  LYS 183          1HD       LYS 183  -5.943   6.051   9.175
  622    HD3  LYS 183          2HD       LYS 183  -5.168   7.282   8.151
  623    HE2  LYS 183          1HE       LYS 183  -6.627   6.645   6.260
  624    HE3  LYS 183          2HE       LYS 183  -7.409   5.408   7.254
  625    HZ1  LYS 183          1HZ       LYS 183  -7.431   8.303   7.920
  626    HZ2  LYS 183          2HZ       LYS 183  -8.296   7.126   8.665
  627    HZ3  LYS 183          3HZ       LYS 183  -8.632   7.554   7.115
  628    H    ALA 184           H        ALA 184  -0.645   4.714   6.225
  629    HA   ALA 184           HA       ALA 184   1.588   3.881   7.824
  630    HB1  ALA 184          1HB       ALA 184   1.524   5.465   5.233
  631    HB2  ALA 184          2HB       ALA 184   2.942   4.672   5.960
  632    HB3  ALA 184          3HB       ALA 184   1.577   3.690   5.386
  633    H    GLN 185           H        GLN 185   2.664   4.930   9.331
  634    HA   GLN 185           HA       GLN 185   2.709   7.920   9.413
  635    HB2  GLN 185          1HB       GLN 185   2.472   5.900  11.647
  636    HB3  GLN 185          2HB       GLN 185   2.849   7.605  11.915
  637    HG2  GLN 185          1HG       GLN 185   0.715   8.332  11.374
  638    HG3  GLN 185          2HG       GLN 185   0.386   6.990  10.288
  639   HE21  GLN 185          1HE2      GLN 185  -0.488   5.021  11.096
  640   HE22  GLN 185          2HE2      GLN 185  -0.967   4.870  12.788
  641    HA   PRO 186           HA       PRO 186   7.186   7.306   9.284
  642    HB2  PRO 186          1HB       PRO 186   7.200  10.037  10.562
  643    HB3  PRO 186          2HB       PRO 186   8.167   9.427   9.183
  644    HG2  PRO 186          1HG       PRO 186   6.029  11.017   8.735
  645    HG3  PRO 186          2HG       PRO 186   6.308   9.574   7.703
  646    HD2  PRO 186          1HD       PRO 186   4.398   9.872  10.033
  647    HD3  PRO 186          2HD       PRO 186   4.136   9.127   8.430
  648    H    LYS 187           H        LYS 187   8.670   6.456  10.745
  649    HA   LYS 187           HA       LYS 187   7.892   5.893  13.430
  650    HB2  LYS 187          1HB       LYS 187  10.179   4.994  13.704
  651    HB3  LYS 187          2HB       LYS 187   9.314   4.374  12.309
  652    HG2  LYS 187          1HG       LYS 187  10.600   5.836  10.798
  653    HG3  LYS 187          2HG       LYS 187  11.463   6.538  12.189
  654    HD2  LYS 187          1HD       LYS 187  12.450   4.388  12.737
  655    HD3  LYS 187          2HD       LYS 187  11.428   3.566  11.541
  656    HE2  LYS 187          1HE       LYS 187  12.536   4.748   9.707
  657    HE3  LYS 187          2HE       LYS 187  13.539   5.656  10.847
  658    HZ1  LYS 187          1HZ       LYS 187  14.606   3.625  11.508
  659    HZ2  LYS 187          2HZ       LYS 187  14.619   3.614   9.872
  660    HZ3  LYS 187          3HZ       LYS 187  13.535   2.688  10.709
  661    H    GLU 188           H        GLU 188   9.511   8.586  12.186
  662    HA   GLU 188           HA       GLU 188  10.576   9.717  14.616
  663    HB2  GLU 188          1HB       GLU 188   9.639  11.082  12.042
  664    HB3  GLU 188          2HB       GLU 188  10.589  11.815  13.324
  665    HG2  GLU 188          1HG       GLU 188  12.214  11.320  11.796
  666    HG3  GLU 188          2HG       GLU 188  12.345   9.978  12.924
  667    H    VAL 189           H        VAL 189   7.286   9.508  13.434
  668    HA   VAL 189           HA       VAL 189   6.401  11.415  15.533
  669    HB   VAL 189           HB       VAL 189   4.723  12.284  14.308
  670   HG11  VAL 189          1HG1      VAL 189   6.952  13.031  13.479
  671   HG12  VAL 189          2HG1      VAL 189   6.840  11.837  12.164
  672   HG13  VAL 189          3HG1      VAL 189   5.669  13.163  12.267
  673   HG21  VAL 189          1HG2      VAL 189   3.924  11.488  12.107
  674   HG22  VAL 189          2HG2      VAL 189   4.986  10.074  12.246
  675   HG23  VAL 189          3HG2      VAL 189   3.639  10.306  13.385
  676    H    MET 190           H        MET 190   5.770   8.193  14.237
  677    HA   MET 190           HA       MET 190   3.623   7.800  16.242
  678    HB2  MET 190          1HB       MET 190   3.515   5.483  15.426
  679    HB3  MET 190          2HB       MET 190   3.030   6.741  14.311
  680    HG2  MET 190          1HG       MET 190   4.768   6.403  12.870
  681    HG3  MET 190          2HG       MET 190   5.856   5.760  14.091
  682    HE1  MET 190          1HE       MET 190   6.130   3.298  14.739
  683    HE2  MET 190          2HE       MET 190   4.545   3.464  15.528
  684    HE3  MET 190          3HE       MET 190   4.875   2.070  14.474
  685    H    SER 191           H        SER 191   6.575   5.880  15.655
  686    HA   SER 191           HA       SER 191   7.541   6.176  18.346
  687    HB2  SER 191          1HB       SER 191   5.681   4.576  18.779
  688    HB3  SER 191          2HB       SER 191   6.380   3.459  17.594
  689    HG   SER 191           HG       SER 191   6.978   2.981  19.778
  690    HA   PRO 192           HA       PRO 192  11.097   4.906  15.843
  691    HB2  PRO 192          1HB       PRO 192  13.044   4.719  17.754
  692    HB3  PRO 192          2HB       PRO 192  12.385   6.280  17.174
  693    HG2  PRO 192          1HG       PRO 192  11.567   4.723  19.650
  694    HG3  PRO 192          2HG       PRO 192  11.982   6.463  19.526
  695    HD2  PRO 192          1HD       PRO 192   9.406   5.600  19.492
  696    HD3  PRO 192          2HD       PRO 192   9.929   6.970  18.466
  697    H    THR 193           H        THR 193  12.251   3.019  15.333
  698    HA   THR 193           HA       THR 193  11.032   0.579  16.196
  699    HB   THR 193           HB       THR 193  11.853   1.069  13.891
  700    HG1  THR 193          1HG       THR 193  12.080  -1.040  13.543
  701   HG21  THR 193          1HG2      THR 193  14.504  -0.004  14.977
  702   HG22  THR 193          2HG2      THR 193  14.229   1.678  14.468
  703   HG23  THR 193          3HG2      THR 193  14.101   0.362  13.291
  704    H    GLY 194           H        GLY 194  11.968  -1.342  16.881
  705    HA2  GLY 194          1HA       GLY 194  14.528  -1.303  18.358
  706    HA3  GLY 194          2HA       GLY 194  13.080  -1.708  19.293
  707    H    SER 195           H        SER 195  13.104  -2.706  15.937
  708    HA   SER 195           HA       SER 195  12.703  -5.454  16.652
  709    HB2  SER 195          1HB       SER 195  11.684  -4.390  14.688
  710    HB3  SER 195          2HB       SER 195  13.284  -4.230  13.933
  711    HG   SER 195           HG       SER 195  12.052  -6.130  13.300
  712    H    ALA 196           H        ALA 196  14.035  -7.158  16.776
  713    HA   ALA 196           HA       ALA 196  16.891  -6.740  16.912
  714    HB1  ALA 196          1HB       ALA 196  16.917  -9.082  17.677
  715    HB2  ALA 196          2HB       ALA 196  15.657  -8.153  18.507
  716    HB3  ALA 196          3HB       ALA 196  15.217  -9.274  17.197
  717    H    ARG 197           H        ARG 197  18.543  -7.863  15.815
  718    HA   ARG 197           HA       ARG 197  18.159  -8.248  12.960
  719    HB2  ARG 197          1HB       ARG 197  20.186  -7.248  14.128
  720    HB3  ARG 197          2HB       ARG 197  20.596  -8.860  14.689
  721    HG2  ARG 197          1HG       ARG 197  21.931  -8.205  12.740
  722    HG3  ARG 197          2HG       ARG 197  20.960  -9.625  12.383
  723    HD2  ARG 197          1HD       ARG 197  21.008  -8.017  10.503
  724    HD3  ARG 197          2HD       ARG 197  19.379  -8.297  11.106
  725    HE   ARG 197           HE       ARG 197  21.024  -5.911  11.909
  726   HH11  ARG 197          1HH1      ARG 197  18.011  -7.028  10.469
  727   HH12  ARG 197          2HH1      ARG 197  17.191  -5.533  10.874
  728   HH21  ARG 197          1HH2      ARG 197  19.942  -4.018  12.257
  729   HH22  ARG 197          2HH2      ARG 197  18.293  -3.845  11.743
  730    H    GLY 198           H        GLY 198  18.069 -10.404  15.649
  731    HA2  GLY 198          1HA       GLY 198  18.660 -12.899  14.312
  732    HA3  GLY 198          2HA       GLY 198  17.895 -12.698  15.885
  733    H    ARG 199           H        ARG 199  15.676 -12.852  16.051
  734    HA   ARG 199           HA       ARG 199  13.567 -13.638  15.536
  735    HB2  ARG 199          1HB       ARG 199  13.753 -11.750  13.160
  736    HB3  ARG 199          2HB       ARG 199  12.306 -12.264  14.038
  737    HG2  ARG 199          1HG       ARG 199  13.305 -11.113  16.108
  738    HG3  ARG 199          2HG       ARG 199  14.562 -10.487  15.041
  739    HD2  ARG 199          1HD       ARG 199  13.136  -8.717  15.011
  740    HD3  ARG 199          2HD       ARG 199  12.557  -9.578  13.597
  741    HE   ARG 199           HE       ARG 199  11.308  -9.576  16.338
  742   HH11  ARG 199          1HH1      ARG 199   9.010  -9.893  13.109
  743   HH12  ARG 199          2HH1      ARG 199  10.730  -9.948  12.871
  744   HH21  ARG 199          1HH2      ARG 199   9.101  -9.439  16.477
  745   HH22  ARG 199          2HH2      ARG 199   8.158  -9.426  14.997
  746    H    SER 200           H        SER 200  15.020 -15.586  15.020
  747    HA   SER 200           HA       SER 200  14.489 -16.679  12.292
  748    HB2  SER 200          1HB       SER 200  16.674 -17.808  12.454
  749    HB3  SER 200          2HB       SER 200  16.771 -16.040  12.396
  750    HG   SER 200           HG       SER 200  16.820 -17.595  14.792
  751    H5'    G 201           H5'        G 201   6.866 -12.934   8.765
  752   H5''    G 201           H5"        G 201   5.658 -13.912   9.605
  753    H4'    G 201           H4'        G 201   5.956 -12.625  11.657
  754    H3'    G 201           H3'        G 201   6.843 -10.469  10.213
  755    H2'    G 201           H2'        G 201   8.663 -11.621   9.266
  756   HO2'    G 201           HO2        G 201   9.448  -9.665  10.375
  757    H1'    G 201           H1'        G 201   9.398 -12.620  12.028
  758    H8     G 201          8H          G 201  10.396 -12.634   8.438
  759    H1     G 201          1H          G 201  12.588 -17.727  11.739
  760    H21    G 201          1H2         G 201  11.702 -17.781  13.635
  761    H22    G 201          2H2         G 201  10.403 -16.671  14.126
  762   HO5'    G 201           HO5        G 201   4.917 -12.105   8.197
  763    H5'    U 202           H5'        U 202   6.314  -8.047  10.104
  764   H5''    U 202           H5"        U 202   7.356  -7.861  11.511
  765    H4'    U 202           H4'        U 202   6.311  -5.755  10.734
  766    H3'    U 202           H3'        U 202   6.686  -6.426  13.357
  767    H2'    U 202           H2'        U 202   4.470  -7.301  13.630
  768   HO2'    U 202           HO2        U 202   4.618  -4.644  14.567
  769    H1'    U 202           H1'        U 202   3.487  -4.874  12.112
  770    H3     U 202          3H          U 202  -0.860  -6.010  12.805
  771    H5     U 202          5H          U 202   0.993  -9.733  12.304
  772    H6     U 202          6H          U 202   3.140  -8.596  12.057
  773    H5'    A 203           H5'        A 203   8.063  -3.275  11.416
  774   H5''    A 203           H5"        A 203   9.292  -2.886  12.621
  775    H4'    A 203           H4'        A 203   9.422  -1.483  10.636
  776    H3'    A 203           H3'        A 203   9.648  -0.509  13.209
  777    H2'    A 203           H2'        A 203   7.409   0.160  13.431
  778   HO2'    A 203           HO2        A 203   8.649   2.136  13.700
  779    H1'    A 203           H1'        A 203   7.421   1.282  10.638
  780    H8     A 203          8H          A 203   5.238  -0.885  13.070
  781    H61    A 203          1H6         A 203   0.729   2.810  10.655
  782    H62    A 203          2H6         A 203   0.982   1.663  11.974
  783    H2     A 203          2H          A 203   4.328   3.660   8.609
  784    H5'    G 204           H5'        G 204  10.447   1.600   9.143
  785   H5''    G 204           H5"        G 204   9.615   0.203   8.457
  786    H4'    G 204           H4'        G 204  11.794  -0.200   7.111
  787    H3'    G 204           H3'        G 204  12.855   1.876   8.605
  788    H2'    G 204           H2'        G 204  11.330   3.506   7.919
  789   HO2'    G 204           HO2        G 204  13.565   3.538   6.203
  790    H1'    G 204           H1'        G 204  11.480   2.515   5.074
  791    H8     G 204          8H          G 204   9.693   3.712   3.689
  792    H1     G 204          1H          G 204   6.093   5.082   8.862
  793    H21    G 204          1H2         G 204   6.925   4.032  10.599
  794    H22    G 204          2H2         G 204   8.487   3.258  10.525
  795    H5'    U 205           H5'        U 205  13.793  -0.095   4.440
  796   H5''    U 205           H5"        U 205  13.532  -1.490   5.508
  797    H4'    U 205           H4'        U 205  15.546  -2.579   4.630
  798    H3'    U 205           H3'        U 205  16.203   0.050   3.613
  799   HO3'    U 205           HO3        U 205  17.968  -1.638   2.801
  800    H2'    U 205           H2'        U 205  15.256  -0.250   1.558
  801   HO2'    U 205           HO2        U 205  17.438  -0.423   0.910
  802    H1'    U 205           H1'        U 205  15.604  -3.243   1.778
  803    H3     U 205          3H          U 205  13.176  -4.151  -1.940
  804    H5     U 205          5H          U 205  11.455  -0.583  -0.587
  805    H6     U 205          6H          U 205  13.005  -0.582   1.291
  Start of MODEL   17
    1    H1   GLY 105          1H        GLY 105  -3.374  18.560   7.666
    2    H2   GLY 105          2H        GLY 105  -1.875  19.174   7.897
    3    H3   GLY 105          3H        GLY 105  -2.727  18.598   9.172
    4    HA2  GLY 105          1HA       GLY 105  -1.018  17.024   8.551
    5    HA3  GLY 105          2HA       GLY 105  -2.643  16.356   8.316
    6    H    SER 106           H        SER 106  -0.361  15.367   7.001
    7    HA   SER 106           HA       SER 106  -0.039  16.410   4.334
    8    HB2  SER 106          1HB       SER 106   1.693  15.070   5.425
    9    HB3  SER 106          2HB       SER 106   0.595  13.681   5.506
   10    HG   SER 106           HG       SER 106   1.877  14.830   3.270
   11    H    HIS 107           H        HIS 107  -0.856  15.777   2.393
   12    HA   HIS 107           HA       HIS 107  -3.402  14.336   2.263
   13    HB2  HIS 107          1HB       HIS 107  -1.724  15.546   0.037
   14    HB3  HIS 107          2HB       HIS 107  -3.402  15.020  -0.078
   15    HD2  HIS 107          2HD       HIS 107  -5.267  16.727   0.558
   16    HE1  HIS 107          1HE       HIS 107  -2.797  19.905   1.975
   17    HE2  HIS 107          2HE       HIS 107  -5.178  19.236   1.363
   18    H    MET 108           H        MET 108  -0.612  12.960   2.770
   19    HA   MET 108           HA       MET 108  -0.068  11.168   0.676
   20    HB2  MET 108          1HB       MET 108   1.140   9.855   2.328
   21    HB3  MET 108          2HB       MET 108   1.451  11.575   2.539
   22    HG2  MET 108          1HG       MET 108  -0.159  11.627   4.438
   23    HG3  MET 108          2HG       MET 108  -0.462   9.901   4.218
   24    HE1  MET 108          1HE       MET 108   1.475   9.863   7.580
   25    HE2  MET 108          2HE       MET 108   0.272  11.053   7.031
   26    HE3  MET 108          3HE       MET 108   0.033   9.321   6.696
   27    H    LYS 109           H        LYS 109  -0.427   8.961   0.403
   28    HA   LYS 109           HA       LYS 109  -3.092   7.910   1.294
   29    HB2  LYS 109          1HB       LYS 109  -1.959   8.027  -1.532
   30    HB3  LYS 109          2HB       LYS 109  -3.493   7.275  -1.079
   31    HG2  LYS 109          1HG       LYS 109  -4.470   9.396  -0.499
   32    HG3  LYS 109          2HG       LYS 109  -2.914  10.222  -0.655
   33    HD2  LYS 109          1HD       LYS 109  -2.825   9.610  -3.074
   34    HD3  LYS 109          2HD       LYS 109  -4.414   8.871  -2.919
   35    HE2  LYS 109          1HE       LYS 109  -4.683  11.099  -3.846
   36    HE3  LYS 109          2HE       LYS 109  -5.365  11.078  -2.216
   37    HZ1  LYS 109          1HZ       LYS 109  -3.999  13.052  -2.590
   38    HZ2  LYS 109          2HZ       LYS 109  -2.685  12.151  -2.930
   39    HZ3  LYS 109          3HZ       LYS 109  -3.306  12.152  -1.415
   40    H    LYS 110           H        LYS 110  -1.304   6.801   2.722
   41    HA   LYS 110           HA       LYS 110  -0.294   4.344   1.331
   42    HB2  LYS 110          1HB       LYS 110   1.365   6.197   1.479
   43    HB3  LYS 110          2HB       LYS 110   1.251   6.131   3.235
   44    HG2  LYS 110          1HG       LYS 110   2.166   3.818   3.205
   45    HG3  LYS 110          2HG       LYS 110   2.211   3.860   1.428
   46    HD2  LYS 110          1HD       LYS 110   3.736   5.820   1.510
   47    HD3  LYS 110          2HD       LYS 110   3.680   5.790   3.283
   48    HE2  LYS 110          1HE       LYS 110   4.671   3.504   3.245
   49    HE3  LYS 110          2HE       LYS 110   4.801   3.600   1.478
   50    HZ1  LYS 110          1HZ       LYS 110   6.863   4.267   2.731
   51    HZ2  LYS 110          2HZ       LYS 110   6.058   5.505   3.379
   52    HZ3  LYS 110          3HZ       LYS 110   6.310   5.481   1.751
   53    H    ILE 111           H        ILE 111  -0.290   2.475   2.360
   54    HA   ILE 111           HA       ILE 111  -1.113   2.375   5.232
   55    HB   ILE 111           HB       ILE 111  -2.421   0.475   4.930
   56   HG12  ILE 111          1HG1      ILE 111  -1.343   0.213   2.120
   57   HG13  ILE 111          2HG1      ILE 111  -1.092  -0.881   3.473
   58   HG21  ILE 111          1HG2      ILE 111  -3.439   2.628   4.266
   59   HG22  ILE 111          2HG2      ILE 111  -3.148   2.218   2.555
   60   HG23  ILE 111          3HG2      ILE 111  -4.226   1.220   3.558
   61   HD11  ILE 111          1HD1      ILE 111  -2.675  -1.873   1.959
   62   HD12  ILE 111          2HD1      ILE 111  -3.497  -1.468   3.479
   63   HD13  ILE 111          3HD1      ILE 111  -3.730  -0.453   2.035
   64    H    PHE 112           H        PHE 112  -0.379   0.752   6.427
   65    HA   PHE 112           HA       PHE 112   2.215  -0.585   5.856
   66    HB2  PHE 112          1HB       PHE 112   1.517   0.737   8.018
   67    HB3  PHE 112          2HB       PHE 112   0.393  -0.573   8.318
   68    HD1  PHE 112          1HD       PHE 112   1.299  -2.910   8.819
   69    HD2  PHE 112          2HD       PHE 112   3.825   0.552   8.435
   70    HE1  PHE 112          1HE       PHE 112   3.102  -4.073  10.088
   71    HE2  PHE 112          2HE       PHE 112   5.629  -0.602   9.637
   72    HZ   PHE 112           HZ       PHE 112   5.257  -2.911  10.534
   73    H    VAL 113           H        VAL 113   2.159  -2.830   5.623
   74    HA   VAL 113           HA       VAL 113  -0.385  -4.348   6.004
   75    HB   VAL 113           HB       VAL 113   1.666  -4.949   3.854
   76   HG11  VAL 113          1HG1      VAL 113  -1.137  -6.041   4.367
   77   HG12  VAL 113          2HG1      VAL 113  -0.047  -6.509   3.041
   78   HG13  VAL 113          3HG1      VAL 113   0.379  -6.902   4.709
   79   HG21  VAL 113          1HG2      VAL 113   0.524  -2.875   3.229
   80   HG22  VAL 113          2HG2      VAL 113  -0.036  -4.213   2.230
   81   HG23  VAL 113          3HG2      VAL 113  -1.057  -3.621   3.560
   82    H    GLY 114           H        GLY 114  -0.075  -5.354   7.879
   83    HA2  GLY 114          1HA       GLY 114   2.663  -6.239   8.671
   84    HA3  GLY 114          2HA       GLY 114   1.321  -5.884   9.744
   85    H    GLY 115           H        GLY 115   3.175  -8.264   9.323
   86    HA2  GLY 115          1HA       GLY 115   2.906 -10.440  10.061
   87    HA3  GLY 115          2HA       GLY 115   1.155 -10.325   9.868
   88    H    LEU 116           H        LEU 116   3.287  -9.522   7.187
   89    HA   LEU 116           HA       LEU 116   2.018 -11.395   5.384
   90    HB2  LEU 116          1HB       LEU 116   4.446  -9.574   5.254
   91    HB3  LEU 116          2HB       LEU 116   4.076 -10.663   3.924
   92    HG   LEU 116           HG       LEU 116   1.962  -8.736   4.937
   93   HD11  LEU 116          1HD1      LEU 116   4.114  -8.226   2.846
   94   HD12  LEU 116          2HD1      LEU 116   3.929  -7.373   4.393
   95   HD13  LEU 116          3HD1      LEU 116   2.699  -7.188   3.136
   96   HD21  LEU 116          1HD2      LEU 116   1.101  -8.986   2.667
   97   HD22  LEU 116          2HD2      LEU 116   1.349 -10.613   3.326
   98   HD23  LEU 116          3HD2      LEU 116   2.520  -9.936   2.184
   99    H    SER 117           H        SER 117   2.743 -13.279   4.471
  100    HA   SER 117           HA       SER 117   4.676 -14.949   5.861
  101    HB2  SER 117          1HB       SER 117   2.885 -16.051   4.740
  102    HB3  SER 117          2HB       SER 117   3.260 -15.249   3.205
  103    HG   SER 117           HG       SER 117   4.064 -17.478   3.519
  104    H    VAL 118           H        VAL 118   6.831 -15.284   5.410
  105    HA   VAL 118           HA       VAL 118   8.242 -13.391   3.737
  106    HB   VAL 118           HB       VAL 118  10.258 -14.494   4.304
  107   HG11  VAL 118          1HG1      VAL 118   8.428 -14.482   6.731
  108   HG12  VAL 118          2HG1      VAL 118  10.198 -14.376   6.737
  109   HG13  VAL 118          3HG1      VAL 118   9.231 -13.072   6.028
  110   HG21  VAL 118          1HG2      VAL 118   9.694 -16.843   4.039
  111   HG22  VAL 118          2HG2      VAL 118  10.317 -16.571   5.668
  112   HG23  VAL 118          3HG2      VAL 118   8.570 -16.766   5.407
  113    H    ASN 119           H        ASN 119   6.525 -16.154   2.811
  114    HA   ASN 119           HA       ASN 119   8.098 -16.549   0.315
  115    HB2  ASN 119          1HB       ASN 119   5.573 -17.855   1.401
  116    HB3  ASN 119          2HB       ASN 119   6.283 -18.226  -0.167
  117   HD21  ASN 119          1HD2      ASN 119   5.952 -19.831   2.456
  118   HD22  ASN 119          2HD2      ASN 119   7.560 -20.511   2.654
  119    H    THR 120           H        THR 120   5.450 -14.599   1.455
  120    HA   THR 120           HA       THR 120   4.307 -14.008  -1.160
  121    HB   THR 120           HB       THR 120   4.109 -12.502   1.471
  122    HG1  THR 120          1HG       THR 120   2.250 -13.650   1.743
  123   HG21  THR 120          1HG2      THR 120   3.414 -11.056  -0.363
  124   HG22  THR 120          2HG2      THR 120   2.001 -11.597   0.556
  125   HG23  THR 120          3HG2      THR 120   2.368 -12.335  -1.011
  126    H    THR 121           H        THR 121   4.930 -12.582  -2.608
  127    HA   THR 121           HA       THR 121   7.180 -10.751  -1.945
  128    HB   THR 121           HB       THR 121   7.614 -12.504  -3.664
  129    HG1  THR 121          1HG       THR 121   8.832 -11.035  -4.804
  130   HG21  THR 121          1HG2      THR 121   6.964 -12.020  -5.970
  131   HG22  THR 121          2HG2      THR 121   5.983 -10.633  -5.455
  132   HG23  THR 121          3HG2      THR 121   5.514 -12.285  -4.994
  133    H    VAL 122           H        VAL 122   7.328  -8.734  -3.209
  134    HA   VAL 122           HA       VAL 122   5.244  -7.036  -2.382
  135    HB   VAL 122           HB       VAL 122   7.625  -6.422  -2.773
  136   HG11  VAL 122          1HG1      VAL 122   8.412  -5.687  -4.925
  137   HG12  VAL 122          2HG1      VAL 122   7.912  -7.376  -5.076
  138   HG13  VAL 122          3HG1      VAL 122   6.872  -6.073  -5.705
  139   HG21  VAL 122          1HG2      VAL 122   5.895  -4.725  -2.377
  140   HG22  VAL 122          2HG2      VAL 122   7.147  -4.143  -3.504
  141   HG23  VAL 122          3HG2      VAL 122   5.569  -4.635  -4.123
  142    H    GLU 123           H        GLU 123   5.714  -8.442  -5.614
  143    HA   GLU 123           HA       GLU 123   3.587  -6.962  -6.864
  144    HB2  GLU 123          1HB       GLU 123   4.849  -9.634  -7.589
  145    HB3  GLU 123          2HB       GLU 123   3.747  -8.745  -8.631
  146    HG2  GLU 123          1HG       GLU 123   6.461  -7.726  -7.667
  147    HG3  GLU 123          2HG       GLU 123   6.149  -8.479  -9.222
  148    H    ASP 124           H        ASP 124   3.533  -9.917  -4.879
  149    HA   ASP 124           HA       ASP 124   0.841 -10.768  -5.599
  150    HB2  ASP 124          1HB       ASP 124   2.284 -11.140  -2.946
  151    HB3  ASP 124          2HB       ASP 124   0.873 -12.013  -3.500
  152    H    VAL 125           H        VAL 125   2.250  -8.739  -3.026
  153    HA   VAL 125           HA       VAL 125  -0.208  -8.093  -1.696
  154    HB   VAL 125           HB       VAL 125   2.462  -6.618  -1.686
  155   HG11  VAL 125          1HG1      VAL 125   0.660  -5.199  -0.779
  156   HG12  VAL 125          2HG1      VAL 125   0.144  -6.528   0.289
  157   HG13  VAL 125          3HG1      VAL 125   1.727  -5.750   0.512
  158   HG21  VAL 125          1HG2      VAL 125   1.326  -8.819   0.089
  159   HG22  VAL 125          2HG2      VAL 125   2.770  -8.906  -0.943
  160   HG23  VAL 125          3HG2      VAL 125   2.769  -7.873   0.485
  161    H    LYS 126           H        LYS 126   1.718  -6.253  -4.079
  162    HA   LYS 126           HA       LYS 126  -0.040  -4.044  -4.467
  163    HB2  LYS 126          1HB       LYS 126   2.204  -3.983  -5.248
  164    HB3  LYS 126          2HB       LYS 126   2.010  -5.489  -6.146
  165    HG2  LYS 126          1HG       LYS 126   0.595  -4.387  -7.802
  166    HG3  LYS 126          2HG       LYS 126   0.715  -2.843  -6.924
  167    HD2  LYS 126          1HD       LYS 126   3.077  -2.679  -7.345
  168    HD3  LYS 126          2HD       LYS 126   3.190  -4.393  -7.752
  169    HE2  LYS 126          1HE       LYS 126   1.547  -3.793  -9.708
  170    HE3  LYS 126          2HE       LYS 126   2.107  -2.134  -9.437
  171    HZ1  LYS 126          1HZ       LYS 126   3.478  -3.382 -11.081
  172    HZ2  LYS 126          2HZ       LYS 126   3.856  -4.502  -9.937
  173    HZ3  LYS 126          3HZ       LYS 126   4.392  -2.961  -9.789
  174    H    HIS 127           H        HIS 127   0.052  -7.138  -6.363
  175    HA   HIS 127           HA       HIS 127  -2.206  -6.546  -7.978
  176    HB2  HIS 127          1HB       HIS 127  -0.493  -8.310  -8.388
  177    HB3  HIS 127          2HB       HIS 127  -1.169  -9.260  -7.057
  178    HD2  HIS 127          2HD       HIS 127  -2.023  -7.919 -10.565
  179    HE1  HIS 127          1HE       HIS 127  -4.813 -11.053  -9.769
  180    HE2  HIS 127          2HE       HIS 127  -3.977  -9.420 -11.538
  181    H    TYR 128           H        TYR 128  -2.066  -8.128  -4.745
  182    HA   TYR 128           HA       TYR 128  -4.867  -8.677  -4.660
  183    HB2  TYR 128          1HB       TYR 128  -3.409  -9.888  -3.232
  184    HB3  TYR 128          2HB       TYR 128  -2.826  -8.416  -2.463
  185    HD1  TYR 128          1HD       TYR 128  -4.212  -7.172  -0.814
  186    HD2  TYR 128          2HD       TYR 128  -5.623 -10.785  -2.713
  187    HE1  TYR 128          1HE       TYR 128  -6.069  -7.318   0.826
  188    HE2  TYR 128          2HE       TYR 128  -7.466 -10.940  -1.051
  189    HH   TYR 128           HH       TYR 128  -8.565  -9.886   0.664
  190    H    PHE 129           H        PHE 129  -3.073  -5.819  -3.421
  191    HA   PHE 129           HA       PHE 129  -5.526  -4.575  -2.585
  192    HB2  PHE 129          1HB       PHE 129  -2.719  -3.545  -2.682
  193    HB3  PHE 129          2HB       PHE 129  -4.086  -2.526  -2.257
  194    HD1  PHE 129          1HD       PHE 129  -5.752  -3.482  -0.400
  195    HD2  PHE 129          2HD       PHE 129  -1.675  -4.760  -0.923
  196    HE1  PHE 129          1HE       PHE 129  -5.743  -4.450   1.891
  197    HE2  PHE 129          2HE       PHE 129  -1.672  -5.685   1.378
  198    HZ   PHE 129           HZ       PHE 129  -3.709  -5.535   2.786
  199    H    GLU 130           H        GLU 130  -3.936  -4.475  -5.655
  200    HA   GLU 130           HA       GLU 130  -5.274  -2.327  -6.898
  201    HB2  GLU 130          1HB       GLU 130  -4.089  -4.931  -7.777
  202    HB3  GLU 130          2HB       GLU 130  -5.108  -4.110  -8.932
  203    HG2  GLU 130          1HG       GLU 130  -2.809  -2.723  -7.495
  204    HG3  GLU 130          2HG       GLU 130  -2.585  -3.619  -8.981
  205    H    GLN 131           H        GLN 131  -6.706  -5.329  -5.823
  206    HA   GLN 131           HA       GLN 131  -9.037  -5.428  -7.477
  207    HB2  GLN 131          1HB       GLN 131  -8.627  -6.219  -4.551
  208    HB3  GLN 131          2HB       GLN 131 -10.007  -6.690  -5.553
  209    HG2  GLN 131          1HG       GLN 131  -8.498  -7.769  -7.141
  210    HG3  GLN 131          2HG       GLN 131  -7.098  -7.414  -6.141
  211   HE21  GLN 131          1HE2      GLN 131  -7.319  -8.146  -3.760
  212   HE22  GLN 131          2HE2      GLN 131  -8.091  -9.709  -3.488
  213    H    PHE 132           H        PHE 132  -8.408  -3.832  -4.433
  214    HA   PHE 132           HA       PHE 132 -11.023  -2.635  -4.102
  215    HB2  PHE 132          1HB       PHE 132  -8.369  -1.945  -2.783
  216    HB3  PHE 132          2HB       PHE 132  -9.937  -1.332  -2.292
  217    HD1  PHE 132          1HD       PHE 132 -11.810  -3.200  -1.808
  218    HD2  PHE 132          2HD       PHE 132  -7.559  -3.905  -1.786
  219    HE1  PHE 132          1HE       PHE 132 -12.154  -5.276  -0.489
  220    HE2  PHE 132          2HE       PHE 132  -7.900  -5.941  -0.411
  221    HZ   PHE 132           HZ       PHE 132 -10.197  -6.640   0.227
  222    H    GLY 133           H        GLY 133  -8.073  -1.456  -5.582
  223    HA2  GLY 133          1HA       GLY 133  -9.152   0.328  -7.382
  224    HA3  GLY 133          2HA       GLY 133  -8.886   1.302  -5.935
  225    H    LYS 134           H        LYS 134  -7.506   2.069  -8.079
  226    HA   LYS 134           HA       LYS 134  -5.191   0.665  -8.796
  227    HB2  LYS 134          1HB       LYS 134  -6.277   2.441 -10.157
  228    HB3  LYS 134          2HB       LYS 134  -5.706   3.646  -9.019
  229    HG2  LYS 134          1HG       LYS 134  -4.126   3.771 -10.734
  230    HG3  LYS 134          2HG       LYS 134  -3.303   2.771  -9.562
  231    HD2  LYS 134          1HD       LYS 134  -4.311   0.746 -10.913
  232    HD3  LYS 134          2HD       LYS 134  -4.720   1.948 -12.126
  233    HE2  LYS 134          1HE       LYS 134  -2.671   0.962 -12.797
  234    HE3  LYS 134          2HE       LYS 134  -2.276   2.592 -12.241
  235    HZ1  LYS 134          1HZ       LYS 134  -2.035   0.176 -10.516
  236    HZ2  LYS 134          2HZ       LYS 134  -1.427   1.645 -10.184
  237    HZ3  LYS 134          3HZ       LYS 134  -0.776   0.767 -11.400
  238    H    VAL 135           H        VAL 135  -3.237   0.501  -8.162
  239    HA   VAL 135           HA       VAL 135  -2.326   1.709  -5.586
  240    HB   VAL 135           HB       VAL 135  -1.454  -0.719  -7.193
  241   HG11  VAL 135          1HG1      VAL 135   0.589   0.133  -6.266
  242   HG12  VAL 135          2HG1      VAL 135  -0.179   0.393  -4.680
  243   HG13  VAL 135          3HG1      VAL 135   0.070  -1.247  -5.301
  244   HG21  VAL 135          1HG2      VAL 135  -2.663  -0.429  -4.408
  245   HG22  VAL 135          2HG2      VAL 135  -3.548  -0.934  -5.860
  246   HG23  VAL 135          3HG2      VAL 135  -2.249  -1.955  -5.228
  247    H    ASP 136           H        ASP 136  -0.626   3.046  -5.506
  248    HA   ASP 136           HA       ASP 136   0.524   4.106  -8.011
  249    HB2  ASP 136          1HB       ASP 136  -0.206   5.769  -6.507
  250    HB3  ASP 136          2HB       ASP 136   0.590   5.001  -5.137
  251    H    ASP 137           H        ASP 137   1.672   2.451  -5.055
  252    HA   ASP 137           HA       ASP 137   3.856   1.162  -6.464
  253    HB2  ASP 137          1HB       ASP 137   4.699   3.567  -5.944
  254    HB3  ASP 137          2HB       ASP 137   4.575   3.140  -4.240
  255    H    ALA 138           H        ALA 138   5.022  -0.319  -4.956
  256    HA   ALA 138           HA       ALA 138   4.015  -0.612  -2.215
  257    HB1  ALA 138          1HB       ALA 138   2.511  -2.085  -3.522
  258    HB2  ALA 138          2HB       ALA 138   3.926  -2.916  -4.209
  259    HB3  ALA 138          3HB       ALA 138   3.583  -3.032  -2.470
  260    H    MET 139           H        MET 139   5.452  -1.763  -0.831
  261    HA   MET 139           HA       MET 139   7.917  -2.960  -1.856
  262    HB2  MET 139          1HB       MET 139   9.447  -1.514  -0.555
  263    HB3  MET 139          2HB       MET 139   8.713  -0.720  -1.944
  264    HG2  MET 139          1HG       MET 139   7.132   0.461  -0.502
  265    HG3  MET 139          2HG       MET 139   7.747  -0.383   0.923
  266    HE1  MET 139          1HE       MET 139   8.857   3.320   1.447
  267    HE2  MET 139          2HE       MET 139   7.410   2.807   0.547
  268    HE3  MET 139          3HE       MET 139   7.871   1.962   2.044
  269    H    LEU 140           H        LEU 140   8.683  -4.526  -0.521
  270    HA   LEU 140           HA       LEU 140   7.517  -4.724   2.223
  271    HB2  LEU 140          1HB       LEU 140   8.795  -6.986   0.694
  272    HB3  LEU 140          2HB       LEU 140   7.884  -7.057   2.199
  273    HG   LEU 140           HG       LEU 140   6.802  -6.485  -0.589
  274   HD11  LEU 140          1HD1      LEU 140   7.250  -8.854  -0.054
  275   HD12  LEU 140          2HD1      LEU 140   5.511  -8.543  -0.207
  276   HD13  LEU 140          3HD1      LEU 140   6.239  -8.716   1.400
  277   HD21  LEU 140          1HD2      LEU 140   5.505  -5.079   0.911
  278   HD22  LEU 140          2HD2      LEU 140   5.323  -6.416   2.066
  279   HD23  LEU 140          3HD2      LEU 140   4.543  -6.474   0.465
  280    H    MET 141           H        MET 141   8.853  -5.164   4.007
  281    HA   MET 141           HA       MET 141  11.341  -3.655   3.751
  282    HB2  MET 141          1HB       MET 141   9.866  -4.750   6.157
  283    HB3  MET 141          2HB       MET 141  11.332  -3.776   6.240
  284    HG2  MET 141          1HG       MET 141   8.633  -2.922   5.135
  285    HG3  MET 141          2HG       MET 141   9.447  -2.374   6.586
  286    HE1  MET 141          1HE       MET 141  10.200  -2.202   2.497
  287    HE2  MET 141          2HE       MET 141   8.597  -1.663   3.060
  288    HE3  MET 141          3HE       MET 141   9.800  -0.482   2.492
  289    H    PHE 142           H        PHE 142  12.406  -5.167   2.403
  290    HA   PHE 142           HA       PHE 142  13.380  -7.651   3.293
  291    HB2  PHE 142          1HB       PHE 142  14.120  -5.898   1.014
  292    HB3  PHE 142          2HB       PHE 142  15.066  -7.323   1.397
  293    HD1  PHE 142          1HD       PHE 142  14.069  -9.594   1.383
  294    HD2  PHE 142          2HD       PHE 142  11.902  -6.148  -0.006
  295    HE1  PHE 142          1HE       PHE 142  12.465 -11.084   0.191
  296    HE2  PHE 142          2HE       PHE 142  10.293  -7.630  -1.186
  297    HZ   PHE 142           HZ       PHE 142  10.567 -10.101  -1.079
  298    H    ASP 143           H        ASP 143  15.131  -8.558   4.074
  299    HA   ASP 143           HA       ASP 143  17.270  -6.808   5.172
  300    HB2  ASP 143          1HB       ASP 143  16.436  -7.956   6.974
  301    HB3  ASP 143          2HB       ASP 143  16.176  -9.438   6.056
  302    H    LYS 144           H        LYS 144  19.179  -6.709   4.242
  303    HA   LYS 144           HA       LYS 144  19.840  -8.128   1.849
  304    HB2  LYS 144          1HB       LYS 144  20.644  -5.855   2.486
  305    HB3  LYS 144          2HB       LYS 144  21.587  -6.554   3.792
  306    HG2  LYS 144          1HG       LYS 144  23.013  -5.984   1.907
  307    HG3  LYS 144          2HG       LYS 144  23.049  -7.707   2.209
  308    HD2  LYS 144          1HD       LYS 144  23.001  -7.248  -0.195
  309    HD3  LYS 144          2HD       LYS 144  21.569  -8.134   0.296
  310    HE2  LYS 144          1HE       LYS 144  20.917  -6.452  -1.294
  311    HE3  LYS 144          2HE       LYS 144  20.243  -6.023   0.277
  312    HZ1  LYS 144          1HZ       LYS 144  22.698  -4.832  -0.910
  313    HZ2  LYS 144          2HZ       LYS 144  22.060  -4.403   0.533
  314    HZ3  LYS 144          3HZ       LYS 144  21.241  -4.105  -0.845
  315    H    THR 145           H        THR 145  20.404  -8.970   5.193
  316    HA   THR 145           HA       THR 145  22.415 -10.963   4.651
  317    HB   THR 145           HB       THR 145  20.894 -11.110   7.205
  318    HG1  THR 145          1HG       THR 145  21.131  -8.970   7.092
  319   HG21  THR 145          1HG2      THR 145  22.788 -12.630   6.745
  320   HG22  THR 145          2HG2      THR 145  23.137 -11.527   8.089
  321   HG23  THR 145          3HG2      THR 145  23.850 -11.225   6.488
  322    H    THR 146           H        THR 146  19.129 -11.550   5.967
  323    HA   THR 146           HA       THR 146  19.119 -14.250   5.121
  324    HB   THR 146           HB       THR 146  16.570 -12.874   5.860
  325    HG1  THR 146          1HG       THR 146  17.968 -11.969   7.323
  326   HG21  THR 146          1HG2      THR 146  17.925 -15.460   6.700
  327   HG22  THR 146          2HG2      THR 146  16.587 -15.318   5.532
  328   HG23  THR 146          3HG2      THR 146  16.317 -14.913   7.236
  329    H    ASN 147           H        ASN 147  18.274 -11.462   3.317
  330    HA   ASN 147           HA       ASN 147  17.265 -11.082   1.368
  331    HB2  ASN 147          1HB       ASN 147  18.247 -13.881   0.755
  332    HB3  ASN 147          2HB       ASN 147  17.484 -12.834  -0.439
  333   HD21  ASN 147          1HD2      ASN 147  20.341 -13.120   1.684
  334   HD22  ASN 147          2HD2      ASN 147  21.235 -11.860   0.862
  335    H    ARG 148           H        ARG 148  15.658 -11.709   3.481
  336    HA   ARG 148           HA       ARG 148  13.068 -12.288   2.136
  337    HB2  ARG 148          1HB       ARG 148  13.907 -13.258   4.908
  338    HB3  ARG 148          2HB       ARG 148  12.274 -13.346   4.267
  339    HG2  ARG 148          1HG       ARG 148  14.691 -14.829   3.144
  340    HG3  ARG 148          2HG       ARG 148  13.441 -15.502   4.187
  341    HD2  ARG 148          1HD       ARG 148  11.737 -14.943   2.434
  342    HD3  ARG 148          2HD       ARG 148  13.048 -14.455   1.352
  343    HE   ARG 148           HE       ARG 148  13.956 -16.835   1.753
  344   HH11  ARG 148          1HH1      ARG 148  10.505 -16.172   1.495
  345   HH12  ARG 148          2HH1      ARG 148  10.137 -17.857   1.198
  346   HH21  ARG 148          1HH2      ARG 148  13.382 -18.934   1.266
  347   HH22  ARG 148          2HH2      ARG 148  11.711 -19.319   0.968
  348    H    HIS 149           H        HIS 149  11.255 -11.188   3.241
  349    HA   HIS 149           HA       HIS 149  12.118  -8.621   4.443
  350    HB2  HIS 149          1HB       HIS 149   9.840  -7.873   4.147
  351    HB3  HIS 149          2HB       HIS 149  10.500  -8.487   2.637
  352    HD2  HIS 149          2HD       HIS 149   9.059 -10.239   1.387
  353    HE1  HIS 149          1HE       HIS 149   6.309 -11.220   4.489
  354    HE2  HIS 149          2HE       HIS 149   6.879 -11.559   2.020
  355    H    ARG 150           H        ARG 150  11.282  -7.752   6.323
  356    HA   ARG 150           HA       ARG 150  11.378  -9.513   8.547
  357    HB2  ARG 150          1HB       ARG 150  12.385  -7.256   8.243
  358    HB3  ARG 150          2HB       ARG 150  10.782  -6.524   8.333
  359    HG2  ARG 150          1HG       ARG 150  10.578  -7.029  10.630
  360    HG3  ARG 150          2HG       ARG 150  11.776  -8.325  10.525
  361    HD2  ARG 150          1HD       ARG 150  12.677  -6.415  11.774
  362    HD3  ARG 150          2HD       ARG 150  13.588  -6.754  10.313
  363    HE   ARG 150           HE       ARG 150  12.769  -4.790   9.265
  364   HH11  ARG 150          1HH1      ARG 150  11.768  -4.817  12.672
  365   HH12  ARG 150          2HH1      ARG 150  11.740  -3.050  12.672
  366   HH21  ARG 150          1HH2      ARG 150  12.624  -2.586   9.462
  367   HH22  ARG 150          2HH2      ARG 150  12.091  -1.927  10.997
  368    H    GLY 151           H        GLY 151   8.907  -9.769   6.756
  369    HA2  GLY 151          1HA       GLY 151   6.823 -10.647   7.174
  370    HA3  GLY 151          2HA       GLY 151   6.974 -10.258   8.885
  371    H    PHE 152           H        PHE 152   7.470  -7.566   6.685
  372    HA   PHE 152           HA       PHE 152   4.661  -6.845   6.532
  373    HB2  PHE 152          1HB       PHE 152   4.694  -4.873   7.869
  374    HB3  PHE 152          2HB       PHE 152   5.235  -6.182   8.881
  375    HD1  PHE 152          1HD       PHE 152   5.981  -2.917   7.560
  376    HD2  PHE 152          2HD       PHE 152   7.783  -6.396   9.361
  377    HE1  PHE 152          1HE       PHE 152   7.919  -1.547   8.266
  378    HE2  PHE 152          2HE       PHE 152   9.755  -5.029  10.007
  379    HZ   PHE 152           HZ       PHE 152   9.824  -2.607   9.454
  380    H    GLY 153           H        GLY 153   4.383  -4.678   5.538
  381    HA2  GLY 153          1HA       GLY 153   6.591  -3.351   4.184
  382    HA3  GLY 153          2HA       GLY 153   5.594  -4.316   3.092
  383    H    PHE 154           H        PHE 154   5.402  -2.122   2.171
  384    HA   PHE 154           HA       PHE 154   3.035  -0.695   3.241
  385    HB2  PHE 154          1HB       PHE 154   5.556   0.512   2.076
  386    HB3  PHE 154          2HB       PHE 154   4.066   1.400   2.355
  387    HD1  PHE 154          1HD       PHE 154   3.373   2.092   4.591
  388    HD2  PHE 154          2HD       PHE 154   6.855  -0.378   4.007
  389    HE1  PHE 154          1HE       PHE 154   4.097   2.549   6.924
  390    HE2  PHE 154          2HE       PHE 154   7.522  -0.002   6.348
  391    HZ   PHE 154           HZ       PHE 154   6.173   1.501   7.813
  392    H    VAL 155           H        VAL 155   1.630   0.320   1.846
  393    HA   VAL 155           HA       VAL 155   2.043   0.030  -1.075
  394    HB   VAL 155           HB       VAL 155  -0.628  -0.675   0.160
  395   HG11  VAL 155          1HG1      VAL 155   0.440  -0.926  -2.678
  396   HG12  VAL 155          2HG1      VAL 155  -1.148  -1.487  -2.113
  397   HG13  VAL 155          3HG1      VAL 155  -0.785   0.236  -2.121
  398   HG21  VAL 155          1HG2      VAL 155   1.464  -2.562  -0.980
  399   HG22  VAL 155          2HG2      VAL 155   0.927  -2.484   0.712
  400   HG23  VAL 155          3HG2      VAL 155  -0.204  -2.987  -0.540
  401    H    THR 156           H        THR 156   1.673   1.805  -2.141
  402    HA   THR 156           HA       THR 156   0.194   4.041  -0.899
  403    HB   THR 156           HB       THR 156   2.012   4.425  -3.238
  404    HG1  THR 156          1HG       THR 156   3.663   4.838  -1.822
  405   HG21  THR 156          1HG2      THR 156   0.591   6.344  -2.614
  406   HG22  THR 156          2HG2      THR 156   2.282   6.676  -2.233
  407   HG23  THR 156          3HG2      THR 156   1.159   6.231  -0.931
  408    H    PHE 157           H        PHE 157  -1.389   5.260  -2.041
  409    HA   PHE 157           HA       PHE 157  -2.685   3.684  -4.197
  410    HB2  PHE 157          1HB       PHE 157  -3.849   5.022  -1.774
  411    HB3  PHE 157          2HB       PHE 157  -4.817   4.477  -3.128
  412    HD1  PHE 157          1HD       PHE 157  -5.424   2.183  -3.408
  413    HD2  PHE 157          2HD       PHE 157  -2.470   3.288  -0.472
  414    HE1  PHE 157          1HE       PHE 157  -5.536  -0.096  -2.428
  415    HE2  PHE 157          2HE       PHE 157  -2.530   0.998   0.445
  416    HZ   PHE 157           HZ       PHE 157  -4.066  -0.706  -0.516
  417    H    GLU 158           H        GLU 158  -4.023   4.583  -5.701
  418    HA   GLU 158           HA       GLU 158  -3.189   7.158  -6.747
  419    HB2  GLU 158          1HB       GLU 158  -3.792   5.229  -8.114
  420    HB3  GLU 158          2HB       GLU 158  -5.447   5.277  -7.525
  421    HG2  GLU 158          1HG       GLU 158  -4.186   7.660  -8.946
  422    HG3  GLU 158          2HG       GLU 158  -4.782   6.283  -9.860
  423    H    SER 159           H        SER 159  -5.875   6.151  -4.691
  424    HA   SER 159           HA       SER 159  -6.641   8.988  -4.321
  425    HB2  SER 159          1HB       SER 159  -8.226   8.230  -5.963
  426    HB3  SER 159          2HB       SER 159  -8.596   6.777  -5.014
  427    HG   SER 159           HG       SER 159 -10.091   8.610  -4.794
  428    H    GLU 160           H        GLU 160  -7.362   9.524  -2.333
  429    HA   GLU 160           HA       GLU 160  -6.618   7.896  -0.069
  430    HB2  GLU 160          1HB       GLU 160  -6.610  10.426  -0.275
  431    HB3  GLU 160          2HB       GLU 160  -8.376  10.381  -0.162
  432    HG2  GLU 160          1HG       GLU 160  -8.190   9.316   2.075
  433    HG3  GLU 160          2HG       GLU 160  -6.426   9.314   1.923
  434    H    ASP 161           H        ASP 161  -9.617   8.291  -1.903
  435    HA   ASP 161           HA       ASP 161 -11.401   7.142   0.033
  436    HB2  ASP 161          1HB       ASP 161 -11.542   7.348  -2.981
  437    HB3  ASP 161          2HB       ASP 161 -12.788   6.570  -2.017
  438    H    ILE 162           H        ILE 162  -9.147   5.595  -2.200
  439    HA   ILE 162           HA       ILE 162 -10.194   2.912  -1.693
  440    HB   ILE 162           HB       ILE 162  -7.368   3.544  -2.577
  441   HG12  ILE 162          1HG1      ILE 162  -8.629   4.708  -4.189
  442   HG13  ILE 162          2HG1      ILE 162  -8.111   3.181  -4.887
  443   HG21  ILE 162          1HG2      ILE 162  -9.196   1.117  -2.874
  444   HG22  ILE 162          2HG2      ILE 162  -7.624   1.289  -3.681
  445   HG23  ILE 162          3HG2      ILE 162  -7.705   1.246  -1.924
  446   HD11  ILE 162          1HD1      ILE 162 -10.386   3.626  -5.596
  447   HD12  ILE 162          2HD1      ILE 162 -10.439   2.266  -4.456
  448   HD13  ILE 162          3HD1      ILE 162 -10.925   3.889  -3.929
  449    H    VAL 163           H        VAL 163  -7.579   4.958  -0.313
  450    HA   VAL 163           HA       VAL 163  -6.498   3.013   1.431
  451    HB   VAL 163           HB       VAL 163  -6.784   6.012   1.966
  452   HG11  VAL 163          1HG1      VAL 163  -4.797   5.741   3.417
  453   HG12  VAL 163          2HG1      VAL 163  -6.184   4.845   4.041
  454   HG13  VAL 163          3HG1      VAL 163  -4.892   3.985   3.186
  455   HG21  VAL 163          1HG2      VAL 163  -5.593   5.563  -0.155
  456   HG22  VAL 163          2HG2      VAL 163  -4.514   6.194   1.086
  457   HG23  VAL 163          3HG2      VAL 163  -4.495   4.460   0.705
  458    H    GLU 164           H        GLU 164  -9.263   5.273   1.983
  459    HA   GLU 164           HA       GLU 164  -9.944   4.251   4.591
  460    HB2  GLU 164          1HB       GLU 164 -11.728   5.541   2.486
  461    HB3  GLU 164          2HB       GLU 164 -12.170   5.283   4.167
  462    HG2  GLU 164          1HG       GLU 164  -9.950   7.107   3.163
  463    HG3  GLU 164          2HG       GLU 164 -11.545   7.609   3.698
  464    H    LYS 165           H        LYS 165 -11.224   3.333   1.343
  465    HA   LYS 165           HA       LYS 165 -13.113   1.388   2.153
  466    HB2  LYS 165          1HB       LYS 165 -12.772   2.322  -0.152
  467    HB3  LYS 165          2HB       LYS 165 -11.317   1.333  -0.306
  468    HG2  LYS 165          1HG       LYS 165 -12.832  -0.709   0.140
  469    HG3  LYS 165          2HG       LYS 165 -14.197   0.390  -0.076
  470    HD2  LYS 165          1HD       LYS 165 -12.010  -0.266  -2.094
  471    HD3  LYS 165          2HD       LYS 165 -13.680  -0.843  -2.129
  472    HE2  LYS 165          1HE       LYS 165 -14.459   1.525  -2.407
  473    HE3  LYS 165          2HE       LYS 165 -12.772   2.055  -2.445
  474    HZ1  LYS 165          1HZ       LYS 165 -13.603   1.758  -4.692
  475    HZ2  LYS 165          2HZ       LYS 165 -14.047   0.216  -4.402
  476    HZ3  LYS 165          3HZ       LYS 165 -12.460   0.610  -4.422
  477    H    VAL 166           H        VAL 166  -9.674   0.955   1.447
  478    HA   VAL 166           HA       VAL 166  -9.503  -1.864   2.029
  479    HB   VAL 166           HB       VAL 166  -7.371   0.303   1.991
  480   HG11  VAL 166          1HG1      VAL 166  -6.514  -1.650   3.189
  481   HG12  VAL 166          2HG1      VAL 166  -7.136  -2.716   1.908
  482   HG13  VAL 166          3HG1      VAL 166  -5.802  -1.593   1.571
  483   HG21  VAL 166          1HG2      VAL 166  -7.941  -1.740  -0.184
  484   HG22  VAL 166          2HG2      VAL 166  -8.650  -0.128  -0.223
  485   HG23  VAL 166          3HG2      VAL 166  -6.905  -0.294  -0.256
  486    H    CYS 167           H        CYS 167  -8.606   1.045   3.985
  487    HA   CYS 167           HA       CYS 167  -7.716  -0.448   6.224
  488    HB2  CYS 167          1HB       CYS 167  -8.619   2.435   5.945
  489    HB3  CYS 167          2HB       CYS 167  -8.024   1.751   7.467
  490    HG   CYS 167           HG       CYS 167  -6.563   2.100   4.556
  491    H    GLU 168           H        GLU 168 -11.029   0.689   5.539
  492    HA   GLU 168           HA       GLU 168 -12.118   0.052   8.118
  493    HB2  GLU 168          1HB       GLU 168 -13.309   0.325   5.344
  494    HB3  GLU 168          2HB       GLU 168 -14.310  -0.087   6.724
  495    HG2  GLU 168          1HG       GLU 168 -12.563   2.409   6.599
  496    HG3  GLU 168          2HG       GLU 168 -14.255   2.357   6.117
  497    H    ILE 169           H        ILE 169 -11.199  -2.100   5.520
  498    HA   ILE 169           HA       ILE 169 -12.809  -4.368   6.424
  499    HB   ILE 169           HB       ILE 169 -10.422  -4.129   4.572
  500   HG12  ILE 169          1HG1      ILE 169 -13.339  -4.779   3.914
  501   HG13  ILE 169          2HG1      ILE 169 -12.754  -3.124   3.954
  502   HG21  ILE 169          1HG2      ILE 169 -10.372  -6.380   5.459
  503   HG22  ILE 169          2HG2      ILE 169 -12.111  -6.594   5.150
  504   HG23  ILE 169          3HG2      ILE 169 -10.953  -6.442   3.810
  505   HD11  ILE 169          1HD1      ILE 169 -12.760  -3.885   1.681
  506   HD12  ILE 169          2HD1      ILE 169 -11.088  -3.619   2.205
  507   HD13  ILE 169          3HD1      ILE 169 -11.736  -5.273   2.078
  508    H    HIS 170           H        HIS 170  -9.647  -3.084   7.148
  509    HA   HIS 170           HA       HIS 170  -8.157  -3.343   8.783
  510    HB2  HIS 170          1HB       HIS 170 -10.183  -3.175  10.181
  511    HB3  HIS 170          2HB       HIS 170 -10.251  -4.930  10.274
  512    HD2  HIS 170          2HD       HIS 170  -6.734  -3.417  10.553
  513    HE1  HIS 170          1HE       HIS 170  -7.939  -4.407  14.516
  514    HE2  HIS 170          2HE       HIS 170  -5.970  -3.713  13.041
  515    H    PHE 171           H        PHE 171  -9.668  -6.552   8.389
  516    HA   PHE 171           HA       PHE 171  -6.948  -7.676   8.132
  517    HB2  PHE 171          1HB       PHE 171  -9.207  -8.901   9.600
  518    HB3  PHE 171          2HB       PHE 171  -7.999  -9.907   8.820
  519    HD1  PHE 171          1HD       PHE 171  -5.714 -10.041   9.586
  520    HD2  PHE 171          2HD       PHE 171  -8.492  -7.312  11.443
  521    HE1  PHE 171          1HE       PHE 171  -4.128  -9.702  11.468
  522    HE2  PHE 171          2HE       PHE 171  -6.897  -6.970  13.316
  523    HZ   PHE 171           HZ       PHE 171  -4.714  -8.167  13.331
  524    H    HIS 172           H        HIS 172  -6.243  -8.502   6.460
  525    HA   HIS 172           HA       HIS 172  -8.047  -9.101   4.139
  526    HB2  HIS 172          1HB       HIS 172  -5.359  -7.696   4.337
  527    HB3  HIS 172          2HB       HIS 172  -6.052  -8.255   2.831
  528    HD2  HIS 172          2HD       HIS 172  -6.695  -5.626   5.622
  529    HE1  HIS 172          1HE       HIS 172  -8.938  -4.389   2.240
  530    HE2  HIS 172          2HE       HIS 172  -8.139  -3.722   4.542
  531    H    GLU 173           H        GLU 173  -6.936 -10.558   2.475
  532    HA   GLU 173           HA       GLU 173  -5.318 -12.669   3.865
  533    HB2  GLU 173          1HB       GLU 173  -7.732 -13.215   3.897
  534    HB3  GLU 173          2HB       GLU 173  -7.753 -13.164   2.130
  535    HG2  GLU 173          1HG       GLU 173  -6.045 -14.985   2.073
  536    HG3  GLU 173          2HG       GLU 173  -6.026 -15.018   3.836
  537    H    ILE 174           H        ILE 174  -3.452 -12.949   2.857
  538    HA   ILE 174           HA       ILE 174  -3.318 -12.736  -0.130
  539    HB   ILE 174           HB       ILE 174  -1.208 -11.634   1.754
  540   HG12  ILE 174          1HG1      ILE 174  -3.451 -10.197   0.284
  541   HG13  ILE 174          2HG1      ILE 174  -3.180 -10.249   2.024
  542   HG21  ILE 174          1HG2      ILE 174  -0.259 -10.676  -0.309
  543   HG22  ILE 174          2HG2      ILE 174  -0.407 -12.414  -0.483
  544   HG23  ILE 174          3HG2      ILE 174  -1.596 -11.347  -1.265
  545   HD11  ILE 174          1HD1      ILE 174  -1.529  -8.748  -0.021
  546   HD12  ILE 174          2HD1      ILE 174  -2.526  -8.100   1.287
  547   HD13  ILE 174          3HD1      ILE 174  -1.034  -8.978   1.676
  548    H    ASN 175           H        ASN 175  -2.300 -14.383  -1.113
  549    HA   ASN 175           HA       ASN 175  -1.711 -16.567  -1.328
  550    HB2  ASN 175          1HB       ASN 175   0.545 -15.598   0.453
  551    HB3  ASN 175          2HB       ASN 175   0.555 -17.144  -0.385
  552   HD21  ASN 175          1HD2      ASN 175   2.292 -14.757  -0.660
  553   HD22  ASN 175          2HD2      ASN 175   2.305 -14.435  -2.398
  554    H    ASN 176           H        ASN 176  -3.796 -16.441   0.233
  555    HA   ASN 176           HA       ASN 176  -5.070 -17.262   1.847
  556    HB2  ASN 176          1HB       ASN 176  -5.133 -19.655   2.112
  557    HB3  ASN 176          2HB       ASN 176  -4.897 -19.185   0.439
  558   HD21  ASN 176          1HD2      ASN 176  -3.060 -20.255   3.317
  559   HD22  ASN 176          2HD2      ASN 176  -1.905 -21.219   2.391
  560    H    LYS 177           H        LYS 177  -2.893 -15.765   2.952
  561    HA   LYS 177           HA       LYS 177  -3.078 -16.781   5.750
  562    HB2  LYS 177          1HB       LYS 177  -0.831 -17.154   4.609
  563    HB3  LYS 177          2HB       LYS 177  -0.611 -15.410   4.579
  564    HG2  LYS 177          1HG       LYS 177  -1.260 -16.854   7.170
  565    HG3  LYS 177          2HG       LYS 177   0.372 -16.936   6.519
  566    HD2  LYS 177          1HD       LYS 177   0.775 -14.625   6.774
  567    HD3  LYS 177          2HD       LYS 177  -0.937 -14.243   6.932
  568    HE2  LYS 177          1HE       LYS 177  -0.944 -15.691   9.060
  569    HE3  LYS 177          2HE       LYS 177   0.820 -15.706   8.944
  570    HZ1  LYS 177          1HZ       LYS 177  -0.879 -13.272   9.148
  571    HZ2  LYS 177          2HZ       LYS 177   0.745 -13.258   9.023
  572    HZ3  LYS 177          3HZ       LYS 177   0.036 -13.892  10.371
  573    H    MET 178           H        MET 178  -3.353 -15.174   7.364
  574    HA   MET 178           HA       MET 178  -4.854 -12.877   6.348
  575    HB2  MET 178          1HB       MET 178  -4.522 -13.961   9.170
  576    HB3  MET 178          2HB       MET 178  -5.549 -12.605   8.715
  577    HG2  MET 178          1HG       MET 178  -5.858 -15.501   7.876
  578    HG3  MET 178          2HG       MET 178  -6.899 -14.586   8.958
  579    HE1  MET 178          1HE       MET 178  -7.264 -11.773   7.338
  580    HE2  MET 178          2HE       MET 178  -8.770 -12.148   6.479
  581    HE3  MET 178          3HE       MET 178  -8.568 -12.650   8.173
  582    H    VAL 179           H        VAL 179  -4.312 -10.793   6.522
  583    HA   VAL 179           HA       VAL 179  -1.963 -10.026   8.150
  584    HB   VAL 179           HB       VAL 179  -1.098  -8.578   6.393
  585   HG11  VAL 179          1HG1      VAL 179  -0.303 -10.912   6.610
  586   HG12  VAL 179          2HG1      VAL 179  -1.431 -11.403   5.321
  587   HG13  VAL 179          3HG1      VAL 179  -0.133 -10.243   4.979
  588   HG21  VAL 179          1HG2      VAL 179  -3.224  -9.752   4.563
  589   HG22  VAL 179          2HG2      VAL 179  -3.104  -8.059   5.099
  590   HG23  VAL 179          3HG2      VAL 179  -1.851  -8.744   4.061
  591    H    GLU 180           H        GLU 180  -1.842  -7.791   8.714
  592    HA   GLU 180           HA       GLU 180  -4.556  -6.553   9.002
  593    HB2  GLU 180          1HB       GLU 180  -3.240  -7.135  11.051
  594    HB3  GLU 180          2HB       GLU 180  -2.020  -5.954  10.557
  595    HG2  GLU 180          1HG       GLU 180  -3.744  -4.161  10.614
  596    HG3  GLU 180          2HG       GLU 180  -4.963  -5.353  11.070
  597    H    CYS 181           H        CYS 181  -5.068  -4.696   7.940
  598    HA   CYS 181           HA       CYS 181  -2.898  -3.060   6.713
  599    HB2  CYS 181          1HB       CYS 181  -4.658  -1.830   5.575
  600    HB3  CYS 181          2HB       CYS 181  -4.743  -3.556   5.203
  601    HG   CYS 181           HG       CYS 181  -6.453  -1.946   7.538
  602    H    LYS 182           H        LYS 182  -2.323  -1.118   7.495
  603    HA   LYS 182           HA       LYS 182  -4.009   0.302   9.508
  604    HB2  LYS 182          1HB       LYS 182  -1.019  -0.066   9.915
  605    HB3  LYS 182          2HB       LYS 182  -2.161   0.692  11.011
  606    HG2  LYS 182          1HG       LYS 182  -3.219  -1.487  11.467
  607    HG3  LYS 182          2HG       LYS 182  -2.129  -2.288  10.327
  608    HD2  LYS 182          1HD       LYS 182  -1.235  -0.880  12.870
  609    HD3  LYS 182          2HD       LYS 182  -1.453  -2.625  12.661
  610    HE2  LYS 182          1HE       LYS 182   0.216  -2.526  10.751
  611    HE3  LYS 182          2HE       LYS 182   0.559  -0.852  11.209
  612    HZ1  LYS 182          1HZ       LYS 182   0.999  -3.282  12.851
  613    HZ2  LYS 182          2HZ       LYS 182   1.163  -1.748  13.450
  614    HZ3  LYS 182          3HZ       LYS 182   2.143  -2.265  12.259
  615    H    LYS 183           H        LYS 183  -3.688   2.625   9.411
  616    HA   LYS 183           HA       LYS 183  -2.585   3.636   6.906
  617    HB2  LYS 183          1HB       LYS 183  -3.609   5.024   9.399
  618    HB3  LYS 183          2HB       LYS 183  -2.953   5.904   8.007
  619    HG2  LYS 183          1HG       LYS 183  -4.616   4.992   6.509
  620    HG3  LYS 183          2HG       LYS 183  -5.207   3.872   7.739
  621    HD2  LYS 183          1HD       LYS 183  -5.945   5.802   9.137
  622    HD3  LYS 183          2HD       LYS 183  -5.447   6.906   7.832
  623    HE2  LYS 183          1HE       LYS 183  -7.002   5.780   6.273
  624    HE3  LYS 183          2HE       LYS 183  -7.447   4.613   7.523
  625    HZ1  LYS 183          1HZ       LYS 183  -7.976   7.532   7.645
  626    HZ2  LYS 183          2HZ       LYS 183  -8.387   6.456   8.817
  627    HZ3  LYS 183          3HZ       LYS 183  -9.079   6.386   7.327
  628    H    ALA 184           H        ALA 184  -0.646   4.533   6.414
  629    HA   ALA 184           HA       ALA 184   1.566   3.685   8.079
  630    HB1  ALA 184          1HB       ALA 184   2.949   4.603   6.260
  631    HB2  ALA 184          2HB       ALA 184   1.652   3.559   5.641
  632    HB3  ALA 184          3HB       ALA 184   1.507   5.330   5.523
  633    H    GLN 185           H        GLN 185   2.318   4.752   9.802
  634    HA   GLN 185           HA       GLN 185   1.933   7.609  10.207
  635    HB2  GLN 185          1HB       GLN 185   3.553   5.522  11.709
  636    HB3  GLN 185          2HB       GLN 185   3.500   7.218  12.180
  637    HG2  GLN 185          1HG       GLN 185   1.074   5.392  11.983
  638    HG3  GLN 185          2HG       GLN 185   1.923   5.814  13.470
  639   HE21  GLN 185          1HE2      GLN 185  -0.859   6.284  13.147
  640   HE22  GLN 185          2HE2      GLN 185  -1.087   8.028  13.136
  641    HA   PRO 186           HA       PRO 186   5.532   9.064   8.066
  642    HB2  PRO 186          1HB       PRO 186   5.991  10.968  10.351
  643    HB3  PRO 186          2HB       PRO 186   5.844  11.319   8.602
  644    HG2  PRO 186          1HG       PRO 186   3.795  11.854  10.307
  645    HG3  PRO 186          2HG       PRO 186   3.470  11.144   8.691
  646    HD2  PRO 186          1HD       PRO 186   3.633   9.709  11.368
  647    HD3  PRO 186          2HD       PRO 186   2.412   9.569  10.074
  648    H    LYS 187           H        LYS 187   7.813   8.780   8.020
  649    HA   LYS 187           HA       LYS 187   9.143   7.225  10.063
  650    HB2  LYS 187          1HB       LYS 187  10.188   8.903   7.742
  651    HB3  LYS 187          2HB       LYS 187  11.247   7.987   8.822
  652    HG2  LYS 187          1HG       LYS 187  10.181   5.882   8.209
  653    HG3  LYS 187          2HG       LYS 187   8.980   6.731   7.233
  654    HD2  LYS 187          1HD       LYS 187  10.704   5.693   5.829
  655    HD3  LYS 187          2HD       LYS 187  10.619   7.438   5.627
  656    HE2  LYS 187          1HE       LYS 187  12.929   6.722   5.611
  657    HE3  LYS 187          2HE       LYS 187  12.631   7.742   7.017
  658    HZ1  LYS 187          1HZ       LYS 187  12.720   4.767   7.067
  659    HZ2  LYS 187          2HZ       LYS 187  12.533   5.726   8.381
  660    HZ3  LYS 187          3HZ       LYS 187  13.940   5.740   7.550
  661    H    GLU 188           H        GLU 188   8.525  10.517   9.813
  662    HA   GLU 188           HA       GLU 188  10.620  11.640  11.442
  663    HB2  GLU 188          1HB       GLU 188   7.809  12.670  10.874
  664    HB3  GLU 188          2HB       GLU 188   9.119  13.596  11.627
  665    HG2  GLU 188          1HG       GLU 188  10.514  13.207   9.569
  666    HG3  GLU 188          2HG       GLU 188   9.110  12.462   8.799
  667    H    VAL 189           H        VAL 189   7.615  10.021  12.349
  668    HA   VAL 189           HA       VAL 189   7.946  10.827  15.165
  669    HB   VAL 189           HB       VAL 189   5.875  10.127  15.701
  670   HG11  VAL 189          1HG1      VAL 189   5.472  10.884  12.777
  671   HG12  VAL 189          2HG1      VAL 189   4.329  11.083  14.117
  672   HG13  VAL 189          3HG1      VAL 189   5.820  12.038  14.088
  673   HG21  VAL 189          1HG2      VAL 189   4.397   8.669  14.375
  674   HG22  VAL 189          2HG2      VAL 189   5.702   8.399  13.208
  675   HG23  VAL 189          3HG2      VAL 189   5.859   7.822  14.881
  676    H    MET 190           H        MET 190   9.330   8.498  13.313
  677    HA   MET 190           HA       MET 190  10.123   6.814  15.583
  678    HB2  MET 190          1HB       MET 190   9.317   4.737  14.453
  679    HB3  MET 190          2HB       MET 190   8.078   5.728  15.200
  680    HG2  MET 190          1HG       MET 190   7.145   6.410  13.197
  681    HG3  MET 190          2HG       MET 190   8.617   6.161  12.269
  682    HE1  MET 190          1HE       MET 190   9.635   3.289  12.746
  683    HE2  MET 190          2HE       MET 190   8.777   2.504  11.403
  684    HE3  MET 190          3HE       MET 190   9.423   4.144  11.205
  685    H    SER 191           H        SER 191  12.088   7.898  14.898
  686    HA   SER 191           HA       SER 191  13.626   6.119  13.150
  687    HB2  SER 191          1HB       SER 191  14.727   8.037  11.972
  688    HB3  SER 191          2HB       SER 191  13.046   7.749  11.519
  689    HG   SER 191           HG       SER 191  12.413   9.516  12.577
  690    HA   PRO 192           HA       PRO 192  16.556   6.568  16.372
  691    HB2  PRO 192          1HB       PRO 192  18.934   5.883  15.211
  692    HB3  PRO 192          2HB       PRO 192  17.588   4.725  15.436
  693    HG2  PRO 192          1HG       PRO 192  18.254   6.333  12.945
  694    HG3  PRO 192          2HG       PRO 192  17.958   4.568  13.072
  695    HD2  PRO 192          1HD       PRO 192  15.991   6.276  12.335
  696    HD3  PRO 192          2HD       PRO 192  15.638   4.887  13.403
  697    H    THR 193           H        THR 193  18.378   7.707  17.223
  698    HA   THR 193           HA       THR 193  19.251  10.128  15.790
  699    HB   THR 193           HB       THR 193  18.555  10.493  18.660
  700    HG1  THR 193          1HG       THR 193  16.511  11.136  18.117
  701   HG21  THR 193          1HG2      THR 193  18.526  12.340  16.234
  702   HG22  THR 193          2HG2      THR 193  19.760  12.303  17.516
  703   HG23  THR 193          3HG2      THR 193  18.113  12.811  17.897
  704    H    GLY 194           H        GLY 194  21.251  10.919  16.094
  705    HA2  GLY 194          1HA       GLY 194  23.401  11.130  16.917
  706    HA3  GLY 194          2HA       GLY 194  22.979  10.135  18.303
  707    H    SER 195           H        SER 195  25.393   9.761  17.461
  708    HA   SER 195           HA       SER 195  25.721   7.710  15.401
  709    HB2  SER 195          1HB       SER 195  27.411   9.479  15.923
  710    HB3  SER 195          2HB       SER 195  27.708   8.685  17.482
  711    HG   SER 195           HG       SER 195  29.178   8.032  15.814
  712    H    ALA 196           H        ALA 196  26.781   5.629  15.852
  713    HA   ALA 196           HA       ALA 196  25.363   4.051  17.813
  714    HB1  ALA 196          1HB       ALA 196  26.711   2.202  16.892
  715    HB2  ALA 196          2HB       ALA 196  26.009   3.188  15.596
  716    HB3  ALA 196          3HB       ALA 196  27.730   3.365  16.017
  717    H    ARG 197           H        ARG 197  26.255   2.775  19.499
  718    HA   ARG 197           HA       ARG 197  28.874   3.457  20.672
  719    HB2  ARG 197          1HB       ARG 197  27.266   5.217  21.475
  720    HB3  ARG 197          2HB       ARG 197  26.235   3.953  22.127
  721    HG2  ARG 197          1HG       ARG 197  27.466   4.969  23.915
  722    HG3  ARG 197          2HG       ARG 197  28.049   3.316  23.729
  723    HD2  ARG 197          1HD       ARG 197  30.028   4.185  22.461
  724    HD3  ARG 197          2HD       ARG 197  29.394   5.831  22.642
  725    HE   ARG 197           HE       ARG 197  29.645   4.554  25.213
  726   HH11  ARG 197          1HH1      ARG 197  32.880   6.517  23.937
  727   HH12  ARG 197          2HH1      ARG 197  31.662   6.063  22.777
  728   HH21  ARG 197          1HH2      ARG 197  31.235   5.160  26.638
  729   HH22  ARG 197          2HH2      ARG 197  32.639   6.014  26.065
  730    H    GLY 198           H        GLY 198  29.650   1.916  22.127
  731    HA2  GLY 198          1HA       GLY 198  29.813  -0.098  23.268
  732    HA3  GLY 198          2HA       GLY 198  28.068  -0.294  23.139
  733    H    ARG 199           H        ARG 199  28.486  -2.528  22.784
  734    HA   ARG 199           HA       ARG 199  29.125  -3.288  19.968
  735    HB2  ARG 199          1HB       ARG 199  30.193  -4.655  22.474
  736    HB3  ARG 199          2HB       ARG 199  30.265  -5.335  20.846
  737    HG2  ARG 199          1HG       ARG 199  31.647  -3.416  20.085
  738    HG3  ARG 199          2HG       ARG 199  31.588  -2.730  21.714
  739    HD2  ARG 199          1HD       ARG 199  33.698  -3.860  21.463
  740    HD3  ARG 199          2HD       ARG 199  32.710  -4.740  22.619
  741    HE   ARG 199           HE       ARG 199  32.565  -6.561  21.174
  742   HH11  ARG 199          1HH1      ARG 199  34.128  -3.960  19.416
  743   HH12  ARG 199          2HH1      ARG 199  34.660  -5.024  18.144
  744   HH21  ARG 199          1HH2      ARG 199  33.254  -7.848  19.510
  745   HH22  ARG 199          2HH2      ARG 199  34.173  -7.165  18.201
  746    H    SER 200           H        SER 200  28.223  -5.227  19.240
  747    HA   SER 200           HA       SER 200  25.492  -5.678  19.896
  748    HB2  SER 200          1HB       SER 200  27.437  -7.389  18.297
  749    HB3  SER 200          2HB       SER 200  25.675  -7.590  18.329
  750    HG   SER 200           HG       SER 200  26.347  -6.262  16.556
  751    H5'    G 201           H5'        G 201  10.143 -11.720  10.737
  752   H5''    G 201           H5"        G 201   9.696 -11.536  12.436
  753    H4'    G 201           H4'        G 201   7.849 -10.875  11.015
  754    H3'    G 201           H3'        G 201   7.530 -12.737  13.107
  755    H2'    G 201           H2'        G 201   7.310 -14.608  11.731
  756   HO2'    G 201           HO2        G 201   4.805 -13.413  12.152
  757    H1'    G 201           H1'        G 201   5.786 -12.905   9.740
  758    H8     G 201          8H          G 201   4.979 -14.576   8.022
  759    H1     G 201          1H          G 201  10.087 -18.440   8.792
  760    H21    G 201          1H2         G 201  11.471 -17.502  10.313
  761    H22    G 201          2H2         G 201  11.031 -15.971  11.053
  762   HO5'    G 201           HO5        G 201   9.550 -14.017  11.015
  763    H5'    U 202           H5'        U 202   5.762  -8.984  10.772
  764   H5''    U 202           H5"        U 202   6.978  -8.463  11.945
  765    H4'    U 202           H4'        U 202   5.993  -6.492  11.041
  766    H3'    U 202           H3'        U 202   6.096  -6.996  13.764
  767    H2'    U 202           H2'        U 202   3.842  -7.565  14.023
  768   HO2'    U 202           HO2        U 202   4.292  -5.061  14.821
  769    H1'    U 202           H1'        U 202   3.061  -5.421  12.052
  770    H3     U 202          3H          U 202  -1.291  -6.517  12.792
  771    H5     U 202          5H          U 202   0.595 -10.256  12.670
  772    H6     U 202          6H          U 202   2.745  -9.121  12.388
  773    H5'    A 203           H5'        A 203   7.546  -3.418  11.646
  774   H5''    A 203           H5"        A 203   8.888  -3.375  12.796
  775    H4'    A 203           H4'        A 203   9.020  -1.494  11.332
  776    H3'    A 203           H3'        A 203   9.181  -1.186  14.072
  777    H2'    A 203           H2'        A 203   6.850  -0.664  14.296
  778   HO2'    A 203           HO2        A 203   8.140   1.078  15.271
  779    H1'    A 203           H1'        A 203   7.233   1.200  11.943
  780    H8     A 203          8H          A 203   4.582  -0.886  13.871
  781    H61    A 203          1H6         A 203   0.611   2.771  10.618
  782    H62    A 203          2H6         A 203   0.656   1.597  11.936
  783    H2     A 203          2H          A 203   4.593   3.621   9.265
  784    H5'    G 204           H5'        G 204  10.456   1.642  10.092
  785   H5''    G 204           H5"        G 204   9.207   0.386  10.015
  786    H4'    G 204           H4'        G 204  10.778  -0.781   8.282
  787    H3'    G 204           H3'        G 204  12.590   1.235   8.894
  788    H2'    G 204           H2'        G 204  10.954   2.939   8.220
  789   HO2'    G 204           HO2        G 204  12.944   2.367   6.295
  790    H1'    G 204           H1'        G 204  10.690   1.094   5.842
  791    H8     G 204          8H          G 204   9.534   2.147   3.925
  792    H1     G 204          1H          G 204   5.848   5.891   7.639
  793    H21    G 204          1H2         G 204   6.367   5.635   9.686
  794    H22    G 204          2H2         G 204   7.485   4.380  10.207
  795    H5'    U 205           H5'        U 205  12.873  -2.513   5.312
  796   H5''    U 205           H5"        U 205  14.462  -3.191   5.678
  797    H4'    U 205           H4'        U 205  14.182  -3.387   3.339
  798    H3'    U 205           H3'        U 205  16.332  -1.877   4.230
  799   HO3'    U 205           HO3        U 205  16.902  -1.990   1.865
  800    H2'    U 205           H2'        U 205  15.246   0.207   3.865
  801   HO2'    U 205           HO2        U 205  16.218   1.139   2.017
  802    H1'    U 205           H1'        U 205  14.218  -0.968   1.258
  803    H3     U 205          3H          U 205  12.323   2.941  -0.034
  804    H5     U 205          5H          U 205  11.850   3.049   4.115
  805    H6     U 205          6H          U 205  12.928   0.843   4.263
  Start of MODEL   18
    1    H1   GLY 105          1H        GLY 105  -9.786  14.761   7.747
    2    H2   GLY 105          2H        GLY 105 -10.779  15.069   6.483
    3    H3   GLY 105          3H        GLY 105 -10.610  16.176   7.679
    4    HA2  GLY 105          1HA       GLY 105  -9.380  16.874   5.732
    5    HA3  GLY 105          2HA       GLY 105  -8.311  16.558   7.110
    6    H    SER 106           H        SER 106  -7.570  16.529   4.330
    7    HA   SER 106           HA       SER 106  -7.348  13.899   3.240
    8    HB2  SER 106          1HB       SER 106  -5.606  16.357   2.805
    9    HB3  SER 106          2HB       SER 106  -5.646  14.927   1.762
   10    HG   SER 106           HG       SER 106  -7.745  15.387   1.197
   11    H    HIS 107           H        HIS 107  -5.436  12.623   2.900
   12    HA   HIS 107           HA       HIS 107  -3.150  12.954   4.759
   13    HB2  HIS 107          1HB       HIS 107  -4.899  11.586   5.972
   14    HB3  HIS 107          2HB       HIS 107  -4.734  10.356   4.716
   15    HD2  HIS 107          2HD       HIS 107  -2.982   8.502   5.308
   16    HE1  HIS 107          1HE       HIS 107  -0.507  10.668   8.026
   17    HE2  HIS 107          2HE       HIS 107  -0.866   8.423   6.910
   18    H    MET 108           H        MET 108  -1.465  11.189   4.351
   19    HA   MET 108           HA       MET 108  -0.648  11.086   1.615
   20    HB2  MET 108          1HB       MET 108   0.114   9.252   3.929
   21    HB3  MET 108          2HB       MET 108   0.957   9.370   2.379
   22    HG2  MET 108          1HG       MET 108   1.367  11.807   2.859
   23    HG3  MET 108          2HG       MET 108   0.717  11.556   4.480
   24    HE1  MET 108          1HE       MET 108   1.924   8.641   5.298
   25    HE2  MET 108          2HE       MET 108   3.385   9.199   6.138
   26    HE3  MET 108          3HE       MET 108   1.854  10.079   6.345
   27    H    LYS 109           H        LYS 109  -0.976   9.639   0.006
   28    HA   LYS 109           HA       LYS 109  -3.135   7.683   0.195
   29    HB2  LYS 109          1HB       LYS 109  -1.340   8.544  -2.102
   30    HB3  LYS 109          2HB       LYS 109  -2.617   7.326  -2.247
   31    HG2  LYS 109          1HG       LYS 109  -4.311   8.892  -1.539
   32    HG3  LYS 109          2HG       LYS 109  -3.098  10.188  -1.353
   33    HD2  LYS 109          1HD       LYS 109  -2.539   9.874  -3.806
   34    HD3  LYS 109          2HD       LYS 109  -3.856   8.703  -3.894
   35    HE2  LYS 109          1HE       LYS 109  -4.529  10.875  -4.797
   36    HE3  LYS 109          2HE       LYS 109  -5.518  10.422  -3.412
   37    HZ1  LYS 109          1HZ       LYS 109  -4.722  12.791  -3.464
   38    HZ2  LYS 109          2HZ       LYS 109  -3.209  12.274  -3.161
   39    HZ3  LYS 109          3HZ       LYS 109  -4.421  12.049  -2.063
   40    H    LYS 110           H        LYS 110  -1.306   6.867   1.980
   41    HA   LYS 110           HA       LYS 110   0.050   4.480   0.781
   42    HB2  LYS 110          1HB       LYS 110   1.570   6.446   0.927
   43    HB3  LYS 110          2HB       LYS 110   1.264   6.533   2.658
   44    HG2  LYS 110          1HG       LYS 110   2.286   4.197   2.852
   45    HG3  LYS 110          2HG       LYS 110   2.713   4.323   1.135
   46    HD2  LYS 110          1HD       LYS 110   3.993   6.420   1.634
   47    HD3  LYS 110          2HD       LYS 110   3.550   6.272   3.343
   48    HE2  LYS 110          1HE       LYS 110   4.703   4.016   3.356
   49    HE3  LYS 110          2HE       LYS 110   5.289   4.365   1.725
   50    HZ1  LYS 110          1HZ       LYS 110   6.399   6.354   2.679
   51    HZ2  LYS 110          2HZ       LYS 110   6.923   4.986   3.421
   52    HZ3  LYS 110          3HZ       LYS 110   5.872   5.943   4.186
   53    H    ILE 111           H        ILE 111  -0.002   2.657   1.958
   54    HA   ILE 111           HA       ILE 111  -0.847   2.788   4.821
   55    HB   ILE 111           HB       ILE 111  -2.186   0.869   4.681
   56   HG12  ILE 111          1HG1      ILE 111  -1.237   0.473   1.847
   57   HG13  ILE 111          2HG1      ILE 111  -0.917  -0.562   3.232
   58   HG21  ILE 111          1HG2      ILE 111  -3.188   3.014   3.934
   59   HG22  ILE 111          2HG2      ILE 111  -2.975   2.492   2.241
   60   HG23  ILE 111          3HG2      ILE 111  -4.025   1.575   3.350
   61   HD11  ILE 111          1HD1      ILE 111  -3.314  -1.147   3.392
   62   HD12  ILE 111          2HD1      ILE 111  -3.626  -0.206   1.914
   63   HD13  ILE 111          3HD1      ILE 111  -2.569  -1.624   1.854
   64    H    PHE 112           H        PHE 112  -0.060   1.316   6.174
   65    HA   PHE 112           HA       PHE 112   2.458  -0.141   5.569
   66    HB2  PHE 112          1HB       PHE 112   2.150   1.222   7.677
   67    HB3  PHE 112          2HB       PHE 112   0.781   0.202   8.097
   68    HD1  PHE 112          1HD       PHE 112   4.429   0.352   7.731
   69    HD2  PHE 112          2HD       PHE 112   1.117  -2.072   9.019
   70    HE1  PHE 112          1HE       PHE 112   6.007  -1.182   8.839
   71    HE2  PHE 112          2HE       PHE 112   2.699  -3.610  10.146
   72    HZ   PHE 112           HZ       PHE 112   5.146  -3.201  10.030
   73    H    VAL 113           H        VAL 113   2.462  -2.394   5.550
   74    HA   VAL 113           HA       VAL 113  -0.053  -3.904   6.049
   75    HB   VAL 113           HB       VAL 113   1.862  -4.527   3.786
   76   HG11  VAL 113          1HG1      VAL 113   0.104  -6.098   3.103
   77   HG12  VAL 113          2HG1      VAL 113   0.635  -6.468   4.746
   78   HG13  VAL 113          3HG1      VAL 113  -0.901  -5.611   4.490
   79   HG21  VAL 113          1HG2      VAL 113   0.045  -3.823   2.268
   80   HG22  VAL 113          2HG2      VAL 113  -0.875  -3.200   3.655
   81   HG23  VAL 113          3HG2      VAL 113   0.683  -2.470   3.197
   82    H    GLY 114           H        GLY 114   0.329  -5.038   7.841
   83    HA2  GLY 114          1HA       GLY 114   3.093  -6.079   8.398
   84    HA3  GLY 114          2HA       GLY 114   1.912  -5.600   9.602
   85    H    GLY 115           H        GLY 115   3.441  -8.131   9.201
   86    HA2  GLY 115          1HA       GLY 115   2.963 -10.284   9.937
   87    HA3  GLY 115          2HA       GLY 115   1.231  -9.991   9.764
   88    H    LEU 116           H        LEU 116   3.293  -9.296   7.043
   89    HA   LEU 116           HA       LEU 116   1.995 -11.174   5.249
   90    HB2  LEU 116          1HB       LEU 116   4.444  -9.374   5.101
   91    HB3  LEU 116          2HB       LEU 116   4.051 -10.470   3.790
   92    HG   LEU 116           HG       LEU 116   1.974  -8.493   4.774
   93   HD11  LEU 116          1HD1      LEU 116   3.951  -7.154   4.238
   94   HD12  LEU 116          2HD1      LEU 116   2.746  -6.974   2.959
   95   HD13  LEU 116          3HD1      LEU 116   4.160  -8.024   2.703
   96   HD21  LEU 116          1HD2      LEU 116   2.538  -9.735   2.041
   97   HD22  LEU 116          2HD2      LEU 116   1.121  -8.764   2.501
   98   HD23  LEU 116          3HD2      LEU 116   1.353 -10.386   3.178
   99    H    SER 117           H        SER 117   2.741 -13.099   4.406
  100    HA   SER 117           HA       SER 117   4.742 -14.636   5.879
  101    HB2  SER 117          1HB       SER 117   2.913 -15.827   4.861
  102    HB3  SER 117          2HB       SER 117   3.305 -15.167   3.257
  103    HG   SER 117           HG       SER 117   4.135 -17.336   3.716
  104    H    VAL 118           H        VAL 118   6.880 -14.909   5.396
  105    HA   VAL 118           HA       VAL 118   8.230 -13.019   3.725
  106    HB   VAL 118           HB       VAL 118  10.266 -14.072   4.341
  107   HG11  VAL 118          1HG1      VAL 118   8.435 -14.327   6.762
  108   HG12  VAL 118          2HG1      VAL 118  10.165 -13.940   6.720
  109   HG13  VAL 118          3HG1      VAL 118   8.991 -12.778   6.096
  110   HG21  VAL 118          1HG2      VAL 118  10.315 -16.192   5.671
  111   HG22  VAL 118          2HG2      VAL 118   8.596 -16.421   5.338
  112   HG23  VAL 118          3HG2      VAL 118   9.761 -16.445   4.001
  113    H    ASN 119           H        ASN 119   6.681 -15.894   2.789
  114    HA   ASN 119           HA       ASN 119   8.264 -16.366   0.356
  115    HB2  ASN 119          1HB       ASN 119   7.097 -18.187   1.569
  116    HB3  ASN 119          2HB       ASN 119   5.547 -17.381   1.309
  117   HD21  ASN 119          1HD2      ASN 119   8.252 -19.019  -0.364
  118   HD22  ASN 119          2HD2      ASN 119   7.288 -19.449  -1.769
  119    H    THR 120           H        THR 120   5.509 -14.355   1.275
  120    HA   THR 120           HA       THR 120   4.326 -13.994  -1.312
  121    HB   THR 120           HB       THR 120   4.267 -12.281   1.195
  122    HG1  THR 120          1HG       THR 120   2.425 -13.421   1.635
  123   HG21  THR 120          1HG2      THR 120   3.434 -10.939  -0.653
  124   HG22  THR 120          2HG2      THR 120   2.113 -11.420   0.415
  125   HG23  THR 120          3HG2      THR 120   2.331 -12.239  -1.138
  126    H    THR 121           H        THR 121   4.768 -12.652  -2.965
  127    HA   THR 121           HA       THR 121   7.129 -10.925  -2.767
  128    HB   THR 121           HB       THR 121   7.351 -10.833  -4.993
  129    HG1  THR 121          1HG       THR 121   5.623 -11.369  -6.430
  130   HG21  THR 121          1HG2      THR 121   7.561 -13.191  -4.221
  131   HG22  THR 121          2HG2      THR 121   7.135 -13.028  -5.934
  132   HG23  THR 121          3HG2      THR 121   5.886 -13.486  -4.753
  133    H    VAL 122           H        VAL 122   7.262  -8.795  -3.694
  134    HA   VAL 122           HA       VAL 122   5.308  -6.968  -2.708
  135    HB   VAL 122           HB       VAL 122   7.726  -6.492  -3.183
  136   HG11  VAL 122          1HG1      VAL 122   6.815  -6.017  -6.055
  137   HG12  VAL 122          2HG1      VAL 122   8.412  -5.695  -5.359
  138   HG13  VAL 122          3HG1      VAL 122   7.848  -7.364  -5.526
  139   HG21  VAL 122          1HG2      VAL 122   5.732  -4.543  -4.379
  140   HG22  VAL 122          2HG2      VAL 122   6.044  -4.752  -2.642
  141   HG23  VAL 122          3HG2      VAL 122   7.335  -4.169  -3.721
  142    H    GLU 123           H        GLU 123   5.532  -8.564  -5.847
  143    HA   GLU 123           HA       GLU 123   3.420  -6.981  -7.091
  144    HB2  GLU 123          1HB       GLU 123   4.595  -9.688  -7.852
  145    HB3  GLU 123          2HB       GLU 123   3.450  -8.739  -8.815
  146    HG2  GLU 123          1HG       GLU 123   5.112  -6.855  -8.854
  147    HG3  GLU 123          2HG       GLU 123   6.279  -7.906  -8.042
  148    H    ASP 124           H        ASP 124   3.553 -10.100  -5.304
  149    HA   ASP 124           HA       ASP 124   0.788 -10.785  -5.547
  150    HB2  ASP 124          1HB       ASP 124   2.622 -11.196  -3.166
  151    HB3  ASP 124          2HB       ASP 124   1.034 -11.901  -3.352
  152    H    VAL 125           H        VAL 125   2.422  -8.739  -3.058
  153    HA   VAL 125           HA       VAL 125   0.017  -8.095  -1.646
  154    HB   VAL 125           HB       VAL 125   2.614  -6.514  -1.826
  155   HG11  VAL 125          1HG1      VAL 125   1.905  -5.516   0.334
  156   HG12  VAL 125          2HG1      VAL 125   0.797  -5.083  -0.968
  157   HG13  VAL 125          3HG1      VAL 125   0.337  -6.344   0.199
  158   HG21  VAL 125          1HG2      VAL 125   2.990  -8.734  -0.901
  159   HG22  VAL 125          2HG2      VAL 125   2.971  -7.607   0.448
  160   HG23  VAL 125          3HG2      VAL 125   1.548  -8.612   0.117
  161    H    LYS 126           H        LYS 126   1.639  -6.334  -4.354
  162    HA   LYS 126           HA       LYS 126  -0.285  -4.229  -4.494
  163    HB2  LYS 126          1HB       LYS 126   1.803  -4.016  -5.623
  164    HB3  LYS 126          2HB       LYS 126   1.510  -5.442  -6.626
  165    HG2  LYS 126          1HG       LYS 126  -0.098  -4.357  -7.959
  166    HG3  LYS 126          2HG       LYS 126  -0.406  -3.103  -6.757
  167    HD2  LYS 126          1HD       LYS 126   1.805  -2.100  -7.163
  168    HD3  LYS 126          2HD       LYS 126   2.185  -3.386  -8.333
  169    HE2  LYS 126          1HE       LYS 126   0.262  -2.686  -9.729
  170    HE3  LYS 126          2HE       LYS 126  -0.136  -1.407  -8.581
  171    HZ1  LYS 126          1HZ       LYS 126   1.918  -0.281  -9.125
  172    HZ2  LYS 126          2HZ       LYS 126   1.204  -0.656 -10.528
  173    HZ3  LYS 126          3HZ       LYS 126   2.466  -1.548 -10.020
  174    H    HIS 127           H        HIS 127  -0.311  -7.358  -6.312
  175    HA   HIS 127           HA       HIS 127  -2.830  -6.902  -7.570
  176    HB2  HIS 127          1HB       HIS 127  -1.311  -9.428  -6.896
  177    HB3  HIS 127          2HB       HIS 127  -2.885  -9.461  -7.689
  178    HD2  HIS 127          2HD       HIS 127   0.559  -9.622  -8.672
  179    HE1  HIS 127          1HE       HIS 127  -1.333  -7.759 -12.008
  180    HE2  HIS 127          2HE       HIS 127   0.776  -8.946 -11.214
  181    H    TYR 128           H        TYR 128  -2.183  -8.421  -4.372
  182    HA   TYR 128           HA       TYR 128  -4.943  -8.849  -3.809
  183    HB2  TYR 128          1HB       TYR 128  -2.451  -8.992  -2.202
  184    HB3  TYR 128          2HB       TYR 128  -3.978  -8.873  -1.378
  185    HD1  TYR 128          1HD       TYR 128  -1.811 -11.125  -3.295
  186    HD2  TYR 128          2HD       TYR 128  -5.761 -10.576  -1.662
  187    HE1  TYR 128          1HE       TYR 128  -2.189 -13.578  -3.389
  188    HE2  TYR 128          2HE       TYR 128  -6.145 -13.028  -1.767
  189    HH   TYR 128           HH       TYR 128  -5.270 -15.077  -2.355
  190    H    PHE 129           H        PHE 129  -3.312  -5.837  -3.780
  191    HA   PHE 129           HA       PHE 129  -5.639  -4.699  -2.339
  192    HB2  PHE 129          1HB       PHE 129  -2.900  -3.561  -2.694
  193    HB3  PHE 129          2HB       PHE 129  -4.288  -2.586  -2.230
  194    HD1  PHE 129          1HD       PHE 129  -5.763  -3.510  -0.201
  195    HD2  PHE 129          2HD       PHE 129  -1.671  -4.611  -0.961
  196    HE1  PHE 129          1HE       PHE 129  -5.528  -4.302   2.144
  197    HE2  PHE 129          2HE       PHE 129  -1.445  -5.386   1.383
  198    HZ   PHE 129           HZ       PHE 129  -3.373  -5.227   2.942
  199    H    GLU 130           H        GLU 130  -4.286  -4.726  -5.521
  200    HA   GLU 130           HA       GLU 130  -5.670  -2.584  -6.715
  201    HB2  GLU 130          1HB       GLU 130  -4.933  -5.311  -7.807
  202    HB3  GLU 130          2HB       GLU 130  -5.522  -4.000  -8.815
  203    HG2  GLU 130          1HG       GLU 130  -3.193  -3.307  -7.080
  204    HG3  GLU 130          2HG       GLU 130  -2.879  -4.526  -8.285
  205    H    GLN 131           H        GLN 131  -7.058  -5.585  -5.564
  206    HA   GLN 131           HA       GLN 131  -9.474  -5.590  -7.081
  207    HB2  GLN 131          1HB       GLN 131 -10.352  -7.039  -5.341
  208    HB3  GLN 131          2HB       GLN 131  -8.723  -7.527  -5.818
  209    HG2  GLN 131          1HG       GLN 131  -7.807  -6.476  -3.766
  210    HG3  GLN 131          2HG       GLN 131  -9.431  -5.983  -3.284
  211   HE21  GLN 131          1HE2      GLN 131  -7.384  -7.919  -2.051
  212   HE22  GLN 131          2HE2      GLN 131  -8.379  -9.348  -1.746
  213    H    PHE 132           H        PHE 132  -8.584  -3.648  -4.241
  214    HA   PHE 132           HA       PHE 132 -11.343  -2.784  -3.732
  215    HB2  PHE 132          1HB       PHE 132  -8.679  -1.828  -2.605
  216    HB3  PHE 132          2HB       PHE 132 -10.268  -1.356  -2.026
  217    HD1  PHE 132          1HD       PHE 132 -11.912  -3.360  -1.383
  218    HD2  PHE 132          2HD       PHE 132  -7.633  -3.721  -1.691
  219    HE1  PHE 132          1HE       PHE 132 -11.984  -5.438  -0.021
  220    HE2  PHE 132          2HE       PHE 132  -7.696  -5.763  -0.288
  221    HZ   PHE 132           HZ       PHE 132  -9.876  -6.638   0.536
  222    H    GLY 133           H        GLY 133  -8.629  -1.620  -5.526
  223    HA2  GLY 133          1HA       GLY 133  -9.769   0.170  -7.261
  224    HA3  GLY 133          2HA       GLY 133  -9.403   1.145  -5.832
  225    H    LYS 134           H        LYS 134  -8.062   1.807  -8.085
  226    HA   LYS 134           HA       LYS 134  -5.870   0.188  -8.765
  227    HB2  LYS 134          1HB       LYS 134  -6.915   1.970 -10.211
  228    HB3  LYS 134          2HB       LYS 134  -6.090   3.176  -9.233
  229    HG2  LYS 134          1HG       LYS 134  -4.650   2.900 -11.062
  230    HG3  LYS 134          2HG       LYS 134  -3.889   1.912  -9.840
  231    HD2  LYS 134          1HD       LYS 134  -5.259  -0.076 -10.896
  232    HD3  LYS 134          2HD       LYS 134  -5.609   1.047 -12.202
  233    HE2  LYS 134          1HE       LYS 134  -3.757  -0.287 -12.884
  234    HE3  LYS 134          2HE       LYS 134  -3.138   1.338 -12.568
  235    HZ1  LYS 134          1HZ       LYS 134  -1.752  -0.465 -11.614
  236    HZ2  LYS 134          2HZ       LYS 134  -2.965  -0.942 -10.640
  237    HZ3  LYS 134          3HZ       LYS 134  -2.284   0.525 -10.423
  238    H    VAL 135           H        VAL 135  -3.961  -0.119  -8.124
  239    HA   VAL 135           HA       VAL 135  -2.745   1.413  -5.857
  240    HB   VAL 135           HB       VAL 135  -2.065  -1.294  -7.040
  241   HG11  VAL 135          1HG1      VAL 135  -0.885   0.099  -4.621
  242   HG12  VAL 135          2HG1      VAL 135  -0.613  -1.590  -5.051
  243   HG13  VAL 135          3HG1      VAL 135  -0.028  -0.310  -6.122
  244   HG21  VAL 135          1HG2      VAL 135  -4.203  -1.240  -5.735
  245   HG22  VAL 135          2HG2      VAL 135  -2.949  -2.216  -4.961
  246   HG23  VAL 135          3HG2      VAL 135  -3.316  -0.580  -4.351
  247    H    ASP 136           H        ASP 136  -0.971   2.598  -6.149
  248    HA   ASP 136           HA       ASP 136   0.091   3.070  -8.851
  249    HB2  ASP 136          1HB       ASP 136  -0.269   5.008  -7.527
  250    HB3  ASP 136          2HB       ASP 136   0.571   4.314  -6.145
  251    H    ASP 137           H        ASP 137   1.469   2.005  -5.710
  252    HA   ASP 137           HA       ASP 137   3.486   0.311  -7.032
  253    HB2  ASP 137          1HB       ASP 137   4.268   2.781  -7.095
  254    HB3  ASP 137          2HB       ASP 137   4.320   2.715  -5.335
  255    H    ALA 138           H        ALA 138   4.931  -0.661  -5.320
  256    HA   ALA 138           HA       ALA 138   4.018  -0.623  -2.547
  257    HB1  ALA 138          1HB       ALA 138   2.486  -2.299  -3.486
  258    HB2  ALA 138          2HB       ALA 138   3.846  -3.181  -4.208
  259    HB3  ALA 138          3HB       ALA 138   3.678  -3.092  -2.440
  260    H    MET 139           H        MET 139   5.515  -1.685  -1.096
  261    HA   MET 139           HA       MET 139   8.065  -2.710  -2.146
  262    HB2  MET 139          1HB       MET 139   9.467  -1.110  -0.921
  263    HB3  MET 139          2HB       MET 139   8.561  -0.359  -2.230
  264    HG2  MET 139          1HG       MET 139   6.917   0.525  -0.575
  265    HG3  MET 139          2HG       MET 139   7.872  -0.193   0.726
  266    HE1  MET 139          1HE       MET 139   8.181   1.923   2.103
  267    HE2  MET 139          2HE       MET 139   8.642   3.501   1.427
  268    HE3  MET 139          3HE       MET 139   7.091   2.761   0.972
  269    H    LEU 140           H        LEU 140   8.712  -4.375  -0.906
  270    HA   LEU 140           HA       LEU 140   7.656  -4.581   1.881
  271    HB2  LEU 140          1HB       LEU 140   8.904  -6.841   0.337
  272    HB3  LEU 140          2HB       LEU 140   7.959  -6.899   1.824
  273    HG   LEU 140           HG       LEU 140   6.964  -6.326  -0.990
  274   HD11  LEU 140          1HD1      LEU 140   6.304  -8.516   1.008
  275   HD12  LEU 140          2HD1      LEU 140   7.328  -8.697  -0.435
  276   HD13  LEU 140          3HD1      LEU 140   5.598  -8.344  -0.604
  277   HD21  LEU 140          1HD2      LEU 140   5.661  -4.884   0.527
  278   HD22  LEU 140          2HD2      LEU 140   5.334  -6.278   1.575
  279   HD23  LEU 140          3HD2      LEU 140   4.697  -6.213  -0.092
  280    H    MET 141           H        MET 141   9.038  -5.030   3.624
  281    HA   MET 141           HA       MET 141  11.583  -3.620   3.280
  282    HB2  MET 141          1HB       MET 141  10.190  -4.662   5.758
  283    HB3  MET 141          2HB       MET 141  11.686  -3.724   5.747
  284    HG2  MET 141          1HG       MET 141   8.957  -2.798   4.774
  285    HG3  MET 141          2HG       MET 141   9.825  -2.292   6.209
  286    HE1  MET 141          1HE       MET 141  10.039  -0.318   2.160
  287    HE2  MET 141          2HE       MET 141  10.245  -2.074   2.123
  288    HE3  MET 141          3HE       MET 141   8.776  -1.368   2.841
  289    H    PHE 142           H        PHE 142  12.678  -5.067   1.961
  290    HA   PHE 142           HA       PHE 142  13.502  -7.634   2.688
  291    HB2  PHE 142          1HB       PHE 142  14.478  -5.764   0.655
  292    HB3  PHE 142          2HB       PHE 142  15.482  -7.127   1.102
  293    HD1  PHE 142          1HD       PHE 142  15.269  -9.036  -0.184
  294    HD2  PHE 142          2HD       PHE 142  11.792  -6.559   0.383
  295    HE1  PHE 142          1HE       PHE 142  13.948 -10.546  -1.640
  296    HE2  PHE 142          2HE       PHE 142  10.465  -8.091  -1.044
  297    HZ   PHE 142           HZ       PHE 142  11.540 -10.093  -2.055
  298    H    ASP 143           H        ASP 143  15.115  -8.693   3.542
  299    HA   ASP 143           HA       ASP 143  16.771  -7.406   5.597
  300    HB2  ASP 143          1HB       ASP 143  15.623  -9.753   5.615
  301    HB3  ASP 143          2HB       ASP 143  16.895 -10.256   4.503
  302    H    LYS 144           H        LYS 144  19.056  -7.371   5.376
  303    HA   LYS 144           HA       LYS 144  19.819  -6.375   2.779
  304    HB2  LYS 144          1HB       LYS 144  21.956  -5.691   3.866
  305    HB3  LYS 144          2HB       LYS 144  20.545  -5.144   4.748
  306    HG2  LYS 144          1HG       LYS 144  21.737  -7.781   5.585
  307    HG3  LYS 144          2HG       LYS 144  22.688  -6.335   5.912
  308    HD2  LYS 144          1HD       LYS 144  20.974  -5.330   7.240
  309    HD3  LYS 144          2HD       LYS 144  19.780  -6.543   6.802
  310    HE2  LYS 144          1HE       LYS 144  22.308  -7.072   8.425
  311    HE3  LYS 144          2HE       LYS 144  20.685  -6.840   9.085
  312    HZ1  LYS 144          1HZ       LYS 144  21.049  -9.173   8.908
  313    HZ2  LYS 144          2HZ       LYS 144  21.558  -9.087   7.361
  314    HZ3  LYS 144          3HZ       LYS 144  19.986  -8.803   7.712
  315    H    THR 145           H        THR 145  19.867  -9.471   3.614
  316    HA   THR 145           HA       THR 145  22.180 -10.494   2.120
  317    HB   THR 145           HB       THR 145  20.482 -12.455   1.921
  318    HG1  THR 145          1HG       THR 145  18.785 -12.284   3.502
  319   HG21  THR 145          1HG2      THR 145  22.241 -12.397   3.683
  320   HG22  THR 145          2HG2      THR 145  20.748 -13.151   4.267
  321   HG23  THR 145          3HG2      THR 145  21.141 -11.480   4.739
  322    H    THR 146           H        THR 146  19.129  -9.015   1.442
  323    HA   THR 146           HA       THR 146  17.881  -8.552  -0.258
  324    HB   THR 146           HB       THR 146  18.444  -7.965  -2.301
  325    HG1  THR 146          1HG       THR 146  19.059  -9.917  -3.144
  326   HG21  THR 146          1HG2      THR 146  21.217  -8.042  -1.041
  327   HG22  THR 146          2HG2      THR 146  19.966  -6.827  -0.683
  328   HG23  THR 146          3HG2      THR 146  20.637  -6.954  -2.317
  329    H    ASN 147           H        ASN 147  17.984 -11.102   0.974
  330    HA   ASN 147           HA       ASN 147  17.154 -13.040  -1.078
  331    HB2  ASN 147          1HB       ASN 147  18.638 -13.661   0.786
  332    HB3  ASN 147          2HB       ASN 147  17.366 -13.285   1.952
  333   HD21  ASN 147          1HD2      ASN 147  18.016 -15.393  -0.910
  334   HD22  ASN 147          2HD2      ASN 147  17.061 -16.724  -0.277
  335    H    ARG 148           H        ARG 148  15.531 -11.804   1.858
  336    HA   ARG 148           HA       ARG 148  12.837 -11.848   0.640
  337    HB2  ARG 148          1HB       ARG 148  13.733 -13.516   3.025
  338    HB3  ARG 148          2HB       ARG 148  12.044 -13.091   2.768
  339    HG2  ARG 148          1HG       ARG 148  11.950 -14.245   0.661
  340    HG3  ARG 148          2HG       ARG 148  13.670 -14.624   0.702
  341    HD2  ARG 148          1HD       ARG 148  11.720 -15.601   2.805
  342    HD3  ARG 148          2HD       ARG 148  12.220 -16.539   1.388
  343    HE   ARG 148           HE       ARG 148  14.606 -16.192   2.179
  344   HH11  ARG 148          1HH1      ARG 148  12.115 -16.358   4.655
  345   HH12  ARG 148          2HH1      ARG 148  13.323 -16.396   5.922
  346   HH21  ARG 148          1HH2      ARG 148  15.986 -16.264   3.784
  347   HH22  ARG 148          2HH2      ARG 148  15.424 -16.284   5.451
  348    H    HIS 149           H        HIS 149  11.217 -10.928   2.169
  349    HA   HIS 149           HA       HIS 149  12.319  -8.694   3.795
  350    HB2  HIS 149          1HB       HIS 149  10.050  -7.814   3.798
  351    HB3  HIS 149          2HB       HIS 149  10.588  -8.119   2.152
  352    HD2  HIS 149          2HD       HIS 149   9.372 -10.107   0.790
  353    HE1  HIS 149          1HE       HIS 149   6.300 -10.878   3.637
  354    HE2  HIS 149          2HE       HIS 149   7.095 -11.322   1.248
  355    H    ARG 150           H        ARG 150  11.422  -8.173   5.858
  356    HA   ARG 150           HA       ARG 150  11.580 -10.398   7.677
  357    HB2  ARG 150          1HB       ARG 150  12.583  -8.300   8.222
  358    HB3  ARG 150          2HB       ARG 150  11.082  -7.401   7.935
  359    HG2  ARG 150          1HG       ARG 150  10.039  -8.281   9.842
  360    HG3  ARG 150          2HG       ARG 150  11.295  -9.526  10.054
  361    HD2  ARG 150          1HD       ARG 150  12.872  -7.940  10.885
  362    HD3  ARG 150          2HD       ARG 150  11.917  -6.573  10.311
  363    HE   ARG 150           HE       ARG 150  10.790  -6.564  12.305
  364   HH11  ARG 150          1HH1      ARG 150  11.616 -10.011  11.961
  365   HH12  ARG 150          2HH1      ARG 150  10.371 -10.373  13.157
  366   HH21  ARG 150          1HH2      ARG 150   9.488  -7.214  13.781
  367   HH22  ARG 150          2HH2      ARG 150   9.293  -8.952  14.117
  368    H    GLY 151           H        GLY 151   8.869  -9.256   5.957
  369    HA2  GLY 151          1HA       GLY 151   6.789 -10.465   6.193
  370    HA3  GLY 151          2HA       GLY 151   6.970 -10.474   7.942
  371    H    PHE 152           H        PHE 152   7.629  -7.482   6.142
  372    HA   PHE 152           HA       PHE 152   4.881  -6.588   6.233
  373    HB2  PHE 152          1HB       PHE 152   5.115  -4.718   7.696
  374    HB3  PHE 152          2HB       PHE 152   5.574  -6.146   8.582
  375    HD1  PHE 152          1HD       PHE 152   6.651  -2.929   7.255
  376    HD2  PHE 152          2HD       PHE 152   8.001  -6.538   9.184
  377    HE1  PHE 152          1HE       PHE 152   8.666  -1.740   8.048
  378    HE2  PHE 152          2HE       PHE 152  10.029  -5.347   9.979
  379    HZ   PHE 152           HZ       PHE 152  10.371  -2.955   9.421
  380    H    GLY 153           H        GLY 153   4.660  -4.361   5.349
  381    HA2  GLY 153          1HA       GLY 153   6.833  -3.074   3.916
  382    HA3  GLY 153          2HA       GLY 153   5.817  -4.052   2.853
  383    H    PHE 154           H        PHE 154   5.699  -1.816   1.953
  384    HA   PHE 154           HA       PHE 154   3.273  -0.426   2.934
  385    HB2  PHE 154          1HB       PHE 154   5.778   0.748   1.730
  386    HB3  PHE 154          2HB       PHE 154   4.274   1.640   1.893
  387    HD1  PHE 154          1HD       PHE 154   7.082   0.111   3.738
  388    HD2  PHE 154          2HD       PHE 154   3.390   2.314   4.084
  389    HE1  PHE 154          1HE       PHE 154   7.641   0.670   6.066
  390    HE2  PHE 154          2HE       PHE 154   3.984   2.939   6.404
  391    HZ   PHE 154           HZ       PHE 154   6.115   2.134   7.405
  392    H    VAL 155           H        VAL 155   1.844   0.548   1.502
  393    HA   VAL 155           HA       VAL 155   2.116  -0.058  -1.396
  394    HB   VAL 155           HB       VAL 155  -0.451  -0.618   0.106
  395   HG11  VAL 155          1HG1      VAL 155   0.378  -1.160  -2.766
  396   HG12  VAL 155          2HG1      VAL 155  -1.135  -1.706  -2.008
  397   HG13  VAL 155          3HG1      VAL 155  -0.840   0.017  -2.220
  398   HG21  VAL 155          1HG2      VAL 155  -0.061  -2.986  -0.332
  399   HG22  VAL 155          2HG2      VAL 155   1.547  -2.619  -1.000
  400   HG23  VAL 155          3HG2      VAL 155   1.191  -2.341   0.718
  401    H    THR 156           H        THR 156   1.531   1.516  -2.708
  402    HA   THR 156           HA       THR 156   0.291   3.956  -1.608
  403    HB   THR 156           HB       THR 156   1.922   4.009  -4.105
  404    HG1  THR 156          1HG       THR 156   3.714   4.459  -2.854
  405   HG21  THR 156          1HG2      THR 156   1.422   6.059  -1.903
  406   HG22  THR 156          2HG2      THR 156   0.651   6.050  -3.507
  407   HG23  THR 156          3HG2      THR 156   2.393   6.314  -3.369
  408    H    PHE 157           H        PHE 157  -1.365   5.109  -2.646
  409    HA   PHE 157           HA       PHE 157  -2.887   3.459  -4.578
  410    HB2  PHE 157          1HB       PHE 157  -3.758   4.985  -2.145
  411    HB3  PHE 157          2HB       PHE 157  -4.887   4.446  -3.376
  412    HD1  PHE 157          1HD       PHE 157  -2.380   3.241  -0.888
  413    HD2  PHE 157          2HD       PHE 157  -5.609   2.156  -3.534
  414    HE1  PHE 157          1HE       PHE 157  -2.442   0.983   0.103
  415    HE2  PHE 157          2HE       PHE 157  -5.700  -0.094  -2.489
  416    HZ   PHE 157           HZ       PHE 157  -4.106  -0.692  -0.673
  417    H    GLU 158           H        GLU 158  -4.394   4.310  -5.979
  418    HA   GLU 158           HA       GLU 158  -3.645   6.797  -7.282
  419    HB2  GLU 158          1HB       GLU 158  -4.498   4.862  -8.514
  420    HB3  GLU 158          2HB       GLU 158  -6.001   4.913  -7.598
  421    HG2  GLU 158          1HG       GLU 158  -6.393   5.752  -9.796
  422    HG3  GLU 158          2HG       GLU 158  -6.629   7.044  -8.638
  423    H    SER 159           H        SER 159  -6.125   5.966  -4.880
  424    HA   SER 159           HA       SER 159  -6.776   8.839  -4.566
  425    HB2  SER 159          1HB       SER 159  -8.460   8.067  -6.117
  426    HB3  SER 159          2HB       SER 159  -8.849   6.685  -5.076
  427    HG   SER 159           HG       SER 159 -10.249   8.599  -4.894
  428    H    GLU 160           H        GLU 160  -7.515   9.450  -2.566
  429    HA   GLU 160           HA       GLU 160  -6.692   7.844  -0.296
  430    HB2  GLU 160          1HB       GLU 160  -8.257  10.453  -0.471
  431    HB3  GLU 160          2HB       GLU 160  -7.688   9.721   1.042
  432    HG2  GLU 160          1HG       GLU 160  -5.368   9.910   0.344
  433    HG3  GLU 160          2HG       GLU 160  -5.863  10.441  -1.269
  434    H    ASP 161           H        ASP 161  -9.718   8.243  -2.052
  435    HA   ASP 161           HA       ASP 161 -11.477   7.166  -0.047
  436    HB2  ASP 161          1HB       ASP 161 -11.668   7.288  -3.064
  437    HB3  ASP 161          2HB       ASP 161 -12.903   6.546  -2.056
  438    H    ILE 162           H        ILE 162  -9.271   5.560  -2.280
  439    HA   ILE 162           HA       ILE 162 -10.300   2.890  -1.656
  440    HB   ILE 162           HB       ILE 162  -7.528   3.505  -2.707
  441   HG12  ILE 162          1HG1      ILE 162  -8.870   4.592  -4.300
  442   HG13  ILE 162          2HG1      ILE 162  -8.419   3.028  -4.960
  443   HG21  ILE 162          1HG2      ILE 162  -7.815   1.205  -3.705
  444   HG22  ILE 162          2HG2      ILE 162  -7.812   1.230  -1.945
  445   HG23  ILE 162          3HG2      ILE 162  -9.345   1.054  -2.818
  446   HD11  ILE 162          1HD1      ILE 162 -11.151   3.847  -3.873
  447   HD12  ILE 162          2HD1      ILE 162 -10.722   3.436  -5.541
  448   HD13  ILE 162          3HD1      ILE 162 -10.733   2.174  -4.289
  449    H    VAL 163           H        VAL 163  -7.614   4.976  -0.472
  450    HA   VAL 163           HA       VAL 163  -6.491   3.089   1.323
  451    HB   VAL 163           HB       VAL 163  -6.691   6.126   1.619
  452   HG11  VAL 163          1HG1      VAL 163  -4.709   5.893   3.132
  453   HG12  VAL 163          2HG1      VAL 163  -6.196   5.240   3.822
  454   HG13  VAL 163          3HG1      VAL 163  -4.986   4.138   3.146
  455   HG21  VAL 163          1HG2      VAL 163  -4.357   6.057   0.811
  456   HG22  VAL 163          2HG2      VAL 163  -4.497   4.308   0.556
  457   HG23  VAL 163          3HG2      VAL 163  -5.491   5.437  -0.395
  458    H    GLU 164           H        GLU 164  -9.179   5.429   1.877
  459    HA   GLU 164           HA       GLU 164  -9.824   4.557   4.540
  460    HB2  GLU 164          1HB       GLU 164 -11.618   5.685   2.346
  461    HB3  GLU 164          2HB       GLU 164 -12.117   5.478   4.017
  462    HG2  GLU 164          1HG       GLU 164  -9.856   7.293   3.080
  463    HG3  GLU 164          2HG       GLU 164 -11.503   7.806   3.423
  464    H    LYS 165           H        LYS 165 -11.207   3.420   1.403
  465    HA   LYS 165           HA       LYS 165 -13.029   1.505   2.418
  466    HB2  LYS 165          1HB       LYS 165 -12.875   2.337   0.085
  467    HB3  LYS 165          2HB       LYS 165 -11.394   1.406  -0.148
  468    HG2  LYS 165          1HG       LYS 165 -12.685  -0.700   0.352
  469    HG3  LYS 165          2HG       LYS 165 -14.161   0.265   0.431
  470    HD2  LYS 165          1HD       LYS 165 -12.289  -0.048  -1.953
  471    HD3  LYS 165          2HD       LYS 165 -13.843  -0.851  -1.768
  472    HE2  LYS 165          1HE       LYS 165 -13.414   2.163  -2.042
  473    HE3  LYS 165          2HE       LYS 165 -13.891   1.073  -3.342
  474    HZ1  LYS 165          1HZ       LYS 165 -15.507   1.601  -0.901
  475    HZ2  LYS 165          2HZ       LYS 165 -15.926   0.565  -2.095
  476    HZ3  LYS 165          3HZ       LYS 165 -15.826   2.162  -2.397
  477    H    VAL 166           H        VAL 166  -9.647   1.039   1.501
  478    HA   VAL 166           HA       VAL 166  -9.415  -1.750   2.190
  479    HB   VAL 166           HB       VAL 166  -7.306   0.433   1.970
  480   HG11  VAL 166          1HG1      VAL 166  -6.389  -1.491   3.194
  481   HG12  VAL 166          2HG1      VAL 166  -7.036  -2.589   1.952
  482   HG13  VAL 166          3HG1      VAL 166  -5.736  -1.449   1.550
  483   HG21  VAL 166          1HG2      VAL 166  -7.969  -1.694  -0.093
  484   HG22  VAL 166          2HG2      VAL 166  -8.687  -0.088  -0.161
  485   HG23  VAL 166          3HG2      VAL 166  -6.942  -0.255  -0.274
  486    H    CYS 167           H        CYS 167  -8.466   1.242   3.986
  487    HA   CYS 167           HA       CYS 167  -7.455  -0.151   6.246
  488    HB2  CYS 167          1HB       CYS 167  -8.362   2.716   5.843
  489    HB3  CYS 167          2HB       CYS 167  -7.721   2.129   7.381
  490    HG   CYS 167           HG       CYS 167  -6.367   2.294   4.405
  491    H    GLU 168           H        GLU 168 -10.795   0.972   5.657
  492    HA   GLU 168           HA       GLU 168 -11.780   0.438   8.301
  493    HB2  GLU 168          1HB       GLU 168 -13.072   0.598   5.565
  494    HB3  GLU 168          2HB       GLU 168 -14.022   0.216   6.988
  495    HG2  GLU 168          1HG       GLU 168 -12.313   2.728   6.738
  496    HG3  GLU 168          2HG       GLU 168 -14.016   2.641   6.301
  497    H    ILE 169           H        ILE 169 -10.993  -1.807   5.725
  498    HA   ILE 169           HA       ILE 169 -12.501  -4.057   6.825
  499    HB   ILE 169           HB       ILE 169 -10.228  -3.878   4.824
  500   HG12  ILE 169          1HG1      ILE 169 -13.166  -4.589   4.352
  501   HG13  ILE 169          2HG1      ILE 169 -12.615  -2.923   4.302
  502   HG21  ILE 169          1HG2      ILE 169 -11.862  -6.320   5.618
  503   HG22  ILE 169          2HG2      ILE 169 -10.790  -6.228   4.204
  504   HG23  ILE 169          3HG2      ILE 169 -10.110  -6.080   5.810
  505   HD11  ILE 169          1HD1      ILE 169 -11.046  -3.432   2.481
  506   HD12  ILE 169          2HD1      ILE 169 -11.625  -5.117   2.460
  507   HD13  ILE 169          3HD1      ILE 169 -12.728  -3.790   2.058
  508    H    HIS 170           H        HIS 170  -9.310  -2.710   7.274
  509    HA   HIS 170           HA       HIS 170  -7.692  -2.886   8.791
  510    HB2  HIS 170          1HB       HIS 170  -9.619  -2.698  10.346
  511    HB3  HIS 170          2HB       HIS 170  -9.596  -4.446  10.538
  512    HD2  HIS 170          2HD       HIS 170  -6.127  -2.814  10.413
  513    HE1  HIS 170          1HE       HIS 170  -6.951  -3.537  14.527
  514    HE2  HIS 170          2HE       HIS 170  -5.142  -2.894  12.842
  515    H    PHE 171           H        PHE 171  -9.208  -6.097   8.550
  516    HA   PHE 171           HA       PHE 171  -6.509  -7.239   8.206
  517    HB2  PHE 171          1HB       PHE 171  -8.700  -8.377   9.846
  518    HB3  PHE 171          2HB       PHE 171  -7.536  -9.426   9.057
  519    HD1  PHE 171          1HD       PHE 171  -5.247  -9.602   9.759
  520    HD2  PHE 171          2HD       PHE 171  -7.874  -6.694  11.564
  521    HE1  PHE 171          1HE       PHE 171  -3.587  -9.220  11.569
  522    HE2  PHE 171          2HE       PHE 171  -6.210  -6.315  13.368
  523    HZ   PHE 171           HZ       PHE 171  -4.066  -7.580  13.374
  524    H    HIS 172           H        HIS 172  -5.905  -8.229   6.519
  525    HA   HIS 172           HA       HIS 172  -7.933  -8.912   4.414
  526    HB2  HIS 172          1HB       HIS 172  -5.229  -7.536   4.212
  527    HB3  HIS 172          2HB       HIS 172  -6.140  -8.134   2.832
  528    HD2  HIS 172          2HD       HIS 172  -6.449  -5.414   5.625
  529    HE1  HIS 172          1HE       HIS 172  -8.922  -4.222   2.391
  530    HE2  HIS 172          2HE       HIS 172  -7.944  -3.513   4.612
  531    H    GLU 173           H        GLU 173  -7.680 -10.786   3.278
  532    HA   GLU 173           HA       GLU 173  -5.617 -12.724   4.132
  533    HB2  GLU 173          1HB       GLU 173  -8.005 -13.374   3.906
  534    HB3  GLU 173          2HB       GLU 173  -7.965 -12.904   2.216
  535    HG2  GLU 173          1HG       GLU 173  -7.832 -15.201   2.135
  536    HG3  GLU 173          2HG       GLU 173  -6.162 -14.713   1.880
  537    H    ILE 174           H        ILE 174  -3.718 -12.944   3.100
  538    HA   ILE 174           HA       ILE 174  -3.468 -12.481   0.160
  539    HB   ILE 174           HB       ILE 174  -1.546 -11.432   2.286
  540   HG12  ILE 174          1HG1      ILE 174  -3.553 -10.040   0.494
  541   HG13  ILE 174          2HG1      ILE 174  -3.405  -9.958   2.243
  542   HG21  ILE 174          1HG2      ILE 174  -1.372 -11.208  -0.747
  543   HG22  ILE 174          2HG2      ILE 174  -0.212 -10.568   0.428
  544   HG23  ILE 174          3HG2      ILE 174  -0.387 -12.302   0.241
  545   HD11  ILE 174          1HD1      ILE 174  -1.589  -8.649   0.188
  546   HD12  ILE 174          2HD1      ILE 174  -2.654  -7.876   1.370
  547   HD13  ILE 174          3HD1      ILE 174  -1.205  -8.740   1.923
  548    H    ASN 175           H        ASN 175  -2.560 -14.284  -0.775
  549    HA   ASN 175           HA       ASN 175  -1.723 -16.400  -0.923
  550    HB2  ASN 175          1HB       ASN 175   0.474 -14.975   0.601
  551    HB3  ASN 175          2HB       ASN 175   0.667 -16.598  -0.038
  552   HD21  ASN 175          1HD2      ASN 175   2.354 -14.664  -0.747
  553   HD22  ASN 175          2HD2      ASN 175   2.196 -14.368  -2.482
  554    H    ASN 176           H        ASN 176  -3.678 -16.529   0.871
  555    HA   ASN 176           HA       ASN 176  -4.603 -17.437   2.663
  556    HB2  ASN 176          1HB       ASN 176  -4.240 -19.765   3.094
  557    HB3  ASN 176          2HB       ASN 176  -4.242 -19.418   1.376
  558   HD21  ASN 176          1HD2      ASN 176  -1.991 -19.906   4.116
  559   HD22  ASN 176          2HD2      ASN 176  -0.785 -20.764   3.150
  560    H    LYS 177           H        LYS 177  -2.558 -15.541   3.361
  561    HA   LYS 177           HA       LYS 177  -2.292 -16.214   6.257
  562    HB2  LYS 177          1HB       LYS 177  -0.083 -16.287   5.126
  563    HB3  LYS 177          2HB       LYS 177  -0.367 -14.701   4.440
  564    HG2  LYS 177          1HG       LYS 177   1.168 -14.476   6.253
  565    HG3  LYS 177          2HG       LYS 177  -0.329 -13.661   6.670
  566    HD2  LYS 177          1HD       LYS 177   0.602 -14.840   8.584
  567    HD3  LYS 177          2HD       LYS 177  -0.960 -15.546   8.150
  568    HE2  LYS 177          1HE       LYS 177   0.206 -17.403   6.977
  569    HE3  LYS 177          2HE       LYS 177   1.769 -16.670   7.363
  570    HZ1  LYS 177          1HZ       LYS 177  -0.186 -17.673   9.370
  571    HZ2  LYS 177          2HZ       LYS 177   1.258 -16.994   9.727
  572    HZ3  LYS 177          3HZ       LYS 177   1.198 -18.422   8.943
  573    H    MET 178           H        MET 178  -3.053 -14.632   7.662
  574    HA   MET 178           HA       MET 178  -4.545 -12.400   6.435
  575    HB2  MET 178          1HB       MET 178  -4.523 -13.460   9.277
  576    HB3  MET 178          2HB       MET 178  -5.408 -12.026   8.731
  577    HG2  MET 178          1HG       MET 178  -6.545 -13.454   6.996
  578    HG3  MET 178          2HG       MET 178  -5.769 -14.865   7.713
  579    HE1  MET 178          1HE       MET 178  -9.243 -12.377   9.474
  580    HE2  MET 178          2HE       MET 178  -7.629 -11.656   9.331
  581    HE3  MET 178          3HE       MET 178  -8.499 -12.183   7.870
  582    H    VAL 179           H        VAL 179  -3.967 -10.360   6.478
  583    HA   VAL 179           HA       VAL 179  -1.647  -9.505   8.122
  584    HB   VAL 179           HB       VAL 179  -0.761  -8.187   6.365
  585   HG11  VAL 179          1HG1      VAL 179  -0.032  -9.860   4.838
  586   HG12  VAL 179          2HG1      VAL 179  -0.205 -10.591   6.444
  587   HG13  VAL 179          3HG1      VAL 179  -1.423 -10.904   5.180
  588   HG21  VAL 179          1HG2      VAL 179  -2.790  -7.424   5.205
  589   HG22  VAL 179          2HG2      VAL 179  -1.609  -8.113   4.094
  590   HG23  VAL 179          3HG2      VAL 179  -3.031  -9.062   4.557
  591    H    GLU 180           H        GLU 180  -1.465  -7.320   8.615
  592    HA   GLU 180           HA       GLU 180  -4.131  -6.014   9.031
  593    HB2  GLU 180          1HB       GLU 180  -2.691  -6.604  11.021
  594    HB3  GLU 180          2HB       GLU 180  -1.513  -5.422  10.436
  595    HG2  GLU 180          1HG       GLU 180  -3.427  -3.705  10.457
  596    HG3  GLU 180          2HG       GLU 180  -4.399  -4.926  11.276
  597    H    CYS 181           H        CYS 181  -4.650  -4.196   7.911
  598    HA   CYS 181           HA       CYS 181  -2.511  -2.579   6.616
  599    HB2  CYS 181          1HB       CYS 181  -4.342  -1.354   5.529
  600    HB3  CYS 181          2HB       CYS 181  -4.324  -3.074   5.124
  601    HG   CYS 181           HG       CYS 181  -6.134  -1.587   7.453
  602    H    LYS 182           H        LYS 182  -1.956  -0.569   7.290
  603    HA   LYS 182           HA       LYS 182  -3.685   0.887   9.252
  604    HB2  LYS 182          1HB       LYS 182  -0.670   0.968   9.501
  605    HB3  LYS 182          2HB       LYS 182  -1.863   1.579  10.621
  606    HG2  LYS 182          1HG       LYS 182  -2.388  -0.690  11.372
  607    HG3  LYS 182          2HG       LYS 182  -1.319  -1.384  10.129
  608    HD2  LYS 182          1HD       LYS 182   0.606  -0.118  11.080
  609    HD3  LYS 182          2HD       LYS 182  -0.423   0.474  12.386
  610    HE2  LYS 182          1HE       LYS 182   0.096  -2.469  11.798
  611    HE3  LYS 182          2HE       LYS 182   1.097  -1.501  12.883
  612    HZ1  LYS 182          1HZ       LYS 182  -0.586  -2.715  14.108
  613    HZ2  LYS 182          2HZ       LYS 182  -1.801  -2.070  13.274
  614    HZ3  LYS 182          3HZ       LYS 182  -0.889  -1.109  14.261
  615    H    LYS 183           H        LYS 183  -3.697   3.162   8.881
  616    HA   LYS 183           HA       LYS 183  -2.714   4.195   6.344
  617    HB2  LYS 183          1HB       LYS 183  -3.642   5.618   8.873
  618    HB3  LYS 183          2HB       LYS 183  -3.230   6.441   7.361
  619    HG2  LYS 183          1HG       LYS 183  -4.996   5.266   6.156
  620    HG3  LYS 183          2HG       LYS 183  -5.378   4.288   7.581
  621    HD2  LYS 183          1HD       LYS 183  -6.012   6.341   8.829
  622    HD3  LYS 183          2HD       LYS 183  -5.704   7.308   7.365
  623    HE2  LYS 183          1HE       LYS 183  -7.400   6.010   6.132
  624    HE3  LYS 183          2HE       LYS 183  -7.664   4.968   7.535
  625    HZ1  LYS 183          1HZ       LYS 183  -8.526   6.886   8.743
  626    HZ2  LYS 183          2HZ       LYS 183  -9.338   6.724   7.316
  627    HZ3  LYS 183          3HZ       LYS 183  -8.220   7.883   7.469
  628    H    ALA 184           H        ALA 184  -0.740   5.033   5.794
  629    HA   ALA 184           HA       ALA 184   1.409   4.362   7.552
  630    HB1  ALA 184          1HB       ALA 184   1.480   5.938   4.968
  631    HB2  ALA 184          2HB       ALA 184   2.876   5.200   5.790
  632    HB3  ALA 184          3HB       ALA 184   1.595   4.165   5.137
  633    H    GLN 185           H        GLN 185   2.735   5.528   8.813
  634    HA   GLN 185           HA       GLN 185   2.600   8.483   8.903
  635    HB2  GLN 185          1HB       GLN 185   2.493   6.642  11.322
  636    HB3  GLN 185          2HB       GLN 185   2.651   8.399  11.378
  637    HG2  GLN 185          1HG       GLN 185   0.424   8.574  10.185
  638    HG3  GLN 185          2HG       GLN 185   0.252   6.821  10.347
  639   HE21  GLN 185          1HE2      GLN 185   0.580   9.861  12.261
  640   HE22  GLN 185          2HE2      GLN 185  -0.124   9.167  13.714
  641    HA   PRO 186           HA       PRO 186   6.959   8.237   8.813
  642    HB2  PRO 186          1HB       PRO 186   7.117  10.397  10.911
  643    HB3  PRO 186          2HB       PRO 186   7.892  10.329   9.299
  644    HG2  PRO 186          1HG       PRO 186   5.700  11.864   9.688
  645    HG3  PRO 186          2HG       PRO 186   5.826  10.854   8.209
  646    HD2  PRO 186          1HD       PRO 186   4.339  10.230  10.779
  647    HD3  PRO 186          2HD       PRO 186   3.768  10.128   9.094
  648    H    LYS 187           H        LYS 187   8.858   7.479   9.795
  649    HA   LYS 187           HA       LYS 187   8.708   5.872  12.157
  650    HB2  LYS 187          1HB       LYS 187  11.108   5.565  11.867
  651    HB3  LYS 187          2HB       LYS 187  10.274   5.436  10.322
  652    HG2  LYS 187          1HG       LYS 187  10.969   7.779   9.759
  653    HG3  LYS 187          2HG       LYS 187  11.783   7.902  11.321
  654    HD2  LYS 187          1HD       LYS 187  13.415   7.471   9.614
  655    HD3  LYS 187          2HD       LYS 187  13.314   6.059  10.678
  656    HE2  LYS 187          1HE       LYS 187  11.926   4.875   9.024
  657    HE3  LYS 187          2HE       LYS 187  11.876   6.311   7.992
  658    HZ1  LYS 187          1HZ       LYS 187  14.266   6.107   7.670
  659    HZ2  LYS 187          2HZ       LYS 187  13.534   4.704   7.251
  660    HZ3  LYS 187          3HZ       LYS 187  14.349   4.809   8.666
  661    H    GLU 188           H        GLU 188   9.243   9.183  11.834
  662    HA   GLU 188           HA       GLU 188  10.515   9.725  14.403
  663    HB2  GLU 188          1HB       GLU 188  10.684  11.233  12.487
  664    HB3  GLU 188          2HB       GLU 188   8.932  11.502  12.504
  665    HG2  GLU 188          1HG       GLU 188   9.080  12.583  14.700
  666    HG3  GLU 188          2HG       GLU 188  10.803  12.202  14.803
  667    H    VAL 189           H        VAL 189   7.160   9.384  13.313
  668    HA   VAL 189           HA       VAL 189   5.965  10.282  15.847
  669    HB   VAL 189           HB       VAL 189   4.733   8.862  13.449
  670   HG11  VAL 189          1HG1      VAL 189   3.402  10.289  15.786
  671   HG12  VAL 189          2HG1      VAL 189   2.580   9.716  14.318
  672   HG13  VAL 189          3HG1      VAL 189   3.313   8.549  15.418
  673   HG21  VAL 189          1HG2      VAL 189   5.592  11.081  12.813
  674   HG22  VAL 189          2HG2      VAL 189   3.829  11.119  12.898
  675   HG23  VAL 189          3HG2      VAL 189   4.790  11.813  14.218
  676    H    MET 190           H        MET 190   6.806   7.213  14.285
  677    HA   MET 190           HA       MET 190   5.694   5.564  16.435
  678    HB2  MET 190          1HB       MET 190   7.411   4.863  14.023
  679    HB3  MET 190          2HB       MET 190   6.678   3.700  15.140
  680    HG2  MET 190          1HG       MET 190   5.170   5.689  13.404
  681    HG3  MET 190          2HG       MET 190   5.348   3.970  13.077
  682    HE1  MET 190          1HE       MET 190   1.546   5.062  14.241
  683    HE2  MET 190          2HE       MET 190   2.759   6.281  13.792
  684    HE3  MET 190          3HE       MET 190   2.564   4.815  12.807
  685    H    SER 191           H        SER 191   6.759   6.490  18.233
  686    HA   SER 191           HA       SER 191   9.429   6.861  18.664
  687    HB2  SER 191          1HB       SER 191   7.330   5.958  20.667
  688    HB3  SER 191          2HB       SER 191   8.924   6.600  21.104
  689    HG   SER 191           HG       SER 191   7.302   8.232  21.079
  690    HA   PRO 192           HA       PRO 192  11.365   2.908  18.809
  691    HB2  PRO 192          1HB       PRO 192  13.776   3.472  19.947
  692    HB3  PRO 192          2HB       PRO 192  13.270   4.167  18.378
  693    HG2  PRO 192          1HG       PRO 192  13.039   5.445  21.130
  694    HG3  PRO 192          2HG       PRO 192  13.786   6.139  19.653
  695    HD2  PRO 192          1HD       PRO 192  11.218   6.701  20.338
  696    HD3  PRO 192          2HD       PRO 192  11.686   6.464  18.627
  697    H    THR 193           H        THR 193  10.288   4.257  21.757
  698    HA   THR 193           HA       THR 193  11.543   2.495  23.600
  699    HB   THR 193           HB       THR 193  10.414   3.429  25.313
  700    HG1  THR 193          1HG       THR 193   8.419   4.417  25.137
  701   HG21  THR 193          1HG2      THR 193  10.357   5.819  25.012
  702   HG22  THR 193          2HG2      THR 193  10.164   5.669  23.255
  703   HG23  THR 193          3HG2      THR 193  11.691   5.187  24.035
  704    H    GLY 194           H        GLY 194  10.678   0.920  25.029
  705    HA2  GLY 194          1HA       GLY 194   9.547  -1.045  25.521
  706    HA3  GLY 194          2HA       GLY 194   8.346  -0.671  24.291
  707    H    SER 195           H        SER 195   8.744  -3.158  24.258
  708    HA   SER 195           HA       SER 195  10.177  -3.788  21.796
  709    HB2  SER 195          1HB       SER 195  11.971  -3.967  23.545
  710    HB3  SER 195          2HB       SER 195  11.005  -5.214  24.356
  711    HG   SER 195           HG       SER 195  12.600  -6.073  22.915
  712    H    ALA 196           H        ALA 196   9.678  -5.938  21.007
  713    HA   ALA 196           HA       ALA 196   6.940  -6.758  21.530
  714    HB1  ALA 196          1HB       ALA 196   7.921  -6.740  19.267
  715    HB2  ALA 196          2HB       ALA 196   9.107  -7.970  19.761
  716    HB3  ALA 196          3HB       ALA 196   7.377  -8.366  19.715
  717    H    ARG 197           H        ARG 197   6.260  -8.916  22.036
  718    HA   ARG 197           HA       ARG 197   8.073 -10.791  23.385
  719    HB2  ARG 197          1HB       ARG 197   6.866 -10.840  25.494
  720    HB3  ARG 197          2HB       ARG 197   7.549  -9.244  25.214
  721    HG2  ARG 197          1HG       ARG 197   5.318  -8.405  24.484
  722    HG3  ARG 197          2HG       ARG 197   4.619 -10.001  24.783
  723    HD2  ARG 197          1HD       ARG 197   5.958  -8.228  26.868
  724    HD3  ARG 197          2HD       ARG 197   4.222  -8.370  26.638
  725    HE   ARG 197           HE       ARG 197   6.019 -10.289  27.943
  726   HH11  ARG 197          1HH1      ARG 197   2.802  -9.939  26.589
  727   HH12  ARG 197          2HH1      ARG 197   2.186 -11.301  27.482
  728   HH21  ARG 197          1HH2      ARG 197   5.169 -12.019  29.032
  729   HH22  ARG 197          2HH2      ARG 197   3.495 -12.443  28.827
  730    H    GLY 198           H        GLY 198   6.992 -12.798  24.028
  731    HA2  GLY 198          1HA       GLY 198   4.373 -13.552  23.158
  732    HA3  GLY 198          2HA       GLY 198   5.547 -13.976  21.909
  733    H    ARG 199           H        ARG 199   4.547 -16.125  22.544
  734    HA   ARG 199           HA       ARG 199   5.212 -17.460  24.996
  735    HB2  ARG 199          1HB       ARG 199   3.374 -18.129  23.508
  736    HB3  ARG 199          2HB       ARG 199   4.528 -18.571  22.243
  737    HG2  ARG 199          1HG       ARG 199   5.435 -20.374  23.650
  738    HG3  ARG 199          2HG       ARG 199   4.381 -19.885  24.993
  739    HD2  ARG 199          1HD       ARG 199   2.386 -20.396  23.581
  740    HD3  ARG 199          2HD       ARG 199   3.453 -20.864  22.260
  741    HE   ARG 199           HE       ARG 199   4.045 -22.844  23.357
  742   HH11  ARG 199          1HH1      ARG 199   1.877 -21.043  25.448
  743   HH12  ARG 199          2HH1      ARG 199   1.537 -22.437  26.436
  744   HH21  ARG 199          1HH2      ARG 199   3.588 -24.560  24.675
  745   HH22  ARG 199          2HH2      ARG 199   2.486 -24.371  26.007
  746    H    SER 200           H        SER 200   6.848 -18.758  25.609
  747    HA   SER 200           HA       SER 200   9.474 -18.413  24.505
  748    HB2  SER 200          1HB       SER 200  10.134 -20.048  26.278
  749    HB3  SER 200          2HB       SER 200   9.242 -18.635  26.859
  750    HG   SER 200           HG       SER 200   8.073 -21.185  26.278
  751    H5'    G 201           H5'        G 201   9.459 -15.666  12.213
  752   H5''    G 201           H5"        G 201  10.372 -15.231  13.664
  753    H4'    G 201           H4'        G 201   9.659 -12.914  13.497
  754    H3'    G 201           H3'        G 201   7.443 -13.601  12.052
  755    H2'    G 201           H2'        G 201   8.708 -14.680  10.352
  756   HO2'    G 201           HO2        G 201   8.355 -12.061   9.272
  757    H1'    G 201           H1'        G 201  10.416 -12.172  10.171
  758    H8     G 201          8H          G 201  10.182 -15.919   9.319
  759    H1     G 201          1H          G 201  15.676 -13.092   7.472
  760    H21    G 201          1H2         G 201  15.717 -11.019   8.176
  761    H22    G 201          2H2         G 201  14.384 -10.373   9.139
  762   HO5'    G 201           HO5        G 201   8.315 -16.151  14.192
  763    H5'    U 202           H5'        U 202   5.226  -9.391  12.510
  764   H5''    U 202           H5"        U 202   5.933  -9.707  10.911
  765    H4'    U 202           H4'        U 202   6.704  -7.418  10.737
  766    H3'    U 202           H3'        U 202   6.856  -7.298  13.475
  767    H2'    U 202           H2'        U 202   4.559  -7.378  13.885
  768   HO2'    U 202           HO2        U 202   5.593  -5.080  14.386
  769    H1'    U 202           H1'        U 202   3.977  -5.447  11.642
  770    H3     U 202          3H          U 202  -0.448  -5.805  12.723
  771    H5     U 202          5H          U 202   0.861  -9.782  12.786
  772    H6     U 202          6H          U 202   3.127  -9.014  12.335
  773    H5'    A 203           H5'        A 203   6.775  -2.133  13.666
  774   H5''    A 203           H5"        A 203   6.153  -3.048  12.283
  775    H4'    A 203           H4'        A 203   7.689  -1.724  10.794
  776    H3'    A 203           H3'        A 203   8.902  -0.634  13.038
  777    H2'    A 203           H2'        A 203   6.743   0.318  13.736
  778   HO2'    A 203           HO2        A 203   8.399   2.275  12.518
  779    H1'    A 203           H1'        A 203   6.628   1.152  10.812
  780    H8     A 203          8H          A 203   4.128   0.284  13.717
  781    H61    A 203          1H6         A 203   0.358   3.919  10.228
  782    H62    A 203          2H6         A 203   0.390   2.978  11.725
  783    H2     A 203          2H          A 203   4.250   3.925   8.414
  784    H5'    G 204           H5'        G 204  10.322  -0.671   9.184
  785   H5''    G 204           H5"        G 204  12.021  -0.423   9.593
  786    H4'    G 204           H4'        G 204  11.698  -0.740   7.178
  787    H3'    G 204           H3'        G 204  13.232   1.340   8.296
  788    H2'    G 204           H2'        G 204  11.542   2.973   7.850
  789   HO2'    G 204           HO2        G 204  13.410   2.768   5.727
  790    H1'    G 204           H1'        G 204  11.196   1.506   5.231
  791    H8     G 204          8H          G 204   9.812   2.977   3.700
  792    H1     G 204          1H          G 204   6.287   5.367   8.547
  793    H21    G 204          1H2         G 204   7.018   4.429  10.468
  794    H22    G 204          2H2         G 204   8.495   3.463  10.470
  795    H5'    U 205           H5'        U 205  13.384  -2.264   5.109
  796   H5''    U 205           H5"        U 205  15.002  -2.944   5.316
  797    H4'    U 205           H4'        U 205  14.332  -3.565   3.156
  798    H3'    U 205           H3'        U 205  16.618  -2.053   3.321
  799   HO3'    U 205           HO3        U 205  16.714  -2.597   0.944
  800    H2'    U 205           H2'        U 205  15.543   0.015   2.828
  801   HO2'    U 205           HO2        U 205  17.183  -0.167   1.223
  802    H1'    U 205           H1'        U 205  13.966  -1.394   0.667
  803    H3     U 205          3H          U 205  11.950   2.488  -0.529
  804    H5     U 205          5H          U 205  12.341   2.920   3.609
  805    H6     U 205          6H          U 205  13.361   0.691   3.709
  Start of MODEL   19
    1    H1   GLY 105          1H        GLY 105  -6.478  18.775   4.725
    2    H2   GLY 105          2H        GLY 105  -6.729  18.409   6.300
    3    H3   GLY 105          3H        GLY 105  -7.990  18.432   5.255
    4    HA2  GLY 105          1HA       GLY 105  -7.371  16.158   5.749
    5    HA3  GLY 105          2HA       GLY 105  -7.126  16.554   4.038
    6    H    SER 106           H        SER 106  -5.786  14.622   6.022
    7    HA   SER 106           HA       SER 106  -3.035  15.577   6.240
    8    HB2  SER 106          1HB       SER 106  -4.266  12.881   6.908
    9    HB3  SER 106          2HB       SER 106  -2.645  13.442   7.368
   10    HG   SER 106           HG       SER 106  -4.173  13.769   9.047
   11    H    HIS 107           H        HIS 107  -4.657  14.049   3.696
   12    HA   HIS 107           HA       HIS 107  -4.065  13.013   1.786
   13    HB2  HIS 107          1HB       HIS 107  -1.347  14.279   2.175
   14    HB3  HIS 107          2HB       HIS 107  -2.065  13.739   0.662
   15    HD2  HIS 107          2HD       HIS 107  -4.681  15.051   0.248
   16    HE1  HIS 107          1HE       HIS 107  -3.217  18.726   1.847
   17    HE2  HIS 107          2HE       HIS 107  -5.067  17.652   0.464
   18    H    MET 108           H        MET 108  -3.858  11.281   4.041
   19    HA   MET 108           HA       MET 108  -1.603   9.497   3.656
   20    HB2  MET 108          1HB       MET 108  -4.116   9.439   5.293
   21    HB3  MET 108          2HB       MET 108  -3.382   7.891   4.877
   22    HG2  MET 108          1HG       MET 108  -2.484   8.516   6.960
   23    HG3  MET 108          2HG       MET 108  -1.211   8.619   5.752
   24    HE1  MET 108          1HE       MET 108   0.019  11.342   8.171
   25    HE2  MET 108          2HE       MET 108  -0.638   9.726   8.517
   26    HE3  MET 108          3HE       MET 108   0.459   9.963   7.139
   27    H    LYS 109           H        LYS 109  -1.482   9.214   1.443
   28    HA   LYS 109           HA       LYS 109  -3.387   7.276   0.218
   29    HB2  LYS 109          1HB       LYS 109  -1.060   8.779  -1.023
   30    HB3  LYS 109          2HB       LYS 109  -2.092   7.601  -1.840
   31    HG2  LYS 109          1HG       LYS 109  -4.084   9.096  -1.104
   32    HG3  LYS 109          2HG       LYS 109  -2.849  10.349  -0.845
   33    HD2  LYS 109          1HD       LYS 109  -2.052   9.787  -3.243
   34    HD3  LYS 109          2HD       LYS 109  -3.536   8.814  -3.374
   35    HE2  LYS 109          1HE       LYS 109  -4.907  10.817  -2.948
   36    HE3  LYS 109          2HE       LYS 109  -3.453  11.798  -2.743
   37    HZ1  LYS 109          1HZ       LYS 109  -4.225  10.397  -5.256
   38    HZ2  LYS 109          2HZ       LYS 109  -2.895  11.338  -5.069
   39    HZ3  LYS 109          3HZ       LYS 109  -4.384  12.005  -4.983
   40    H    LYS 110           H        LYS 110  -1.520   6.545   2.474
   41    HA   LYS 110           HA       LYS 110  -0.107   4.264   1.166
   42    HB2  LYS 110          1HB       LYS 110   1.423   6.220   1.437
   43    HB3  LYS 110          2HB       LYS 110   1.117   6.192   3.171
   44    HG2  LYS 110          1HG       LYS 110   2.117   3.841   3.214
   45    HG3  LYS 110          2HG       LYS 110   2.518   4.053   1.501
   46    HD2  LYS 110          1HD       LYS 110   3.870   6.074   2.084
   47    HD3  LYS 110          2HD       LYS 110   3.456   5.850   3.794
   48    HE2  LYS 110          1HE       LYS 110   4.542   3.591   3.715
   49    HE3  LYS 110          2HE       LYS 110   5.041   3.914   2.049
   50    HZ1  LYS 110          1HZ       LYS 110   6.807   4.436   3.663
   51    HZ2  LYS 110          2HZ       LYS 110   5.863   5.493   4.444
   52    HZ3  LYS 110          3HZ       LYS 110   6.336   5.813   2.903
   53    H    ILE 111           H        ILE 111  -0.098   2.386   2.288
   54    HA   ILE 111           HA       ILE 111  -1.083   2.396   5.108
   55    HB   ILE 111           HB       ILE 111  -2.287   0.371   4.841
   56   HG12  ILE 111          1HG1      ILE 111  -1.274   0.269   2.007
   57   HG13  ILE 111          2HG1      ILE 111  -0.929  -0.864   3.304
   58   HG21  ILE 111          1HG2      ILE 111  -3.376   2.521   4.265
   59   HG22  ILE 111          2HG2      ILE 111  -3.133   2.152   2.536
   60   HG23  ILE 111          3HG2      ILE 111  -4.149   1.101   3.555
   61   HD11  ILE 111          1HD1      ILE 111  -2.505  -1.885   1.807
   62   HD12  ILE 111          2HD1      ILE 111  -3.308  -1.565   3.358
   63   HD13  ILE 111          3HD1      ILE 111  -3.621  -0.519   1.950
   64    H    PHE 112           H        PHE 112  -0.365   0.887   6.444
   65    HA   PHE 112           HA       PHE 112   2.256  -0.460   5.997
   66    HB2  PHE 112          1HB       PHE 112   1.570   0.866   8.119
   67    HB3  PHE 112          2HB       PHE 112   0.349  -0.368   8.393
   68    HD1  PHE 112          1HD       PHE 112   1.037  -2.722   8.985
   69    HD2  PHE 112          2HD       PHE 112   3.884   0.485   8.586
   70    HE1  PHE 112          1HE       PHE 112   2.741  -4.079  10.174
   71    HE2  PHE 112          2HE       PHE 112   5.588  -0.869   9.724
   72    HZ   PHE 112           HZ       PHE 112   5.024  -3.156  10.569
   73    H    VAL 113           H        VAL 113   2.260  -2.728   5.808
   74    HA   VAL 113           HA       VAL 113  -0.246  -4.272   6.247
   75    HB   VAL 113           HB       VAL 113   1.691  -4.851   3.989
   76   HG11  VAL 113          1HG1      VAL 113  -1.056  -5.975   4.681
   77   HG12  VAL 113          2HG1      VAL 113  -0.075  -6.409   3.261
   78   HG13  VAL 113          3HG1      VAL 113   0.496  -6.818   4.882
   79   HG21  VAL 113          1HG2      VAL 113  -0.100  -4.137   2.453
   80   HG22  VAL 113          2HG2      VAL 113  -1.047  -3.534   3.833
   81   HG23  VAL 113          3HG2      VAL 113   0.519  -2.796   3.410
   82    H    GLY 114           H        GLY 114   0.100  -5.651   7.893
   83    HA2  GLY 114          1HA       GLY 114   2.887  -6.690   8.383
   84    HA3  GLY 114          2HA       GLY 114   1.787  -6.188   9.654
   85    H    GLY 115           H        GLY 115   3.195  -8.774   9.017
   86    HA2  GLY 115          1HA       GLY 115   2.616 -10.897   9.863
   87    HA3  GLY 115          2HA       GLY 115   0.904 -10.585   9.572
   88    H    LEU 116           H        LEU 116   2.995  -9.833   6.919
   89    HA   LEU 116           HA       LEU 116   1.826 -11.754   5.098
   90    HB2  LEU 116          1HB       LEU 116   4.314  -9.997   5.002
   91    HB3  LEU 116          2HB       LEU 116   3.805 -10.981   3.645
   92    HG   LEU 116           HG       LEU 116   1.895  -8.939   4.845
   93   HD11  LEU 116          1HD1      LEU 116   3.969  -7.724   4.305
   94   HD12  LEU 116          2HD1      LEU 116   2.699  -7.340   3.134
   95   HD13  LEU 116          3HD1      LEU 116   3.999  -8.472   2.694
   96   HD21  LEU 116          1HD2      LEU 116   2.261  -9.980   2.000
   97   HD22  LEU 116          2HD2      LEU 116   0.939  -8.970   2.614
   98   HD23  LEU 116          3HD2      LEU 116   1.089 -10.660   3.135
   99    H    SER 117           H        SER 117   2.619 -13.712   4.332
  100    HA   SER 117           HA       SER 117   4.606 -15.183   5.873
  101    HB2  SER 117          1HB       SER 117   2.762 -16.327   4.664
  102    HB3  SER 117          2HB       SER 117   3.449 -15.778   3.122
  103    HG   SER 117           HG       SER 117   4.551 -17.567   5.034
  104    H    VAL 118           H        VAL 118   6.775 -15.586   5.364
  105    HA   VAL 118           HA       VAL 118   8.133 -13.793   3.592
  106    HB   VAL 118           HB       VAL 118   9.018 -14.880   5.706
  107   HG11  VAL 118          1HG1      VAL 118   8.673 -17.256   5.027
  108   HG12  VAL 118          2HG1      VAL 118   9.899 -17.053   3.753
  109   HG13  VAL 118          3HG1      VAL 118  10.350 -16.893   5.461
  110   HG21  VAL 118          1HG2      VAL 118  11.272 -14.548   5.035
  111   HG22  VAL 118          2HG2      VAL 118  10.880 -14.796   3.313
  112   HG23  VAL 118          3HG2      VAL 118  10.262 -13.372   4.183
  113    H    ASN 119           H        ASN 119   6.408 -16.575   2.838
  114    HA   ASN 119           HA       ASN 119   7.760 -17.243   0.326
  115    HB2  ASN 119          1HB       ASN 119   4.939 -17.809   1.355
  116    HB3  ASN 119          2HB       ASN 119   5.653 -18.503  -0.096
  117   HD21  ASN 119          1HD2      ASN 119   5.385 -18.799   3.326
  118   HD22  ASN 119          2HD2      ASN 119   6.456 -20.194   3.472
  119    H    THR 120           H        THR 120   5.419 -14.831   1.370
  120    HA   THR 120           HA       THR 120   4.356 -14.183  -1.235
  121    HB   THR 120           HB       THR 120   4.327 -12.570   1.335
  122    HG1  THR 120          1HG       THR 120   2.444 -13.611   1.750
  123   HG21  THR 120          1HG2      THR 120   2.575 -12.402  -1.135
  124   HG22  THR 120          2HG2      THR 120   3.627 -11.138  -0.469
  125   HG23  THR 120          3HG2      THR 120   2.186 -11.654   0.419
  126    H    THR 121           H        THR 121   4.920 -12.736  -2.691
  127    HA   THR 121           HA       THR 121   7.261 -10.985  -2.126
  128    HB   THR 121           HB       THR 121   7.634 -12.711  -3.879
  129    HG1  THR 121          1HG       THR 121   8.784 -11.224  -5.063
  130   HG21  THR 121          1HG2      THR 121   5.894 -10.851  -5.574
  131   HG22  THR 121          2HG2      THR 121   5.483 -12.519  -5.117
  132   HG23  THR 121          3HG2      THR 121   6.881 -12.207  -6.153
  133    H    VAL 122           H        VAL 122   7.371  -8.941  -3.218
  134    HA   VAL 122           HA       VAL 122   5.296  -7.259  -2.384
  135    HB   VAL 122           HB       VAL 122   7.709  -6.714  -2.735
  136   HG11  VAL 122          1HG1      VAL 122   8.511  -5.894  -4.861
  137   HG12  VAL 122          2HG1      VAL 122   7.973  -7.565  -5.074
  138   HG13  VAL 122          3HG1      VAL 122   6.959  -6.218  -5.649
  139   HG21  VAL 122          1HG2      VAL 122   6.029  -4.981  -2.260
  140   HG22  VAL 122          2HG2      VAL 122   7.338  -4.396  -3.312
  141   HG23  VAL 122          3HG2      VAL 122   5.756  -4.775  -4.008
  142    H    GLU 123           H        GLU 123   5.730  -8.668  -5.601
  143    HA   GLU 123           HA       GLU 123   3.685  -7.095  -6.888
  144    HB2  GLU 123          1HB       GLU 123   4.813  -9.836  -7.607
  145    HB3  GLU 123          2HB       GLU 123   3.768  -8.841  -8.637
  146    HG2  GLU 123          1HG       GLU 123   5.490  -7.012  -8.539
  147    HG3  GLU 123          2HG       GLU 123   6.563  -8.111  -7.666
  148    H    ASP 124           H        ASP 124   3.518 -10.143  -5.013
  149    HA   ASP 124           HA       ASP 124   0.808 -10.873  -5.712
  150    HB2  ASP 124          1HB       ASP 124   2.195 -11.254  -3.031
  151    HB3  ASP 124          2HB       ASP 124   0.799 -12.130  -3.621
  152    H    VAL 125           H        VAL 125   2.259  -8.810  -3.212
  153    HA   VAL 125           HA       VAL 125  -0.168  -8.095  -1.863
  154    HB   VAL 125           HB       VAL 125   2.515  -6.656  -1.912
  155   HG11  VAL 125          1HG1      VAL 125   0.218  -6.520   0.081
  156   HG12  VAL 125          2HG1      VAL 125   1.806  -5.744   0.274
  157   HG13  VAL 125          3HG1      VAL 125   0.730  -5.216  -1.021
  158   HG21  VAL 125          1HG2      VAL 125   2.816  -8.943  -1.128
  159   HG22  VAL 125          2HG2      VAL 125   2.840  -7.872   0.274
  160   HG23  VAL 125          3HG2      VAL 125   1.385  -8.816  -0.082
  161    H    LYS 126           H        LYS 126   1.727  -6.324  -4.386
  162    HA   LYS 126           HA       LYS 126  -0.165  -4.181  -4.626
  163    HB2  LYS 126          1HB       LYS 126   2.043  -3.898  -5.487
  164    HB3  LYS 126          2HB       LYS 126   1.884  -5.269  -6.596
  165    HG2  LYS 126          1HG       LYS 126   0.387  -4.121  -8.020
  166    HG3  LYS 126          2HG       LYS 126  -0.029  -2.929  -6.789
  167    HD2  LYS 126          1HD       LYS 126   2.212  -1.905  -6.965
  168    HD3  LYS 126          2HD       LYS 126   2.664  -3.106  -8.201
  169    HE2  LYS 126          1HE       LYS 126   0.807  -2.336  -9.641
  170    HE3  LYS 126          2HE       LYS 126   0.305  -1.170  -8.421
  171    HZ1  LYS 126          1HZ       LYS 126   1.653  -0.183 -10.200
  172    HZ2  LYS 126          2HZ       LYS 126   2.941  -1.098  -9.795
  173    HZ3  LYS 126          3HZ       LYS 126   2.364   0.049  -8.765
  174    H    HIS 127           H        HIS 127   0.014  -7.248  -6.522
  175    HA   HIS 127           HA       HIS 127  -2.289  -6.726  -8.121
  176    HB2  HIS 127          1HB       HIS 127  -0.941  -9.292  -7.258
  177    HB3  HIS 127          2HB       HIS 127  -2.407  -9.293  -8.229
  178    HD2  HIS 127          2HD       HIS 127   1.101  -9.586  -8.817
  179    HE1  HIS 127          1HE       HIS 127  -0.341  -7.725 -12.370
  180    HE2  HIS 127          2HE       HIS 127   1.623  -8.970 -11.329
  181    H    TYR 128           H        TYR 128  -2.107  -8.188  -4.840
  182    HA   TYR 128           HA       TYR 128  -4.922  -8.674  -4.701
  183    HB2  TYR 128          1HB       TYR 128  -3.572  -9.917  -3.251
  184    HB3  TYR 128          2HB       TYR 128  -2.823  -8.476  -2.572
  185    HD1  TYR 128          1HD       TYR 128  -3.992  -7.046  -0.926
  186    HD2  TYR 128          2HD       TYR 128  -5.834 -10.589  -2.566
  187    HE1  TYR 128          1HE       TYR 128  -5.772  -6.920   0.795
  188    HE2  TYR 128          2HE       TYR 128  -7.613 -10.465  -0.822
  189    HH   TYR 128           HH       TYR 128  -7.774  -7.787   1.530
  190    H    PHE 129           H        PHE 129  -3.071  -5.834  -3.517
  191    HA   PHE 129           HA       PHE 129  -5.478  -4.582  -2.603
  192    HB2  PHE 129          1HB       PHE 129  -2.675  -3.571  -2.816
  193    HB3  PHE 129          2HB       PHE 129  -4.010  -2.520  -2.371
  194    HD1  PHE 129          1HD       PHE 129  -5.613  -3.380  -0.427
  195    HD2  PHE 129          2HD       PHE 129  -1.588  -4.762  -1.077
  196    HE1  PHE 129          1HE       PHE 129  -5.514  -4.236   1.906
  197    HE2  PHE 129          2HE       PHE 129  -1.501  -5.601   1.258
  198    HZ   PHE 129           HZ       PHE 129  -3.465  -5.335   2.751
  199    H    GLU 130           H        GLU 130  -4.083  -4.484  -5.772
  200    HA   GLU 130           HA       GLU 130  -5.429  -2.219  -6.804
  201    HB2  GLU 130          1HB       GLU 130  -4.459  -4.797  -8.041
  202    HB3  GLU 130          2HB       GLU 130  -5.378  -3.624  -8.995
  203    HG2  GLU 130          1HG       GLU 130  -3.771  -1.842  -8.390
  204    HG3  GLU 130          2HG       GLU 130  -2.788  -3.027  -7.534
  205    H    GLN 131           H        GLN 131  -6.900  -5.172  -5.774
  206    HA   GLN 131           HA       GLN 131  -9.252  -5.258  -7.383
  207    HB2  GLN 131          1HB       GLN 131  -8.754  -6.003  -4.457
  208    HB3  GLN 131          2HB       GLN 131 -10.216  -6.426  -5.364
  209    HG2  GLN 131          1HG       GLN 131  -8.876  -7.596  -7.019
  210    HG3  GLN 131          2HG       GLN 131  -7.388  -7.280  -6.137
  211   HE21  GLN 131          1HE2      GLN 131  -7.417  -7.998  -3.754
  212   HE22  GLN 131          2HE2      GLN 131  -8.261  -9.503  -3.381
  213    H    PHE 132           H        PHE 132  -8.598  -3.627  -4.366
  214    HA   PHE 132           HA       PHE 132 -11.204  -2.397  -4.032
  215    HB2  PHE 132          1HB       PHE 132  -8.539  -1.623  -2.769
  216    HB3  PHE 132          2HB       PHE 132 -10.138  -1.166  -2.202
  217    HD1  PHE 132          1HD       PHE 132  -7.505  -3.515  -1.858
  218    HD2  PHE 132          2HD       PHE 132 -11.798  -3.209  -1.708
  219    HE1  PHE 132          1HE       PHE 132  -7.604  -5.604  -0.516
  220    HE2  PHE 132          2HE       PHE 132 -11.901  -5.333  -0.417
  221    HZ   PHE 132           HZ       PHE 132  -9.802  -6.525   0.191
  222    H    GLY 133           H        GLY 133  -8.148  -1.252  -5.402
  223    HA2  GLY 133          1HA       GLY 133  -9.185   0.537  -7.270
  224    HA3  GLY 133          2HA       GLY 133  -8.850   1.502  -5.828
  225    H    LYS 134           H        LYS 134  -7.465   2.060  -8.111
  226    HA   LYS 134           HA       LYS 134  -5.243   0.489  -8.752
  227    HB2  LYS 134          1HB       LYS 134  -6.202   2.201 -10.210
  228    HB3  LYS 134          2HB       LYS 134  -5.615   3.474  -9.133
  229    HG2  LYS 134          1HG       LYS 134  -3.267   2.823  -9.621
  230    HG3  LYS 134          2HG       LYS 134  -3.838   1.459 -10.590
  231    HD2  LYS 134          1HD       LYS 134  -3.134   3.267 -12.051
  232    HD3  LYS 134          2HD       LYS 134  -4.887   3.041 -12.201
  233    HE2  LYS 134          1HE       LYS 134  -5.265   4.931 -10.641
  234    HE3  LYS 134          2HE       LYS 134  -3.519   5.130 -10.441
  235    HZ1  LYS 134          1HZ       LYS 134  -3.383   5.745 -12.785
  236    HZ2  LYS 134          2HZ       LYS 134  -4.449   6.714 -11.999
  237    HZ3  LYS 134          3HZ       LYS 134  -4.995   5.526 -12.990
  238    H    VAL 135           H        VAL 135  -3.390   0.083  -7.946
  239    HA   VAL 135           HA       VAL 135  -2.293   1.544  -5.593
  240    HB   VAL 135           HB       VAL 135  -1.682  -1.153  -6.841
  241   HG11  VAL 135          1HG1      VAL 135  -0.227  -1.578  -4.881
  242   HG12  VAL 135          2HG1      VAL 135   0.419  -0.302  -5.919
  243   HG13  VAL 135          3HG1      VAL 135  -0.397   0.113  -4.399
  244   HG21  VAL 135          1HG2      VAL 135  -3.805  -0.998  -5.523
  245   HG22  VAL 135          2HG2      VAL 135  -2.606  -2.053  -4.762
  246   HG23  VAL 135          3HG2      VAL 135  -2.877  -0.410  -4.135
  247    H    ASP 136           H        ASP 136  -0.573   2.803  -5.784
  248    HA   ASP 136           HA       ASP 136   0.687   3.333  -8.373
  249    HB2  ASP 136          1HB       ASP 136   0.266   5.222  -7.021
  250    HB3  ASP 136          2HB       ASP 136   0.985   4.472  -5.600
  251    H    ASP 137           H        ASP 137   1.886   2.106  -5.214
  252    HA   ASP 137           HA       ASP 137   3.959   0.467  -6.526
  253    HB2  ASP 137          1HB       ASP 137   4.773   2.916  -6.357
  254    HB3  ASP 137          2HB       ASP 137   4.697   2.729  -4.606
  255    H    ALA 138           H        ALA 138   5.256  -0.680  -4.826
  256    HA   ALA 138           HA       ALA 138   4.183  -0.851  -2.119
  257    HB1  ALA 138          1HB       ALA 138   3.763  -3.309  -2.253
  258    HB2  ALA 138          2HB       ALA 138   2.657  -2.382  -3.284
  259    HB3  ALA 138          3HB       ALA 138   4.025  -3.245  -4.011
  260    H    MET 139           H        MET 139   5.595  -2.014  -0.667
  261    HA   MET 139           HA       MET 139   8.127  -3.128  -1.660
  262    HB2  MET 139          1HB       MET 139   9.562  -1.624  -0.340
  263    HB3  MET 139          2HB       MET 139   8.760  -0.817  -1.684
  264    HG2  MET 139          1HG       MET 139   7.094   0.154  -0.124
  265    HG3  MET 139          2HG       MET 139   7.897  -0.653   1.229
  266    HE1  MET 139          1HE       MET 139   7.289   2.430   1.297
  267    HE2  MET 139          2HE       MET 139   8.139   1.534   2.580
  268    HE3  MET 139          3HE       MET 139   8.832   3.041   1.940
  269    H    LEU 140           H        LEU 140   8.940  -4.672  -0.336
  270    HA   LEU 140           HA       LEU 140   7.692  -5.040   2.358
  271    HB2  LEU 140          1HB       LEU 140   9.113  -7.118   0.668
  272    HB3  LEU 140          2HB       LEU 140   8.295  -7.371   2.208
  273    HG   LEU 140           HG       LEU 140   7.004  -6.668  -0.461
  274   HD11  LEU 140          1HD1      LEU 140   5.907  -8.847  -0.190
  275   HD12  LEU 140          2HD1      LEU 140   6.730  -9.089   1.362
  276   HD13  LEU 140          3HD1      LEU 140   7.672  -9.034  -0.143
  277   HD21  LEU 140          1HD2      LEU 140   5.736  -6.902   2.293
  278   HD22  LEU 140          2HD2      LEU 140   4.831  -6.940   0.758
  279   HD23  LEU 140          3HD2      LEU 140   5.713  -5.490   1.212
  280    H    MET 141           H        MET 141   8.935  -5.338   4.175
  281    HA   MET 141           HA       MET 141  11.563  -4.034   4.007
  282    HB2  MET 141          1HB       MET 141   9.924  -4.914   6.395
  283    HB3  MET 141          2HB       MET 141  11.449  -4.023   6.466
  284    HG2  MET 141          1HG       MET 141   8.832  -3.050   5.260
  285    HG3  MET 141          2HG       MET 141   9.592  -2.525   6.746
  286    HE1  MET 141          1HE       MET 141   8.803  -1.621   3.342
  287    HE2  MET 141          2HE       MET 141  10.165  -0.675   2.694
  288    HE3  MET 141          3HE       MET 141  10.259  -2.442   2.726
  289    H    PHE 142           H        PHE 142  12.869  -5.490   2.988
  290    HA   PHE 142           HA       PHE 142  13.319  -8.125   3.871
  291    HB2  PHE 142          1HB       PHE 142  14.828  -6.378   2.006
  292    HB3  PHE 142          2HB       PHE 142  15.501  -7.907   2.545
  293    HD1  PHE 142          1HD       PHE 142  14.625 -10.041   1.811
  294    HD2  PHE 142          2HD       PHE 142  12.661  -6.370   0.705
  295    HE1  PHE 142          1HE       PHE 142  13.239 -11.281   0.171
  296    HE2  PHE 142          2HE       PHE 142  11.265  -7.613  -0.932
  297    HZ   PHE 142           HZ       PHE 142  11.552 -10.069  -1.201
  298    H    ASP 143           H        ASP 143  14.738  -9.242   5.021
  299    HA   ASP 143           HA       ASP 143  16.344  -7.803   7.077
  300    HB2  ASP 143          1HB       ASP 143  14.902  -9.548   7.931
  301    HB3  ASP 143          2HB       ASP 143  15.504 -10.699   6.739
  302    H    LYS 144           H        LYS 144  16.578 -10.282   4.564
  303    HA   LYS 144           HA       LYS 144  19.214  -9.260   3.671
  304    HB2  LYS 144          1HB       LYS 144  18.637 -12.212   4.205
  305    HB3  LYS 144          2HB       LYS 144  20.009 -11.597   3.273
  306    HG2  LYS 144          1HG       LYS 144  20.781 -10.334   5.294
  307    HG3  LYS 144          2HG       LYS 144  19.461 -11.071   6.226
  308    HD2  LYS 144          1HD       LYS 144  20.366 -13.325   5.744
  309    HD3  LYS 144          2HD       LYS 144  21.693 -12.593   4.811
  310    HE2  LYS 144          1HE       LYS 144  22.421 -11.347   6.840
  311    HE3  LYS 144          2HE       LYS 144  21.112 -12.092   7.767
  312    HZ1  LYS 144          1HZ       LYS 144  23.207 -13.279   8.080
  313    HZ2  LYS 144          2HZ       LYS 144  23.348 -13.575   6.483
  314    HZ3  LYS 144          3HZ       LYS 144  22.138 -14.265   7.341
  315    H    THR 145           H        THR 145  18.716  -8.551   1.685
  316    HA   THR 145           HA       THR 145  16.341  -9.084   0.417
  317    HB   THR 145           HB       THR 145  18.533  -8.074  -1.305
  318    HG1  THR 145          1HG       THR 145  18.508  -6.121  -0.211
  319   HG21  THR 145          1HG2      THR 145  16.168  -7.980  -2.066
  320   HG22  THR 145          2HG2      THR 145  16.849  -6.362  -1.850
  321   HG23  THR 145          3HG2      THR 145  15.746  -7.028  -0.626
  322    H    THR 146           H        THR 146  19.215 -10.909  -0.033
  323    HA   THR 146           HA       THR 146  18.298 -12.354  -2.404
  324    HB   THR 146           HB       THR 146  20.318 -13.636  -2.156
  325    HG1  THR 146          1HG       THR 146  21.674 -13.191  -0.334
  326   HG21  THR 146          1HG2      THR 146  22.035 -11.953  -2.266
  327   HG22  THR 146          2HG2      THR 146  21.048 -10.775  -1.379
  328   HG23  THR 146          3HG2      THR 146  20.580 -11.282  -3.020
  329    H    ASN 147           H        ASN 147  17.436 -12.589   0.888
  330    HA   ASN 147           HA       ASN 147  16.708 -15.477   0.596
  331    HB2  ASN 147          1HB       ASN 147  18.558 -14.203   2.605
  332    HB3  ASN 147          2HB       ASN 147  17.559 -15.560   3.101
  333   HD21  ASN 147          1HD2      ASN 147  20.222 -14.639   0.919
  334   HD22  ASN 147          2HD2      ASN 147  20.705 -16.308   0.659
  335    H    ARG 148           H        ARG 148  16.172 -12.755   2.956
  336    HA   ARG 148           HA       ARG 148  13.396 -13.774   3.367
  337    HB2  ARG 148          1HB       ARG 148  15.483 -13.474   5.571
  338    HB3  ARG 148          2HB       ARG 148  13.776 -13.778   5.856
  339    HG2  ARG 148          1HG       ARG 148  15.647 -15.698   4.407
  340    HG3  ARG 148          2HG       ARG 148  15.220 -15.774   6.104
  341    HD2  ARG 148          1HD       ARG 148  12.856 -16.151   5.556
  342    HD3  ARG 148          2HD       ARG 148  13.194 -15.954   3.838
  343    HE   ARG 148           HE       ARG 148  14.191 -18.050   3.725
  344   HH11  ARG 148          1HH1      ARG 148  13.328 -17.464   7.077
  345   HH12  ARG 148          2HH1      ARG 148  13.460 -19.150   7.490
  346   HH21  ARG 148          1HH2      ARG 148  14.374 -20.166   4.338
  347   HH22  ARG 148          2HH2      ARG 148  14.042 -20.632   5.981
  348    H    HIS 149           H        HIS 149  11.943 -12.445   4.304
  349    HA   HIS 149           HA       HIS 149  12.740  -9.696   5.095
  350    HB2  HIS 149          1HB       HIS 149  10.755  -8.755   4.095
  351    HB3  HIS 149          2HB       HIS 149  11.687  -9.578   2.864
  352    HD2  HIS 149          2HD       HIS 149  10.290 -11.004   1.267
  353    HE1  HIS 149          1HE       HIS 149   6.731 -11.388   3.572
  354    HE2  HIS 149          2HE       HIS 149   7.794 -11.846   1.305
  355    H    ARG 150           H        ARG 150  11.251  -8.632   6.560
  356    HA   ARG 150           HA       ARG 150  10.704 -10.436   8.784
  357    HB2  ARG 150          1HB       ARG 150  10.676  -7.443   8.384
  358    HB3  ARG 150          2HB       ARG 150   9.864  -8.132   9.781
  359    HG2  ARG 150          1HG       ARG 150  12.057  -9.409  10.269
  360    HG3  ARG 150          2HG       ARG 150  12.807  -8.316   9.098
  361    HD2  ARG 150          1HD       ARG 150  13.103  -7.463  11.373
  362    HD3  ARG 150          2HD       ARG 150  12.054  -6.374  10.457
  363    HE   ARG 150           HE       ARG 150  10.765  -8.472  12.140
  364   HH11  ARG 150          1HH1      ARG 150  11.495  -4.995  12.023
  365   HH12  ARG 150          2HH1      ARG 150  10.114  -4.695  13.089
  366   HH21  ARG 150          1HH2      ARG 150   9.123  -7.863  13.449
  367   HH22  ARG 150          2HH2      ARG 150   8.972  -6.135  13.868
  368    H    GLY 151           H        GLY 151   8.723 -10.134   6.236
  369    HA2  GLY 151          1HA       GLY 151   6.513 -10.725   5.991
  370    HA3  GLY 151          2HA       GLY 151   6.398 -11.013   7.729
  371    H    PHE 152           H        PHE 152   7.336  -7.857   6.299
  372    HA   PHE 152           HA       PHE 152   4.599  -6.876   6.395
  373    HB2  PHE 152          1HB       PHE 152   4.808  -5.254   8.078
  374    HB3  PHE 152          2HB       PHE 152   5.494  -6.683   8.798
  375    HD1  PHE 152          1HD       PHE 152   6.015  -3.228   7.851
  376    HD2  PHE 152          2HD       PHE 152   8.048  -6.856   8.976
  377    HE1  PHE 152          1HE       PHE 152   7.993  -1.900   8.537
  378    HE2  PHE 152          2HE       PHE 152  10.029  -5.518   9.677
  379    HZ   PHE 152           HZ       PHE 152  10.002  -3.049   9.465
  380    H    GLY 153           H        GLY 153   4.510  -4.620   5.631
  381    HA2  GLY 153          1HA       GLY 153   6.750  -3.291   4.380
  382    HA3  GLY 153          2HA       GLY 153   5.815  -4.232   3.212
  383    H    PHE 154           H        PHE 154   5.670  -2.019   2.351
  384    HA   PHE 154           HA       PHE 154   3.221  -0.646   3.320
  385    HB2  PHE 154          1HB       PHE 154   5.743   0.606   2.225
  386    HB3  PHE 154          2HB       PHE 154   4.226   1.466   2.444
  387    HD1  PHE 154          1HD       PHE 154   7.067  -0.113   4.177
  388    HD2  PHE 154          2HD       PHE 154   3.332   1.976   4.694
  389    HE1  PHE 154          1HE       PHE 154   7.631   0.298   6.542
  390    HE2  PHE 154          2HE       PHE 154   3.934   2.460   7.050
  391    HZ   PHE 154           HZ       PHE 154   6.088   1.639   7.983
  392    H    VAL 155           H        VAL 155   1.837   0.342   1.866
  393    HA   VAL 155           HA       VAL 155   2.236  -0.167  -1.035
  394    HB   VAL 155           HB       VAL 155  -0.392  -0.801   0.320
  395   HG11  VAL 155          1HG1      VAL 155  -0.651  -0.123  -2.012
  396   HG12  VAL 155          2HG1      VAL 155   0.604  -1.285  -2.508
  397   HG13  VAL 155          3HG1      VAL 155  -0.945  -1.853  -1.846
  398   HG21  VAL 155          1HG2      VAL 155   1.223  -2.518   1.005
  399   HG22  VAL 155          2HG2      VAL 155   0.044  -3.156  -0.131
  400   HG23  VAL 155          3HG2      VAL 155   1.688  -2.766  -0.693
  401    H    THR 156           H        THR 156   1.692   1.451  -2.316
  402    HA   THR 156           HA       THR 156   0.402   3.841  -1.151
  403    HB   THR 156           HB       THR 156   2.163   4.034  -3.548
  404    HG1  THR 156          1HG       THR 156   3.890   4.382  -2.184
  405   HG21  THR 156          1HG2      THR 156   0.892   6.050  -2.897
  406   HG22  THR 156          2HG2      THR 156   2.618   6.279  -2.611
  407   HG23  THR 156          3HG2      THR 156   1.538   5.934  -1.242
  408    H    PHE 157           H        PHE 157  -1.147   5.078  -2.219
  409    HA   PHE 157           HA       PHE 157  -2.634   3.572  -4.294
  410    HB2  PHE 157          1HB       PHE 157  -3.567   4.970  -1.795
  411    HB3  PHE 157          2HB       PHE 157  -4.654   4.508  -3.090
  412    HD1  PHE 157          1HD       PHE 157  -5.456   2.282  -3.325
  413    HD2  PHE 157          2HD       PHE 157  -2.203   3.110  -0.629
  414    HE1  PHE 157          1HE       PHE 157  -5.613  -0.028  -2.430
  415    HE2  PHE 157          2HE       PHE 157  -2.332   0.796   0.223
  416    HZ   PHE 157           HZ       PHE 157  -4.041  -0.781  -0.653
  417    H    GLU 158           H        GLU 158  -4.081   4.567  -5.684
  418    HA   GLU 158           HA       GLU 158  -3.261   7.093  -6.804
  419    HB2  GLU 158          1HB       GLU 158  -4.290   5.272  -8.104
  420    HB3  GLU 158          2HB       GLU 158  -5.765   5.413  -7.160
  421    HG2  GLU 158          1HG       GLU 158  -6.225   6.394  -9.228
  422    HG3  GLU 158          2HG       GLU 158  -6.107   7.730  -8.103
  423    H    SER 159           H        SER 159  -5.771   6.268  -4.426
  424    HA   SER 159           HA       SER 159  -6.249   9.157  -3.906
  425    HB2  SER 159          1HB       SER 159  -7.964   8.508  -5.510
  426    HB3  SER 159          2HB       SER 159  -8.420   7.120  -4.502
  427    HG   SER 159           HG       SER 159  -9.715   9.111  -4.278
  428    H    GLU 160           H        GLU 160  -6.875   9.676  -1.830
  429    HA   GLU 160           HA       GLU 160  -6.238   7.918   0.342
  430    HB2  GLU 160          1HB       GLU 160  -8.061  10.381   0.354
  431    HB3  GLU 160          2HB       GLU 160  -7.338   9.585   1.741
  432    HG2  GLU 160          1HG       GLU 160  -5.980  11.377   1.517
  433    HG3  GLU 160          2HG       GLU 160  -5.060  10.124   0.695
  434    H    ASP 161           H        ASP 161  -9.196   8.592  -1.452
  435    HA   ASP 161           HA       ASP 161 -11.079   7.396   0.336
  436    HB2  ASP 161          1HB       ASP 161 -11.185   7.841  -2.653
  437    HB3  ASP 161          2HB       ASP 161 -12.496   7.098  -1.752
  438    H    ILE 162           H        ILE 162  -8.898   5.815  -1.917
  439    HA   ILE 162           HA       ILE 162 -10.167   3.187  -1.573
  440    HB   ILE 162           HB       ILE 162  -7.307   3.718  -2.437
  441   HG12  ILE 162          1HG1      ILE 162  -8.585   4.922  -4.031
  442   HG13  ILE 162          2HG1      ILE 162  -8.072   3.402  -4.748
  443   HG21  ILE 162          1HG2      ILE 162  -9.195   1.336  -2.709
  444   HG22  ILE 162          2HG2      ILE 162  -7.647   1.474  -3.567
  445   HG23  ILE 162          3HG2      ILE 162  -7.671   1.427  -1.808
  446   HD11  ILE 162          1HD1      ILE 162 -10.876   4.086  -3.748
  447   HD12  ILE 162          2HD1      ILE 162 -10.354   3.864  -5.427
  448   HD13  ILE 162          3HD1      ILE 162 -10.392   2.476  -4.321
  449    H    VAL 163           H        VAL 163  -7.396   4.966  -0.117
  450    HA   VAL 163           HA       VAL 163  -6.505   2.875   1.575
  451    HB   VAL 163           HB       VAL 163  -6.414   5.903   1.990
  452   HG11  VAL 163          1HG1      VAL 163  -5.125   3.697   3.604
  453   HG12  VAL 163          2HG1      VAL 163  -4.524   5.373   3.590
  454   HG13  VAL 163          3HG1      VAL 163  -6.146   5.019   4.189
  455   HG21  VAL 163          1HG2      VAL 163  -4.042   5.531   1.333
  456   HG22  VAL 163          2HG2      VAL 163  -4.435   3.844   0.957
  457   HG23  VAL 163          3HG2      VAL 163  -5.205   5.171   0.045
  458    H    GLU 164           H        GLU 164  -9.017   5.372   2.147
  459    HA   GLU 164           HA       GLU 164  -9.825   4.528   4.762
  460    HB2  GLU 164          1HB       GLU 164 -11.473   5.712   2.493
  461    HB3  GLU 164          2HB       GLU 164 -12.072   5.502   4.129
  462    HG2  GLU 164          1HG       GLU 164  -9.704   7.251   3.348
  463    HG3  GLU 164          2HG       GLU 164 -11.348   7.814   3.613
  464    H    LYS 165           H        LYS 165 -11.142   3.428   1.594
  465    HA   LYS 165           HA       LYS 165 -13.022   1.544   2.607
  466    HB2  LYS 165          1HB       LYS 165 -12.935   2.457   0.296
  467    HB3  LYS 165          2HB       LYS 165 -11.467   1.537  -0.023
  468    HG2  LYS 165          1HG       LYS 165 -12.698  -0.589   0.312
  469    HG3  LYS 165          2HG       LYS 165 -14.174   0.331   0.669
  470    HD2  LYS 165          1HD       LYS 165 -14.088   1.321  -1.625
  471    HD3  LYS 165          2HD       LYS 165 -12.597   0.430  -1.945
  472    HE2  LYS 165          1HE       LYS 165 -14.393  -0.753  -2.998
  473    HE3  LYS 165          2HE       LYS 165 -13.811  -1.722  -1.643
  474    HZ1  LYS 165          1HZ       LYS 165 -15.727  -0.944  -0.348
  475    HZ2  LYS 165          2HZ       LYS 165 -16.247  -1.630  -1.731
  476    HZ3  LYS 165          3HZ       LYS 165 -16.243  -0.007  -1.588
  477    H    VAL 166           H        VAL 166  -9.682   1.061   1.582
  478    HA   VAL 166           HA       VAL 166  -9.472  -1.760   2.101
  479    HB   VAL 166           HB       VAL 166  -7.344   0.415   2.001
  480   HG11  VAL 166          1HG1      VAL 166  -7.073  -2.603   1.824
  481   HG12  VAL 166          2HG1      VAL 166  -5.779  -1.443   1.470
  482   HG13  VAL 166          3HG1      VAL 166  -6.412  -1.571   3.116
  483   HG21  VAL 166          1HG2      VAL 166  -8.100  -1.610  -0.135
  484   HG22  VAL 166          2HG2      VAL 166  -8.716   0.038  -0.138
  485   HG23  VAL 166          3HG2      VAL 166  -6.984  -0.235  -0.285
  486    H    CYS 167           H        CYS 167  -8.545   1.085   4.093
  487    HA   CYS 167           HA       CYS 167  -7.484  -0.391   6.266
  488    HB2  CYS 167          1HB       CYS 167  -7.022   1.983   5.862
  489    HB3  CYS 167          2HB       CYS 167  -8.717   2.390   6.188
  490    HG   CYS 167           HG       CYS 167  -6.447   1.049   8.213
  491    H    GLU 168           H        GLU 168 -10.864   0.723   5.756
  492    HA   GLU 168           HA       GLU 168 -11.865  -0.075   8.304
  493    HB2  GLU 168          1HB       GLU 168 -13.149   0.318   5.588
  494    HB3  GLU 168          2HB       GLU 168 -14.105  -0.163   6.979
  495    HG2  GLU 168          1HG       GLU 168 -12.366   2.340   6.915
  496    HG3  GLU 168          2HG       GLU 168 -14.074   2.306   6.490
  497    H    ILE 169           H        ILE 169 -10.983  -2.147   5.640
  498    HA   ILE 169           HA       ILE 169 -12.557  -4.454   6.500
  499    HB   ILE 169           HB       ILE 169 -10.152  -4.136   4.684
  500   HG12  ILE 169          1HG1      ILE 169 -13.041  -4.881   4.005
  501   HG13  ILE 169          2HG1      ILE 169 -12.511  -3.209   4.057
  502   HG21  ILE 169          1HG2      ILE 169 -10.025  -6.397   5.559
  503   HG22  ILE 169          2HG2      ILE 169 -11.752  -6.667   5.231
  504   HG23  ILE 169          3HG2      ILE 169 -10.590  -6.464   3.904
  505   HD11  ILE 169          1HD1      ILE 169 -12.502  -3.979   1.778
  506   HD12  ILE 169          2HD1      ILE 169 -10.852  -3.610   2.300
  507   HD13  ILE 169          3HD1      ILE 169 -11.393  -5.303   2.173
  508    H    HIS 170           H        HIS 170  -9.404  -3.149   7.259
  509    HA   HIS 170           HA       HIS 170  -7.891  -3.438   8.865
  510    HB2  HIS 170          1HB       HIS 170  -9.851  -3.228  10.320
  511    HB3  HIS 170          2HB       HIS 170  -9.997  -4.980  10.381
  512    HD2  HIS 170          2HD       HIS 170  -6.426  -3.549  10.628
  513    HE1  HIS 170          1HE       HIS 170  -7.557  -4.699  14.569
  514    HE2  HIS 170          2HE       HIS 170  -5.613  -3.962  13.092
  515    H    PHE 171           H        PHE 171  -9.458  -6.631   8.554
  516    HA   PHE 171           HA       PHE 171  -6.769  -7.794   8.216
  517    HB2  PHE 171          1HB       PHE 171  -9.016  -8.987   9.710
  518    HB3  PHE 171          2HB       PHE 171  -7.855 -10.013   8.884
  519    HD1  PHE 171          1HD       PHE 171  -5.512 -10.131   9.525
  520    HD2  PHE 171          2HD       PHE 171  -8.241  -7.508  11.595
  521    HE1  PHE 171          1HE       PHE 171  -3.851  -9.843  11.351
  522    HE2  PHE 171          2HE       PHE 171  -6.574  -7.219  13.415
  523    HZ   PHE 171           HZ       PHE 171  -4.379  -8.385  13.295
  524    H    HIS 172           H        HIS 172  -6.131  -8.216   6.415
  525    HA   HIS 172           HA       HIS 172  -7.934  -8.916   4.140
  526    HB2  HIS 172          1HB       HIS 172  -5.163  -7.684   4.373
  527    HB3  HIS 172          2HB       HIS 172  -5.845  -8.216   2.849
  528    HD2  HIS 172          2HD       HIS 172  -6.358  -5.528   5.594
  529    HE1  HIS 172          1HE       HIS 172  -8.735  -4.323   2.298
  530    HE2  HIS 172          2HE       HIS 172  -7.840  -3.631   4.551
  531    H    GLU 173           H        GLU 173  -6.844 -10.436   2.487
  532    HA   GLU 173           HA       GLU 173  -5.290 -12.587   3.870
  533    HB2  GLU 173          1HB       GLU 173  -7.694 -13.140   3.899
  534    HB3  GLU 173          2HB       GLU 173  -7.730 -13.037   2.132
  535    HG2  GLU 173          1HG       GLU 173  -6.030 -14.864   2.007
  536    HG3  GLU 173          2HG       GLU 173  -6.008 -14.954   3.768
  537    H    ILE 174           H        ILE 174  -3.458 -12.998   2.846
  538    HA   ILE 174           HA       ILE 174  -3.305 -12.787  -0.134
  539    HB   ILE 174           HB       ILE 174  -1.234 -11.596   1.745
  540   HG12  ILE 174          1HG1      ILE 174  -3.401 -10.238   0.097
  541   HG13  ILE 174          2HG1      ILE 174  -3.225 -10.206   1.850
  542   HG21  ILE 174          1HG2      ILE 174  -1.499 -11.474  -1.298
  543   HG22  ILE 174          2HG2      ILE 174  -0.202 -10.750  -0.325
  544   HG23  ILE 174          3HG2      ILE 174  -0.341 -12.495  -0.414
  545   HD11  ILE 174          1HD1      ILE 174  -1.450  -8.810  -0.166
  546   HD12  ILE 174          2HD1      ILE 174  -2.527  -8.093   1.038
  547   HD13  ILE 174          3HD1      ILE 174  -1.070  -8.950   1.570
  548    H    ASN 175           H        ASN 175  -2.314 -14.494  -1.048
  549    HA   ASN 175           HA       ASN 175  -1.667 -16.669  -1.178
  550    HB2  ASN 175          1HB       ASN 175   0.593 -15.560   0.515
  551    HB3  ASN 175          2HB       ASN 175   0.636 -17.135  -0.268
  552   HD21  ASN 175          1HD2      ASN 175   2.318 -14.759  -0.665
  553   HD22  ASN 175          2HD2      ASN 175   2.280 -14.484  -2.412
  554    H    ASN 176           H        ASN 176  -3.710 -16.502   0.475
  555    HA   ASN 176           HA       ASN 176  -4.907 -17.262   2.161
  556    HB2  ASN 176          1HB       ASN 176  -4.953 -19.613   2.556
  557    HB3  ASN 176          2HB       ASN 176  -4.677 -19.282   0.856
  558   HD21  ASN 176          1HD2      ASN 176  -2.915 -20.090   3.871
  559   HD22  ASN 176          2HD2      ASN 176  -1.726 -21.113   3.060
  560    H    LYS 177           H        LYS 177  -2.408 -15.834   3.050
  561    HA   LYS 177           HA       LYS 177  -2.581 -16.605   5.932
  562    HB2  LYS 177          1HB       LYS 177  -0.283 -16.615   5.085
  563    HB3  LYS 177          2HB       LYS 177  -0.488 -14.985   4.427
  564    HG2  LYS 177          1HG       LYS 177   0.825 -14.814   6.377
  565    HG3  LYS 177          2HG       LYS 177  -0.754 -14.133   6.759
  566    HD2  LYS 177          1HD       LYS 177  -1.336 -16.484   7.725
  567    HD3  LYS 177          2HD       LYS 177   0.384 -16.852   7.581
  568    HE2  LYS 177          1HE       LYS 177  -0.818 -14.486   9.056
  569    HE3  LYS 177          2HE       LYS 177  -0.400 -16.030   9.829
  570    HZ1  LYS 177          1HZ       LYS 177   1.480 -14.107   8.574
  571    HZ2  LYS 177          2HZ       LYS 177   1.937 -15.606   9.096
  572    HZ3  LYS 177          3HZ       LYS 177   1.395 -14.487  10.156
  573    H    MET 178           H        MET 178  -3.323 -15.127   7.406
  574    HA   MET 178           HA       MET 178  -4.893 -12.864   6.386
  575    HB2  MET 178          1HB       MET 178  -4.560 -13.944   9.212
  576    HB3  MET 178          2HB       MET 178  -5.635 -12.633   8.734
  577    HG2  MET 178          1HG       MET 178  -5.804 -15.545   7.899
  578    HG3  MET 178          2HG       MET 178  -6.901 -14.681   8.964
  579    HE1  MET 178          1HE       MET 178  -8.636 -12.808   8.142
  580    HE2  MET 178          2HE       MET 178  -7.360 -11.882   7.318
  581    HE3  MET 178          3HE       MET 178  -8.836 -12.326   6.443
  582    H    VAL 179           H        VAL 179  -4.338 -10.773   6.546
  583    HA   VAL 179           HA       VAL 179  -1.934 -10.017   8.110
  584    HB   VAL 179           HB       VAL 179  -0.996  -8.715   6.341
  585   HG11  VAL 179          1HG1      VAL 179  -0.462 -11.133   6.545
  586   HG12  VAL 179          2HG1      VAL 179  -1.606 -11.472   5.222
  587   HG13  VAL 179          3HG1      VAL 179  -0.185 -10.446   4.937
  588   HG21  VAL 179          1HG2      VAL 179  -1.796  -8.815   4.011
  589   HG22  VAL 179          2HG2      VAL 179  -3.264  -9.658   4.551
  590   HG23  VAL 179          3HG2      VAL 179  -2.936  -7.987   5.074
  591    H    GLU 180           H        GLU 180  -1.722  -7.908   8.722
  592    HA   GLU 180           HA       GLU 180  -4.345  -6.543   9.124
  593    HB2  GLU 180          1HB       GLU 180  -2.983  -7.240  11.087
  594    HB3  GLU 180          2HB       GLU 180  -1.701  -6.134  10.572
  595    HG2  GLU 180          1HG       GLU 180  -3.234  -4.218  10.786
  596    HG3  GLU 180          2HG       GLU 180  -4.575  -5.310  11.153
  597    H    CYS 181           H        CYS 181  -4.841  -4.693   8.045
  598    HA   CYS 181           HA       CYS 181  -2.665  -3.059   6.838
  599    HB2  CYS 181          1HB       CYS 181  -4.405  -1.817   5.695
  600    HB3  CYS 181          2HB       CYS 181  -4.521  -3.542   5.339
  601    HG   CYS 181           HG       CYS 181  -6.225  -1.848   7.628
  602    H    LYS 182           H        LYS 182  -2.283  -0.938   7.412
  603    HA   LYS 182           HA       LYS 182  -3.984   0.402   9.460
  604    HB2  LYS 182          1HB       LYS 182  -1.010   0.745   9.742
  605    HB3  LYS 182          2HB       LYS 182  -2.271   0.987  10.929
  606    HG2  LYS 182          1HG       LYS 182  -2.426  -1.434  11.320
  607    HG3  LYS 182          2HG       LYS 182  -1.271  -1.747  10.003
  608    HD2  LYS 182          1HD       LYS 182   0.452  -0.401  11.197
  609    HD3  LYS 182          2HD       LYS 182  -0.667  -0.220  12.570
  610    HE2  LYS 182          1HE       LYS 182  -0.728  -2.653  12.878
  611    HE3  LYS 182          2HE       LYS 182   0.223  -2.897  11.411
  612    HZ1  LYS 182          1HZ       LYS 182   2.067  -1.705  12.498
  613    HZ2  LYS 182          2HZ       LYS 182   1.627  -3.065  13.308
  614    HZ3  LYS 182          3HZ       LYS 182   1.201  -1.587  13.884
  615    H    LYS 183           H        LYS 183  -3.878   2.736   9.261
  616    HA   LYS 183           HA       LYS 183  -2.959   3.825   6.704
  617    HB2  LYS 183          1HB       LYS 183  -3.827   5.184   9.289
  618    HB3  LYS 183          2HB       LYS 183  -3.401   6.047   7.800
  619    HG2  LYS 183          1HG       LYS 183  -5.190   4.929   6.564
  620    HG3  LYS 183          2HG       LYS 183  -5.592   3.937   7.974
  621    HD2  LYS 183          1HD       LYS 183  -6.210   5.970   9.250
  622    HD3  LYS 183          2HD       LYS 183  -5.846   6.968   7.820
  623    HE2  LYS 183          1HE       LYS 183  -7.543   5.726   6.516
  624    HE3  LYS 183          2HE       LYS 183  -7.887   4.691   7.908
  625    HZ1  LYS 183          1HZ       LYS 183  -8.725   6.627   9.090
  626    HZ2  LYS 183          2HZ       LYS 183  -9.478   6.528   7.624
  627    HZ3  LYS 183          3HZ       LYS 183  -8.316   7.629   7.849
  628    H    ALA 184           H        ALA 184  -0.959   4.520   6.144
  629    HA   ALA 184           HA       ALA 184   1.178   3.979   8.057
  630    HB1  ALA 184          1HB       ALA 184   1.329   5.001   5.214
  631    HB2  ALA 184          2HB       ALA 184   2.687   4.413   6.193
  632    HB3  ALA 184          3HB       ALA 184   1.401   3.292   5.718
  633    H    GLN 185           H        GLN 185   2.510   5.363   9.049
  634    HA   GLN 185           HA       GLN 185   1.978   8.180   9.314
  635    HB2  GLN 185          1HB       GLN 185   4.390   6.435   9.949
  636    HB3  GLN 185          2HB       GLN 185   4.349   8.132  10.348
  637    HG2  GLN 185          1HG       GLN 185   2.256   6.151  11.341
  638    HG3  GLN 185          2HG       GLN 185   3.741   6.544  12.198
  639   HE21  GLN 185          1HE2      GLN 185   2.234   7.157  13.974
  640   HE22  GLN 185          2HE2      GLN 185   1.541   8.773  13.920
  641    HA   PRO 186           HA       PRO 186   3.808   9.786   5.725
  642    HB2  PRO 186          1HB       PRO 186   4.814  12.234   6.424
  643    HB3  PRO 186          2HB       PRO 186   3.069  11.842   6.428
  644    HG2  PRO 186          1HG       PRO 186   4.978  11.883   8.773
  645    HG3  PRO 186          2HG       PRO 186   3.324  12.561   8.674
  646    HD2  PRO 186          1HD       PRO 186   3.912  10.128   9.787
  647    HD3  PRO 186          2HD       PRO 186   2.349  10.430   8.998
  648    H    LYS 187           H        LYS 187   6.045   9.308   8.400
  649    HA   LYS 187           HA       LYS 187   8.152   8.310   6.788
  650    HB2  LYS 187          1HB       LYS 187   9.869   9.973   7.355
  651    HB3  LYS 187          2HB       LYS 187   8.599  10.705   6.417
  652    HG2  LYS 187          1HG       LYS 187   7.624  11.714   8.485
  653    HG3  LYS 187          2HG       LYS 187   8.904  10.952   9.440
  654    HD2  LYS 187          1HD       LYS 187   9.482  13.249   9.095
  655    HD3  LYS 187          2HD       LYS 187  10.611  12.244   8.175
  656    HE2  LYS 187          1HE       LYS 187   9.319  12.698   6.097
  657    HE3  LYS 187          2HE       LYS 187   8.156  13.657   7.023
  658    HZ1  LYS 187          1HZ       LYS 187  11.041  14.311   6.714
  659    HZ2  LYS 187          2HZ       LYS 187   9.966  15.201   7.565
  660    HZ3  LYS 187          3HZ       LYS 187   9.816  15.066   5.946
  661    H    GLU 188           H        GLU 188  10.064   8.775   8.898
  662    HA   GLU 188           HA       GLU 188   9.345   6.580  10.656
  663    HB2  GLU 188          1HB       GLU 188  11.867   8.267  10.802
  664    HB3  GLU 188          2HB       GLU 188  11.579   6.667  11.461
  665    HG2  GLU 188          1HG       GLU 188  12.786   6.108   9.626
  666    HG3  GLU 188          2HG       GLU 188  11.151   5.910   9.004
  667    H    VAL 189           H        VAL 189   7.704   9.005  11.124
  668    HA   VAL 189           HA       VAL 189   8.549  10.390  13.451
  669    HB   VAL 189           HB       VAL 189   6.521  11.475  13.537
  670   HG11  VAL 189          1HG1      VAL 189   5.973  12.136  11.293
  671   HG12  VAL 189          2HG1      VAL 189   7.715  11.842  11.368
  672   HG13  VAL 189          3HG1      VAL 189   6.631  10.641  10.609
  673   HG21  VAL 189          1HG2      VAL 189   4.433  10.641  12.399
  674   HG22  VAL 189          2HG2      VAL 189   5.261   9.087  12.152
  675   HG23  VAL 189          3HG2      VAL 189   4.928   9.681  13.791
  676    H    MET 190           H        MET 190   7.546   7.216  13.330
  677    HA   MET 190           HA       MET 190   6.342   6.864  15.942
  678    HB2  MET 190          1HB       MET 190   7.876   4.962  14.125
  679    HB3  MET 190          2HB       MET 190   6.955   4.477  15.547
  680    HG2  MET 190          1HG       MET 190   5.778   5.838  13.090
  681    HG3  MET 190          2HG       MET 190   5.776   4.107  13.368
  682    HE1  MET 190          1HE       MET 190   3.193   3.493  16.132
  683    HE2  MET 190          2HE       MET 190   4.204   2.798  14.846
  684    HE3  MET 190          3HE       MET 190   4.962   3.526  16.282
  685    H    SER 191           H        SER 191   9.654   7.260  14.787
  686    HA   SER 191           HA       SER 191  10.571   7.545  17.533
  687    HB2  SER 191          1HB       SER 191  10.824   5.105  17.187
  688    HB3  SER 191          2HB       SER 191  11.885   5.419  15.803
  689    HG   SER 191           HG       SER 191  13.049   5.068  17.764
  690    HA   PRO 192           HA       PRO 192  12.407  10.504  14.506
  691    HB2  PRO 192          1HB       PRO 192  12.239  12.284  16.923
  692    HB3  PRO 192          2HB       PRO 192  11.822  12.644  15.222
  693    HG2  PRO 192          1HG       PRO 192   9.864  12.175  17.040
  694    HG3  PRO 192          2HG       PRO 192   9.753  11.456  15.399
  695    HD2  PRO 192          1HD       PRO 192  10.753  10.149  17.952
  696    HD3  PRO 192          2HD       PRO 192   9.569   9.534  16.763
  697    H    THR 193           H        THR 193  14.494  11.580  14.446
  698    HA   THR 193           HA       THR 193  16.349  11.252  16.664
  699    HB   THR 193           HB       THR 193  16.326   9.032  15.461
  700    HG1  THR 193          1HG       THR 193  18.522   8.858  15.774
  701   HG21  THR 193          1HG2      THR 193  17.721   8.783  13.494
  702   HG22  THR 193          2HG2      THR 193  18.066  10.523  13.437
  703   HG23  THR 193          3HG2      THR 193  16.423   9.924  13.111
  704    H    GLY 194           H        GLY 194  18.545  12.080  16.264
  705    HA2  GLY 194          1HA       GLY 194  19.397  13.778  14.242
  706    HA3  GLY 194          2HA       GLY 194  18.354  14.792  15.244
  707    H    SER 195           H        SER 195  20.049  16.115  15.951
  708    HA   SER 195           HA       SER 195  22.428  15.214  17.285
  709    HB2  SER 195          1HB       SER 195  20.949  17.870  17.449
  710    HB3  SER 195          2HB       SER 195  22.597  17.569  18.030
  711    HG   SER 195           HG       SER 195  22.592  18.466  15.923
  712    H    ALA 196           H        ALA 196  19.259  15.016  18.384
  713    HA   ALA 196           HA       ALA 196  20.075  14.470  21.159
  714    HB1  ALA 196          1HB       ALA 196  19.378  16.857  21.148
  715    HB2  ALA 196          2HB       ALA 196  17.819  16.397  20.426
  716    HB3  ALA 196          3HB       ALA 196  18.242  15.858  22.067
  717    H    ARG 197           H        ARG 197  18.051  13.565  22.354
  718    HA   ARG 197           HA       ARG 197  17.167  11.196  21.026
  719    HB2  ARG 197          1HB       ARG 197  15.897  10.740  23.044
  720    HB3  ARG 197          2HB       ARG 197  17.504  11.317  23.416
  721    HG2  ARG 197          1HG       ARG 197  16.105  12.284  25.013
  722    HG3  ARG 197          2HG       ARG 197  16.498  13.609  23.918
  723    HD2  ARG 197          1HD       ARG 197  14.288  13.492  22.902
  724    HD3  ARG 197          2HD       ARG 197  13.943  11.962  23.738
  725    HE   ARG 197           HE       ARG 197  14.516  14.076  25.615
  726   HH11  ARG 197          1HH1      ARG 197  10.689  13.582  24.570
  727   HH12  ARG 197          2HH1      ARG 197  11.930  12.945  23.516
  728   HH21  ARG 197          1HH2      ARG 197  12.875  14.893  26.878
  729   HH22  ARG 197          2HH2      ARG 197  11.217  14.682  26.398
  730    H    GLY 198           H        GLY 198  14.923  10.446  20.801
  731    HA2  GLY 198          1HA       GLY 198  13.527  11.941  18.856
  732    HA3  GLY 198          2HA       GLY 198  12.886  10.535  19.705
  733    H    ARG 199           H        ARG 199  11.986  13.441  18.898
  734    HA   ARG 199           HA       ARG 199  10.168  13.934  21.138
  735    HB2  ARG 199          1HB       ARG 199  10.939  16.220  21.574
  736    HB3  ARG 199          2HB       ARG 199  12.206  15.057  21.939
  737    HG2  ARG 199          1HG       ARG 199  13.290  15.584  19.726
  738    HG3  ARG 199          2HG       ARG 199  12.046  16.817  19.451
  739    HD2  ARG 199          1HD       ARG 199  12.768  17.967  21.555
  740    HD3  ARG 199          2HD       ARG 199  14.009  16.736  21.779
  741    HE   ARG 199           HE       ARG 199  15.282  17.616  20.027
  742   HH11  ARG 199          1HH1      ARG 199  12.313  19.474  20.253
  743   HH12  ARG 199          2HH1      ARG 199  12.959  20.780  19.298
  744   HH21  ARG 199          1HH2      ARG 199  16.023  19.306  18.800
  745   HH22  ARG 199          2HH2      ARG 199  14.999  20.679  18.500
  746    H    SER 200           H        SER 200   8.676  15.684  20.690
  747    HA   SER 200           HA       SER 200   8.203  16.332  17.814
  748    HB2  SER 200          1HB       SER 200   6.202  15.049  19.712
  749    HB3  SER 200          2HB       SER 200   5.802  15.758  18.136
  750    HG   SER 200           HG       SER 200   6.190  13.476  17.991
  751    H5'    G 201           H5'        G 201  10.594 -13.153  12.368
  752   H5''    G 201           H5"        G 201   9.600 -12.516  13.684
  753    H4'    G 201           H4'        G 201   9.101 -11.351  11.598
  754    H3'    G 201           H3'        G 201   7.093 -12.613  13.202
  755    H2'    G 201           H2'        G 201   6.464 -14.185  11.648
  756   HO2'    G 201           HO2        G 201   5.163 -11.790  11.074
  757    H1'    G 201           H1'        G 201   7.181 -12.309   9.390
  758    H8     G 201          8H          G 201   6.669 -13.653   7.274
  759    H1     G 201          1H          G 201   8.017 -19.308  10.064
  760    H21    G 201          1H2         G 201   8.658 -18.922  12.198
  761    H22    G 201          2H2         G 201   8.712 -17.274  12.799
  762   HO5'    G 201           HO5        G 201   8.916 -14.856  12.184
  763    H5'    U 202           H5'        U 202   6.291  -8.314  10.679
  764   H5''    U 202           H5"        U 202   7.650  -7.648  11.584
  765    H4'    U 202           H4'        U 202   6.427  -5.764  10.929
  766    H3'    U 202           H3'        U 202   6.729  -6.273  13.637
  767    H2'    U 202           H2'        U 202   4.552  -6.983  14.053
  768   HO2'    U 202           HO2        U 202   4.897  -4.481  14.790
  769    H1'    U 202           H1'        U 202   3.450  -4.992  12.087
  770    H3     U 202          3H          U 202  -0.728  -6.599  12.852
  771    H5     U 202          5H          U 202   1.564 -10.093  12.492
  772    H6     U 202          6H          U 202   3.579  -8.712  12.316
  773    H5'    A 203           H5'        A 203   7.891  -2.627  11.398
  774   H5''    A 203           H5"        A 203   9.294  -2.409  12.454
  775    H4'    A 203           H4'        A 203   9.114  -0.515  10.971
  776    H3'    A 203           H3'        A 203   9.294  -0.199  13.751
  777    H2'    A 203           H2'        A 203   6.968   0.238  13.988
  778   HO2'    A 203           HO2        A 203   8.512   2.560  13.767
  779    H1'    A 203           H1'        A 203   7.228   1.927  11.473
  780    H8     A 203          8H          A 203   4.689  -0.203  13.547
  781    H61    A 203          1H6         A 203   0.533   3.331  10.389
  782    H62    A 203          2H6         A 203   0.649   2.140  11.685
  783    H2     A 203          2H          A 203   4.472   4.274   8.927
  784    H5'    G 204           H5'        G 204  10.811  -0.933   9.933
  785   H5''    G 204           H5"        G 204  12.524  -0.576  10.115
  786    H4'    G 204           H4'        G 204  11.956  -0.912   7.779
  787    H3'    G 204           H3'        G 204  13.396   1.338   8.783
  788    H2'    G 204           H2'        G 204  11.618   2.823   8.252
  789   HO2'    G 204           HO2        G 204  13.501   2.585   6.204
  790    H1'    G 204           H1'        G 204  11.252   1.049   5.833
  791    H8     G 204          8H          G 204   9.779   2.215   4.166
  792    H1     G 204          1H          G 204   6.750   5.688   8.665
  793    H21    G 204          1H2         G 204   7.257   4.802  10.672
  794    H22    G 204          2H2         G 204   8.561   3.625  10.793
  795    H5'    U 205           H5'        U 205  13.435  -2.462   6.028
  796   H5''    U 205           H5"        U 205  15.023  -3.182   6.325
  797    H4'    U 205           H4'        U 205  14.318  -4.088   4.295
  798    H3'    U 205           H3'        U 205  16.651  -2.656   4.215
  799   HO3'    U 205           HO3        U 205  16.998  -3.811   2.304
  800    H2'    U 205           H2'        U 205  15.651  -0.648   3.422
  801   HO2'    U 205           HO2        U 205  16.374  -2.141   1.086
  802    H1'    U 205           H1'        U 205  13.965  -2.267   1.500
  803    H3     U 205          3H          U 205  12.356   1.641  -0.175
  804    H5     U 205          5H          U 205  12.440   2.379   3.939
  805    H6     U 205          6H          U 205  13.330   0.124   4.289
  Start of MODEL   20
    1    H1   GLY 105          1H        GLY 105  -9.110  12.305   5.468
    2    H2   GLY 105          2H        GLY 105  -9.898  12.449   6.899
    3    H3   GLY 105          3H        GLY 105  -8.441  11.701   6.836
    4    HA2  GLY 105          1HA       GLY 105  -8.912  14.559   6.290
    5    HA3  GLY 105          2HA       GLY 105  -8.208  13.907   7.779
    6    H    SER 106           H        SER 106  -7.268  15.623   5.355
    7    HA   SER 106           HA       SER 106  -5.456  16.041   4.107
    8    HB2  SER 106          1HB       SER 106  -4.028  14.195   6.044
    9    HB3  SER 106          2HB       SER 106  -3.228  15.153   4.793
   10    HG   SER 106           HG       SER 106  -4.833  16.147   6.926
   11    H    HIS 107           H        HIS 107  -3.834  15.278   2.559
   12    HA   HIS 107           HA       HIS 107  -5.070  13.395   0.776
   13    HB2  HIS 107          1HB       HIS 107  -2.463  14.922   0.497
   14    HB3  HIS 107          2HB       HIS 107  -3.359  14.137  -0.802
   15    HD2  HIS 107          2HD       HIS 107  -5.232  15.495  -1.982
   16    HE1  HIS 107          1HE       HIS 107  -5.248  18.943   0.532
   17    HE2  HIS 107          2HE       HIS 107  -6.150  17.945  -1.631
   18    H    MET 108           H        MET 108  -4.277  11.890   3.020
   19    HA   MET 108           HA       MET 108  -1.759  10.523   2.536
   20    HB2  MET 108          1HB       MET 108  -2.560  10.708   4.793
   21    HB3  MET 108          2HB       MET 108  -4.089   9.929   4.382
   22    HG2  MET 108          1HG       MET 108  -2.577   8.392   5.563
   23    HG3  MET 108          2HG       MET 108  -2.998   7.807   3.965
   24    HE1  MET 108          1HE       MET 108  -0.202  10.486   5.126
   25    HE2  MET 108          2HE       MET 108  -0.244   9.181   6.335
   26    HE3  MET 108          3HE       MET 108   1.171   9.370   5.279
   27    H    LYS 109           H        LYS 109  -1.415   9.224   0.901
   28    HA   LYS 109           HA       LYS 109  -3.557   7.371  -0.048
   29    HB2  LYS 109          1HB       LYS 109  -1.324   8.652  -1.634
   30    HB3  LYS 109          2HB       LYS 109  -2.382   7.366  -2.227
   31    HG2  LYS 109          1HG       LYS 109  -4.372   8.850  -1.656
   32    HG3  LYS 109          2HG       LYS 109  -3.206  10.173  -1.433
   33    HD2  LYS 109          1HD       LYS 109  -2.359   9.614  -3.797
   34    HD3  LYS 109          2HD       LYS 109  -3.766   8.531  -3.929
   35    HE2  LYS 109          1HE       LYS 109  -5.284  10.427  -3.533
   36    HE3  LYS 109          2HE       LYS 109  -3.908  11.519  -3.345
   37    HZ1  LYS 109          1HZ       LYS 109  -3.315  11.048  -5.667
   38    HZ2  LYS 109          2HZ       LYS 109  -4.838  11.632  -5.583
   39    HZ3  LYS 109          3HZ       LYS 109  -4.593  10.034  -5.836
   40    H    LYS 110           H        LYS 110  -1.245   6.950   2.065
   41    HA   LYS 110           HA       LYS 110  -0.302   4.366   0.885
   42    HB2  LYS 110          1HB       LYS 110   1.419   6.205   0.954
   43    HB3  LYS 110          2HB       LYS 110   1.332   6.143   2.718
   44    HG2  LYS 110          1HG       LYS 110   2.063   3.755   2.655
   45    HG3  LYS 110          2HG       LYS 110   2.037   3.802   0.891
   46    HD2  LYS 110          1HD       LYS 110   4.309   4.006   1.510
   47    HD3  LYS 110          2HD       LYS 110   3.805   5.605   0.960
   48    HE2  LYS 110          1HE       LYS 110   3.542   6.341   3.319
   49    HE3  LYS 110          2HE       LYS 110   3.952   4.715   3.881
   50    HZ1  LYS 110          1HZ       LYS 110   5.879   6.131   4.002
   51    HZ2  LYS 110          2HZ       LYS 110   5.787   6.533   2.413
   52    HZ3  LYS 110          3HZ       LYS 110   6.161   5.000   2.871
   53    H    ILE 111           H        ILE 111  -0.371   2.567   2.032
   54    HA   ILE 111           HA       ILE 111  -1.104   2.692   4.938
   55    HB   ILE 111           HB       ILE 111  -2.256   0.591   4.780
   56   HG12  ILE 111          1HG1      ILE 111  -1.574   0.630   1.832
   57   HG13  ILE 111          2HG1      ILE 111  -1.029  -0.533   3.027
   58   HG21  ILE 111          1HG2      ILE 111  -3.477   2.734   4.371
   59   HG22  ILE 111          2HG2      ILE 111  -3.389   2.394   2.622
   60   HG23  ILE 111          3HG2      ILE 111  -4.266   1.295   3.720
   61   HD11  ILE 111          1HD1      ILE 111  -3.876  -0.256   2.011
   62   HD12  ILE 111          2HD1      ILE 111  -2.729  -1.563   1.681
   63   HD13  ILE 111          3HD1      ILE 111  -3.356  -1.341   3.324
   64    H    PHE 112           H        PHE 112  -0.305   1.191   6.242
   65    HA   PHE 112           HA       PHE 112   2.227  -0.224   5.636
   66    HB2  PHE 112          1HB       PHE 112   2.064   1.191   7.669
   67    HB3  PHE 112          2HB       PHE 112   0.619   0.330   8.177
   68    HD1  PHE 112          1HD       PHE 112   0.771  -2.026   9.048
   69    HD2  PHE 112          2HD       PHE 112   4.257   0.219   7.889
   70    HE1  PHE 112          1HE       PHE 112   2.224  -3.662  10.214
   71    HE2  PHE 112          2HE       PHE 112   5.697  -1.385   9.051
   72    HZ   PHE 112           HZ       PHE 112   4.692  -3.363  10.218
   73    H    VAL 113           H        VAL 113   2.212  -2.458   5.530
   74    HA   VAL 113           HA       VAL 113  -0.285  -3.968   6.169
   75    HB   VAL 113           HB       VAL 113   1.474  -4.491   3.754
   76   HG11  VAL 113          1HG1      VAL 113   0.425  -6.528   4.652
   77   HG12  VAL 113          2HG1      VAL 113  -1.159  -5.721   4.671
   78   HG13  VAL 113          3HG1      VAL 113  -0.338  -6.060   3.131
   79   HG21  VAL 113          1HG2      VAL 113  -1.284  -3.216   3.916
   80   HG22  VAL 113          2HG2      VAL 113   0.233  -2.458   3.353
   81   HG23  VAL 113          3HG2      VAL 113  -0.484  -3.767   2.425
   82    H    GLY 114           H        GLY 114   0.178  -5.236   7.842
   83    HA2  GLY 114          1HA       GLY 114   2.938  -6.404   8.110
   84    HA3  GLY 114          2HA       GLY 114   1.983  -5.818   9.461
   85    H    GLY 115           H        GLY 115   3.193  -8.459   8.859
   86    HA2  GLY 115          1HA       GLY 115   2.477 -10.534   9.785
   87    HA3  GLY 115          2HA       GLY 115   0.808 -10.196   9.342
   88    H    LEU 116           H        LEU 116   3.178  -9.536   6.891
   89    HA   LEU 116           HA       LEU 116   2.085 -11.449   5.012
   90    HB2  LEU 116          1HB       LEU 116   4.688  -9.866   5.004
   91    HB3  LEU 116          2HB       LEU 116   4.067 -10.756   3.623
   92    HG   LEU 116           HG       LEU 116   2.524  -8.455   4.901
   93   HD11  LEU 116          1HD1      LEU 116   4.759  -7.689   4.105
   94   HD12  LEU 116          2HD1      LEU 116   3.432  -7.034   3.130
   95   HD13  LEU 116          3HD1      LEU 116   4.419  -8.382   2.515
   96   HD21  LEU 116          1HD2      LEU 116   2.441  -9.641   2.094
   97   HD22  LEU 116          2HD2      LEU 116   1.375  -8.388   2.755
   98   HD23  LEU 116          3HD2      LEU 116   1.286 -10.058   3.359
   99    H    SER 117           H        SER 117   2.812 -13.478   4.431
  100    HA   SER 117           HA       SER 117   4.727 -14.911   6.098
  101    HB2  SER 117          1HB       SER 117   2.924 -16.114   4.921
  102    HB3  SER 117          2HB       SER 117   3.595 -15.607   3.359
  103    HG   SER 117           HG       SER 117   4.684 -17.380   5.285
  104    H    VAL 118           H        VAL 118   6.908 -15.329   5.698
  105    HA   VAL 118           HA       VAL 118   8.409 -13.536   4.076
  106    HB   VAL 118           HB       VAL 118  10.354 -14.667   4.713
  107   HG11  VAL 118          1HG1      VAL 118   9.166 -13.490   6.559
  108   HG12  VAL 118          2HG1      VAL 118   8.432 -15.031   7.052
  109   HG13  VAL 118          3HG1      VAL 118  10.185 -14.826   7.120
  110   HG21  VAL 118          1HG2      VAL 118   9.825 -16.987   4.164
  111   HG22  VAL 118          2HG2      VAL 118  10.393 -16.872   5.831
  112   HG23  VAL 118          3HG2      VAL 118   8.658 -17.065   5.505
  113    H    ASN 119           H        ASN 119   6.726 -16.313   3.083
  114    HA   ASN 119           HA       ASN 119   8.227 -16.897   0.648
  115    HB2  ASN 119          1HB       ASN 119   5.357 -17.521   1.496
  116    HB3  ASN 119          2HB       ASN 119   6.186 -18.214   0.107
  117   HD21  ASN 119          1HD2      ASN 119   5.660 -18.503   3.503
  118   HD22  ASN 119          2HD2      ASN 119   6.755 -19.867   3.733
  119    H    THR 120           H        THR 120   5.946 -14.426   1.543
  120    HA   THR 120           HA       THR 120   4.750 -13.937  -1.054
  121    HB   THR 120           HB       THR 120   4.935 -12.170   1.422
  122    HG1  THR 120          1HG       THR 120   3.823 -13.869   2.019
  123   HG21  THR 120          1HG2      THR 120   3.198 -11.941  -1.046
  124   HG22  THR 120          2HG2      THR 120   4.251 -10.716  -0.310
  125   HG23  THR 120          3HG2      THR 120   2.767 -11.220   0.511
  126    H    THR 121           H        THR 121   5.144 -12.382  -2.562
  127    HA   THR 121           HA       THR 121   7.501 -10.615  -2.156
  128    HB   THR 121           HB       THR 121   7.982 -12.432  -3.786
  129    HG1  THR 121          1HG       THR 121   9.054 -10.973  -5.083
  130   HG21  THR 121          1HG2      THR 121   6.156 -10.795  -5.615
  131   HG22  THR 121          2HG2      THR 121   5.822 -12.439  -5.024
  132   HG23  THR 121          3HG2      THR 121   7.204 -12.147  -6.088
  133    H    VAL 122           H        VAL 122   7.534  -8.636  -3.383
  134    HA   VAL 122           HA       VAL 122   5.398  -7.035  -2.565
  135    HB   VAL 122           HB       VAL 122   7.781  -6.387  -2.978
  136   HG11  VAL 122          1HG1      VAL 122   6.924  -5.935  -5.869
  137   HG12  VAL 122          2HG1      VAL 122   8.481  -5.534  -5.126
  138   HG13  VAL 122          3HG1      VAL 122   8.016  -7.229  -5.320
  139   HG21  VAL 122          1HG2      VAL 122   6.021  -4.731  -2.461
  140   HG22  VAL 122          2HG2      VAL 122   7.281  -4.087  -3.535
  141   HG23  VAL 122          3HG2      VAL 122   5.707  -4.540  -4.202
  142    H    GLU 123           H        GLU 123   5.826  -8.476  -5.764
  143    HA   GLU 123           HA       GLU 123   3.694  -6.998  -7.031
  144    HB2  GLU 123          1HB       GLU 123   4.973  -9.673  -7.749
  145    HB3  GLU 123          2HB       GLU 123   3.858  -8.753  -8.777
  146    HG2  GLU 123          1HG       GLU 123   5.462  -6.820  -8.713
  147    HG3  GLU 123          2HG       GLU 123   6.610  -7.839  -7.839
  148    H    ASP 124           H        ASP 124   3.682  -9.914  -5.012
  149    HA   ASP 124           HA       ASP 124   0.964 -10.774  -5.654
  150    HB2  ASP 124          1HB       ASP 124   2.366 -11.051  -2.964
  151    HB3  ASP 124          2HB       ASP 124   1.024 -11.992  -3.573
  152    H    VAL 125           H        VAL 125   2.488  -8.782  -3.080
  153    HA   VAL 125           HA       VAL 125   0.116  -8.047  -1.733
  154    HB   VAL 125           HB       VAL 125   2.706  -6.456  -1.865
  155   HG11  VAL 125          1HG1      VAL 125   2.070  -5.634   0.353
  156   HG12  VAL 125          2HG1      VAL 125   0.820  -5.210  -0.820
  157   HG13  VAL 125          3HG1      VAL 125   0.563  -6.569   0.298
  158   HG21  VAL 125          1HG2      VAL 125   1.838  -8.803  -0.136
  159   HG22  VAL 125          2HG2      VAL 125   3.267  -8.694  -1.184
  160   HG23  VAL 125          3HG2      VAL 125   3.181  -7.738   0.295
  161    H    LYS 126           H        LYS 126   1.814  -6.266  -4.356
  162    HA   LYS 126           HA       LYS 126  -0.062  -4.118  -4.522
  163    HB2  LYS 126          1HB       LYS 126   2.177  -4.144  -5.573
  164    HB3  LYS 126          2HB       LYS 126   1.627  -5.340  -6.756
  165    HG2  LYS 126          1HG       LYS 126   0.050  -3.776  -7.719
  166    HG3  LYS 126          2HG       LYS 126   0.260  -2.656  -6.369
  167    HD2  LYS 126          1HD       LYS 126   2.707  -2.430  -7.076
  168    HD3  LYS 126          2HD       LYS 126   2.261  -3.246  -8.580
  169    HE2  LYS 126          1HE       LYS 126   0.942  -0.718  -7.476
  170    HE3  LYS 126          2HE       LYS 126   2.266  -0.692  -8.635
  171    HZ1  LYS 126          1HZ       LYS 126  -0.316  -2.065  -9.234
  172    HZ2  LYS 126          2HZ       LYS 126   0.878  -1.678 -10.275
  173    HZ3  LYS 126          3HZ       LYS 126  -0.033  -0.498  -9.581
  174    H    HIS 127           H        HIS 127  -0.097  -7.261  -6.297
  175    HA   HIS 127           HA       HIS 127  -2.511  -6.761  -7.722
  176    HB2  HIS 127          1HB       HIS 127  -0.813  -8.517  -8.235
  177    HB3  HIS 127          2HB       HIS 127  -1.352  -9.429  -6.821
  178    HD2  HIS 127          2HD       HIS 127  -2.889  -7.926 -10.070
  179    HE1  HIS 127          1HE       HIS 127  -5.134 -11.435  -9.131
  180    HE2  HIS 127          2HE       HIS 127  -4.841  -9.548 -10.818
  181    H    TYR 128           H        TYR 128  -2.065  -8.301  -4.474
  182    HA   TYR 128           HA       TYR 128  -4.792  -8.856  -4.067
  183    HB2  TYR 128          1HB       TYR 128  -2.461  -8.546  -2.221
  184    HB3  TYR 128          2HB       TYR 128  -4.077  -8.677  -1.581
  185    HD1  TYR 128          1HD       TYR 128  -5.572 -10.672  -2.412
  186    HD2  TYR 128          2HD       TYR 128  -1.272 -10.570  -2.621
  187    HE1  TYR 128          1HE       TYR 128  -5.510 -13.162  -2.553
  188    HE2  TYR 128          2HE       TYR 128  -1.209 -13.041  -2.816
  189    HH   TYR 128           HH       TYR 128  -2.485 -14.962  -3.116
  190    H    PHE 129           H        PHE 129  -3.222  -5.739  -3.695
  191    HA   PHE 129           HA       PHE 129  -5.699  -4.648  -2.548
  192    HB2  PHE 129          1HB       PHE 129  -3.012  -3.388  -2.980
  193    HB3  PHE 129          2HB       PHE 129  -4.440  -2.499  -2.454
  194    HD1  PHE 129          1HD       PHE 129  -5.797  -3.613  -0.393
  195    HD2  PHE 129          2HD       PHE 129  -1.656  -4.335  -1.341
  196    HE1  PHE 129          1HE       PHE 129  -5.445  -4.607   1.861
  197    HE2  PHE 129          2HE       PHE 129  -1.316  -5.333   0.900
  198    HZ   PHE 129           HZ       PHE 129  -3.209  -5.514   2.476
  199    H    GLU 130           H        GLU 130  -4.321  -4.763  -5.714
  200    HA   GLU 130           HA       GLU 130  -5.856  -2.712  -6.949
  201    HB2  GLU 130          1HB       GLU 130  -4.639  -5.280  -7.969
  202    HB3  GLU 130          2HB       GLU 130  -5.543  -4.190  -9.032
  203    HG2  GLU 130          1HG       GLU 130  -4.071  -2.336  -8.554
  204    HG3  GLU 130          2HG       GLU 130  -3.204  -3.261  -7.336
  205    H    GLN 131           H        GLN 131  -6.995  -5.612  -5.588
  206    HA   GLN 131           HA       GLN 131  -9.444  -6.078  -6.980
  207    HB2  GLN 131          1HB       GLN 131  -8.784  -6.322  -3.995
  208    HB3  GLN 131          2HB       GLN 131 -10.149  -7.078  -4.834
  209    HG2  GLN 131          1HG       GLN 131  -8.469  -8.210  -6.331
  210    HG3  GLN 131          2HG       GLN 131  -7.185  -7.664  -5.261
  211   HE21  GLN 131          1HE2      GLN 131  -7.397  -8.291  -2.897
  212   HE22  GLN 131          2HE2      GLN 131  -8.226  -9.805  -2.512
  213    H    PHE 132           H        PHE 132  -8.617  -3.898  -4.339
  214    HA   PHE 132           HA       PHE 132 -11.322  -2.863  -4.007
  215    HB2  PHE 132          1HB       PHE 132  -8.689  -1.989  -2.761
  216    HB3  PHE 132          2HB       PHE 132 -10.279  -1.385  -2.314
  217    HD1  PHE 132          1HD       PHE 132  -7.854  -3.953  -1.756
  218    HD2  PHE 132          2HD       PHE 132 -12.088  -3.155  -1.593
  219    HE1  PHE 132          1HE       PHE 132  -8.165  -5.917  -0.283
  220    HE2  PHE 132          2HE       PHE 132 -12.404  -5.152  -0.152
  221    HZ   PHE 132           HZ       PHE 132 -10.442  -6.535   0.512
  222    H    GLY 133           H        GLY 133  -8.475  -1.667  -5.644
  223    HA2  GLY 133          1HA       GLY 133  -9.687   0.057  -7.462
  224    HA3  GLY 133          2HA       GLY 133  -9.307   1.056  -6.054
  225    H    LYS 134           H        LYS 134  -7.999   1.793  -8.276
  226    HA   LYS 134           HA       LYS 134  -5.732   0.268  -9.019
  227    HB2  LYS 134          1HB       LYS 134  -6.718   1.925 -10.472
  228    HB3  LYS 134          2HB       LYS 134  -6.262   3.236  -9.378
  229    HG2  LYS 134          1HG       LYS 134  -3.884   2.830  -9.790
  230    HG3  LYS 134          2HG       LYS 134  -4.261   1.367 -10.722
  231    HD2  LYS 134          1HD       LYS 134  -5.374   2.707 -12.455
  232    HD3  LYS 134          2HD       LYS 134  -5.186   4.168 -11.488
  233    HE2  LYS 134          1HE       LYS 134  -3.522   4.206 -13.213
  234    HE3  LYS 134          2HE       LYS 134  -2.718   3.992 -11.658
  235    HZ1  LYS 134          1HZ       LYS 134  -2.496   1.617 -12.173
  236    HZ2  LYS 134          2HZ       LYS 134  -1.832   2.500 -13.372
  237    HZ3  LYS 134          3HZ       LYS 134  -3.289   1.804 -13.594
  238    H    VAL 135           H        VAL 135  -3.876  -0.112  -8.193
  239    HA   VAL 135           HA       VAL 135  -2.798   1.453  -5.905
  240    HB   VAL 135           HB       VAL 135  -1.920  -1.255  -6.935
  241   HG11  VAL 135          1HG1      VAL 135  -0.131  -0.065  -5.678
  242   HG12  VAL 135          2HG1      VAL 135  -1.273   0.197  -4.344
  243   HG13  VAL 135          3HG1      VAL 135  -0.766  -1.440  -4.763
  244   HG21  VAL 135          1HG2      VAL 135  -3.029  -2.176  -4.956
  245   HG22  VAL 135          2HG2      VAL 135  -3.614  -0.561  -4.492
  246   HG23  VAL 135          3HG2      VAL 135  -4.217  -1.350  -5.961
  247    H    ASP 136           H        ASP 136  -1.062   2.695  -6.093
  248    HA   ASP 136           HA       ASP 136   0.084   3.272  -8.725
  249    HB2  ASP 136          1HB       ASP 136  -0.472   5.103  -7.225
  250    HB3  ASP 136          2HB       ASP 136   0.510   4.408  -5.945
  251    H    ASP 137           H        ASP 137   1.322   2.036  -5.581
  252    HA   ASP 137           HA       ASP 137   3.559   0.612  -6.862
  253    HB2  ASP 137          1HB       ASP 137   4.187   3.111  -6.696
  254    HB3  ASP 137          2HB       ASP 137   4.086   2.936  -4.945
  255    H    ALA 138           H        ALA 138   4.913  -0.464  -5.179
  256    HA   ALA 138           HA       ALA 138   3.937  -0.616  -2.437
  257    HB1  ALA 138          1HB       ALA 138   3.652  -3.088  -2.464
  258    HB2  ALA 138          2HB       ALA 138   2.473  -2.279  -3.511
  259    HB3  ALA 138          3HB       ALA 138   3.881  -3.091  -4.226
  260    H    MET 139           H        MET 139   5.462  -1.607  -0.996
  261    HA   MET 139           HA       MET 139   8.034  -2.602  -2.028
  262    HB2  MET 139          1HB       MET 139   9.393  -1.006  -0.742
  263    HB3  MET 139          2HB       MET 139   8.525  -0.248  -2.074
  264    HG2  MET 139          1HG       MET 139   6.878   0.696  -0.535
  265    HG3  MET 139          2HG       MET 139   7.607  -0.156   0.826
  266    HE1  MET 139          1HE       MET 139   8.407   3.540   1.690
  267    HE2  MET 139          2HE       MET 139   6.936   2.859   0.967
  268    HE3  MET 139          3HE       MET 139   7.766   1.998   2.288
  269    H    LEU 140           H        LEU 140   8.998  -4.055  -0.654
  270    HA   LEU 140           HA       LEU 140   7.804  -4.391   2.070
  271    HB2  LEU 140          1HB       LEU 140   9.158  -6.576   0.493
  272    HB3  LEU 140          2HB       LEU 140   8.270  -6.714   2.004
  273    HG   LEU 140           HG       LEU 140   7.117  -6.142  -0.754
  274   HD11  LEU 140          1HD1      LEU 140   7.756  -8.488  -0.321
  275   HD12  LEU 140          2HD1      LEU 140   5.993  -8.309  -0.423
  276   HD13  LEU 140          3HD1      LEU 140   6.774  -8.484   1.160
  277   HD21  LEU 140          1HD2      LEU 140   5.763  -4.896   0.840
  278   HD22  LEU 140          2HD2      LEU 140   5.687  -6.299   1.925
  279   HD23  LEU 140          3HD2      LEU 140   4.892  -6.326   0.329
  280    H    MET 141           H        MET 141   9.121  -4.735   3.822
  281    HA   MET 141           HA       MET 141  11.723  -3.446   3.629
  282    HB2  MET 141          1HB       MET 141   9.907  -4.352   5.860
  283    HB3  MET 141          2HB       MET 141  11.582  -3.899   6.189
  284    HG2  MET 141          1HG       MET 141  10.120  -2.026   6.502
  285    HG3  MET 141          2HG       MET 141  11.296  -1.708   5.250
  286    HE1  MET 141          1HE       MET 141  10.612  -1.711   2.586
  287    HE2  MET 141          2HE       MET 141   9.279  -0.575   2.309
  288    HE3  MET 141          3HE       MET 141  10.593  -0.138   3.417
  289    H    PHE 142           H        PHE 142  12.747  -4.976   2.271
  290    HA   PHE 142           HA       PHE 142  13.493  -7.565   3.143
  291    HB2  PHE 142          1HB       PHE 142  14.418  -5.866   0.897
  292    HB3  PHE 142          2HB       PHE 142  15.261  -7.347   1.316
  293    HD1  PHE 142          1HD       PHE 142  12.191  -5.977  -0.150
  294    HD2  PHE 142          2HD       PHE 142  14.147  -9.557   1.234
  295    HE1  PHE 142          1HE       PHE 142  10.542  -7.359  -1.393
  296    HE2  PHE 142          2HE       PHE 142  12.486 -10.941  -0.004
  297    HZ   PHE 142           HZ       PHE 142  10.682  -9.841  -1.313
  298    H    ASP 143           H        ASP 143  15.054  -8.544   4.185
  299    HA   ASP 143           HA       ASP 143  16.937  -7.098   5.796
  300    HB2  ASP 143          1HB       ASP 143  16.101  -9.127   6.609
  301    HB3  ASP 143          2HB       ASP 143  16.486  -9.975   5.114
  302    H    LYS 144           H        LYS 144  18.768  -6.212   5.285
  303    HA   LYS 144           HA       LYS 144  19.740  -6.110   2.632
  304    HB2  LYS 144          1HB       LYS 144  19.910  -4.311   4.331
  305    HB3  LYS 144          2HB       LYS 144  21.084  -5.264   5.246
  306    HG2  LYS 144          1HG       LYS 144  22.730  -5.060   3.454
  307    HG3  LYS 144          2HG       LYS 144  21.531  -4.291   2.391
  308    HD2  LYS 144          1HD       LYS 144  21.377  -2.374   3.955
  309    HD3  LYS 144          2HD       LYS 144  22.561  -3.153   5.029
  310    HE2  LYS 144          1HE       LYS 144  24.239  -3.119   3.193
  311    HE3  LYS 144          2HE       LYS 144  23.061  -2.345   2.126
  312    HZ1  LYS 144          1HZ       LYS 144  23.022  -0.445   3.656
  313    HZ2  LYS 144          2HZ       LYS 144  24.545  -0.711   3.137
  314    HZ3  LYS 144          3HZ       LYS 144  24.112  -1.161   4.643
  315    H    THR 145           H        THR 145  20.444  -8.487   4.956
  316    HA   THR 145           HA       THR 145  22.877  -9.475   3.734
  317    HB   THR 145           HB       THR 145  21.125 -11.328   5.225
  318    HG1  THR 145          1HG       THR 145  20.871  -9.595   6.496
  319   HG21  THR 145          1HG2      THR 145  23.272 -11.962   6.309
  320   HG22  THR 145          2HG2      THR 145  24.107 -10.689   5.392
  321   HG23  THR 145          3HG2      THR 145  23.388 -12.080   4.551
  322    H    THR 146           H        THR 146  19.923  -9.277   2.402
  323    HA   THR 146           HA       THR 146  18.892 -10.056   0.728
  324    HB   THR 146           HB       THR 146  20.940 -11.772  -0.518
  325    HG1  THR 146          1HG       THR 146  22.069  -9.976  -1.187
  326   HG21  THR 146          1HG2      THR 146  18.788 -11.187  -1.640
  327   HG22  THR 146          2HG2      THR 146  20.176 -10.491  -2.495
  328   HG23  THR 146          3HG2      THR 146  19.173  -9.464  -1.440
  329    H    ASN 147           H        ASN 147  18.360 -11.247   3.011
  330    HA   ASN 147           HA       ASN 147  17.881 -14.124   2.482
  331    HB2  ASN 147          1HB       ASN 147  17.361 -12.383   4.911
  332    HB3  ASN 147          2HB       ASN 147  16.926 -14.086   4.818
  333   HD21  ASN 147          1HD2      ASN 147  20.393 -13.465   6.326
  334   HD22  ASN 147          2HD2      ASN 147  18.987 -12.398   6.423
  335    H    ARG 148           H        ARG 148  15.642 -11.757   3.853
  336    HA   ARG 148           HA       ARG 148  13.466 -12.079   1.987
  337    HB2  ARG 148          1HB       ARG 148  11.907 -13.238   3.600
  338    HB3  ARG 148          2HB       ARG 148  13.148 -14.240   2.886
  339    HG2  ARG 148          1HG       ARG 148  12.992 -14.951   5.110
  340    HG3  ARG 148          2HG       ARG 148  14.490 -14.056   5.006
  341    HD2  ARG 148          1HD       ARG 148  13.032 -12.047   5.964
  342    HD3  ARG 148          2HD       ARG 148  11.894 -13.311   6.378
  343    HE   ARG 148           HE       ARG 148  13.365 -14.098   8.023
  344   HH11  ARG 148          1HH1      ARG 148  14.917 -11.491   6.273
  345   HH12  ARG 148          2HH1      ARG 148  16.398 -11.600   7.206
  346   HH21  ARG 148          1HH2      ARG 148  15.202 -14.077   9.284
  347   HH22  ARG 148          2HH2      ARG 148  16.476 -12.933   8.954
  348    H    HIS 149           H        HIS 149  11.445 -10.968   2.879
  349    HA   HIS 149           HA       HIS 149  12.242  -8.527   4.293
  350    HB2  HIS 149          1HB       HIS 149   9.951  -7.773   3.891
  351    HB3  HIS 149          2HB       HIS 149  10.710  -8.349   2.412
  352    HD2  HIS 149          2HD       HIS 149   9.548 -10.311   1.131
  353    HE1  HIS 149          1HE       HIS 149   6.486 -11.230   3.943
  354    HE2  HIS 149          2HE       HIS 149   7.394 -11.710   1.593
  355    H    ARG 150           H        ARG 150  11.220  -7.628   6.060
  356    HA   ARG 150           HA       ARG 150  11.200  -9.320   8.378
  357    HB2  ARG 150          1HB       ARG 150  10.507  -6.401   7.894
  358    HB3  ARG 150          2HB       ARG 150  10.464  -7.135   9.500
  359    HG2  ARG 150          1HG       ARG 150  12.851  -7.715   9.353
  360    HG3  ARG 150          2HG       ARG 150  12.935  -7.015   7.733
  361    HD2  ARG 150          1HD       ARG 150  13.811  -5.449   9.402
  362    HD3  ARG 150          2HD       ARG 150  12.369  -4.801   8.608
  363    HE   ARG 150           HE       ARG 150  11.665  -6.171  11.051
  364   HH11  ARG 150          1HH1      ARG 150  13.119  -3.085  10.107
  365   HH12  ARG 150          2HH1      ARG 150  12.242  -2.271  11.407
  366   HH21  ARG 150          1HH2      ARG 150  10.473  -4.867  12.477
  367   HH22  ARG 150          2HH2      ARG 150  11.010  -3.206  12.677
  368    H    GLY 151           H        GLY 151   8.800  -9.563   6.292
  369    HA2  GLY 151          1HA       GLY 151   6.696 -10.466   6.530
  370    HA3  GLY 151          2HA       GLY 151   6.770 -10.261   8.279
  371    H    PHE 152           H        PHE 152   7.405  -7.411   6.306
  372    HA   PHE 152           HA       PHE 152   4.614  -6.594   6.168
  373    HB2  PHE 152          1HB       PHE 152   4.757  -4.657   7.571
  374    HB3  PHE 152          2HB       PHE 152   5.245  -6.021   8.535
  375    HD1  PHE 152          1HD       PHE 152   6.246  -2.834   7.054
  376    HD2  PHE 152          2HD       PHE 152   7.677  -6.301   9.179
  377    HE1  PHE 152          1HE       PHE 152   8.245  -1.572   7.774
  378    HE2  PHE 152          2HE       PHE 152   9.644  -5.029   9.917
  379    HZ   PHE 152           HZ       PHE 152   9.971  -2.684   9.204
  380    H    GLY 153           H        GLY 153   4.393  -4.418   5.197
  381    HA2  GLY 153          1HA       GLY 153   6.672  -2.994   4.168
  382    HA3  GLY 153          2HA       GLY 153   5.842  -3.876   2.881
  383    H    PHE 154           H        PHE 154   5.598  -1.690   2.064
  384    HA   PHE 154           HA       PHE 154   3.135  -0.368   3.063
  385    HB2  PHE 154          1HB       PHE 154   5.592   0.937   1.898
  386    HB3  PHE 154          2HB       PHE 154   4.049   1.748   2.108
  387    HD1  PHE 154          1HD       PHE 154   6.879   0.180   3.892
  388    HD2  PHE 154          2HD       PHE 154   3.247   2.460   4.304
  389    HE1  PHE 154          1HE       PHE 154   7.448   0.652   6.246
  390    HE2  PHE 154          2HE       PHE 154   3.858   3.001   6.652
  391    HZ   PHE 154           HZ       PHE 154   5.970   2.095   7.626
  392    H    VAL 155           H        VAL 155   1.687   0.539   1.645
  393    HA   VAL 155           HA       VAL 155   1.981  -0.082  -1.254
  394    HB   VAL 155           HB       VAL 155  -0.534  -0.738   0.301
  395   HG11  VAL 155          1HG1      VAL 155  -1.200  -1.870  -1.794
  396   HG12  VAL 155          2HG1      VAL 155  -0.958  -0.142  -2.038
  397   HG13  VAL 155          3HG1      VAL 155   0.291  -1.292  -2.573
  398   HG21  VAL 155          1HG2      VAL 155   1.183  -2.375   0.925
  399   HG22  VAL 155          2HG2      VAL 155  -0.019  -3.100  -0.129
  400   HG23  VAL 155          3HG2      VAL 155   1.568  -2.646  -0.790
  401    H    THR 156           H        THR 156   1.460   1.528  -2.530
  402    HA   THR 156           HA       THR 156   0.042   3.871  -1.419
  403    HB   THR 156           HB       THR 156   1.847   4.129  -3.777
  404    HG1  THR 156          1HG       THR 156   3.520   4.592  -2.383
  405   HG21  THR 156          1HG2      THR 156   1.024   6.024  -1.532
  406   HG22  THR 156          2HG2      THR 156   0.436   6.063  -3.211
  407   HG23  THR 156          3HG2      THR 156   2.131   6.416  -2.865
  408    H    PHE 157           H        PHE 157  -1.636   4.863  -2.408
  409    HA   PHE 157           HA       PHE 157  -2.919   3.314  -4.563
  410    HB2  PHE 157          1HB       PHE 157  -4.006   4.805  -2.189
  411    HB3  PHE 157          2HB       PHE 157  -5.018   4.250  -3.509
  412    HD1  PHE 157          1HD       PHE 157  -5.833   2.029  -3.579
  413    HD2  PHE 157          2HD       PHE 157  -2.565   2.999  -0.947
  414    HE1  PHE 157          1HE       PHE 157  -5.986  -0.226  -2.555
  415    HE2  PHE 157          2HE       PHE 157  -2.684   0.732   0.019
  416    HZ   PHE 157           HZ       PHE 157  -4.407  -0.878  -0.742
  417    H    GLU 158           H        GLU 158  -4.379   4.265  -6.035
  418    HA   GLU 158           HA       GLU 158  -3.466   6.784  -7.184
  419    HB2  GLU 158          1HB       GLU 158  -4.240   4.941  -8.537
  420    HB3  GLU 158          2HB       GLU 158  -5.842   4.996  -7.824
  421    HG2  GLU 158          1HG       GLU 158  -4.650   7.413  -9.248
  422    HG3  GLU 158          2HG       GLU 158  -5.327   6.084 -10.168
  423    H    SER 159           H        SER 159  -6.048   5.938  -4.927
  424    HA   SER 159           HA       SER 159  -6.710   8.818  -4.587
  425    HB2  SER 159          1HB       SER 159  -8.383   8.000  -6.115
  426    HB3  SER 159          2HB       SER 159  -8.709   6.594  -5.085
  427    HG   SER 159           HG       SER 159 -10.183   8.454  -4.894
  428    H    GLU 160           H        GLU 160  -7.364   9.445  -2.568
  429    HA   GLU 160           HA       GLU 160  -6.586   7.920  -0.259
  430    HB2  GLU 160          1HB       GLU 160  -8.564  10.252  -0.404
  431    HB3  GLU 160          2HB       GLU 160  -7.713   9.644   1.005
  432    HG2  GLU 160          1HG       GLU 160  -6.505  11.497   0.555
  433    HG3  GLU 160          2HG       GLU 160  -5.540  10.259  -0.238
  434    H    ASP 161           H        ASP 161  -9.611   8.264  -2.055
  435    HA   ASP 161           HA       ASP 161 -11.380   7.173  -0.093
  436    HB2  ASP 161          1HB       ASP 161 -11.608   7.342  -3.102
  437    HB3  ASP 161          2HB       ASP 161 -12.856   6.633  -2.091
  438    H    ILE 162           H        ILE 162  -9.246   5.468  -2.306
  439    HA   ILE 162           HA       ILE 162 -10.421   2.852  -1.689
  440    HB   ILE 162           HB       ILE 162  -7.599   3.288  -2.672
  441   HG12  ILE 162          1HG1      ILE 162  -8.807   4.512  -4.278
  442   HG13  ILE 162          2HG1      ILE 162  -8.384   2.947  -4.957
  443   HG21  ILE 162          1HG2      ILE 162  -9.606   1.001  -2.911
  444   HG22  ILE 162          2HG2      ILE 162  -8.034   1.042  -3.732
  445   HG23  ILE 162          3HG2      ILE 162  -8.103   1.027  -1.972
  446   HD11  ILE 162          1HD1      ILE 162 -11.150   3.793  -3.972
  447   HD12  ILE 162          2HD1      ILE 162 -10.639   3.559  -5.651
  448   HD13  ILE 162          3HD1      ILE 162 -10.745   2.165  -4.556
  449    H    VAL 163           H        VAL 163  -7.673   4.836  -0.472
  450    HA   VAL 163           HA       VAL 163  -6.641   2.896   1.330
  451    HB   VAL 163           HB       VAL 163  -6.669   5.947   1.561
  452   HG11  VAL 163          1HG1      VAL 163  -4.737   5.643   3.125
  453   HG12  VAL 163          2HG1      VAL 163  -6.288   5.145   3.798
  454   HG13  VAL 163          3HG1      VAL 163  -5.154   3.916   3.213
  455   HG21  VAL 163          1HG2      VAL 163  -4.298   5.640   0.859
  456   HG22  VAL 163          2HG2      VAL 163  -4.636   3.931   0.557
  457   HG23  VAL 163          3HG2      VAL 163  -5.481   5.192  -0.381
  458    H    GLU 164           H        GLU 164  -9.215   5.369   1.804
  459    HA   GLU 164           HA       GLU 164  -9.897   4.638   4.488
  460    HB2  GLU 164          1HB       GLU 164 -11.666   5.736   2.271
  461    HB3  GLU 164          2HB       GLU 164 -12.145   5.619   3.956
  462    HG2  GLU 164          1HG       GLU 164  -9.858   7.321   2.887
  463    HG3  GLU 164          2HG       GLU 164 -11.467   7.895   3.293
  464    H    LYS 165           H        LYS 165 -11.247   3.341   1.402
  465    HA   LYS 165           HA       LYS 165 -13.095   1.498   2.550
  466    HB2  LYS 165          1HB       LYS 165 -13.021   2.210   0.184
  467    HB3  LYS 165          2HB       LYS 165 -11.531   1.297  -0.057
  468    HG2  LYS 165          1HG       LYS 165 -12.743  -0.811   0.561
  469    HG3  LYS 165          2HG       LYS 165 -14.240   0.114   0.696
  470    HD2  LYS 165          1HD       LYS 165 -12.506  -0.221  -1.790
  471    HD3  LYS 165          2HD       LYS 165 -14.016  -1.070  -1.477
  472    HE2  LYS 165          1HE       LYS 165 -13.721   1.946  -1.874
  473    HE3  LYS 165          2HE       LYS 165 -14.244   0.797  -3.103
  474    HZ1  LYS 165          1HZ       LYS 165 -16.150   1.848  -2.063
  475    HZ2  LYS 165          2HZ       LYS 165 -15.708   1.352  -0.575
  476    HZ3  LYS 165          3HZ       LYS 165 -16.169   0.259  -1.702
  477    H    VAL 166           H        VAL 166  -9.756   0.918   1.507
  478    HA   VAL 166           HA       VAL 166  -9.561  -1.836   2.296
  479    HB   VAL 166           HB       VAL 166  -7.396   0.266   1.951
  480   HG11  VAL 166          1HG1      VAL 166  -7.179  -2.764   1.854
  481   HG12  VAL 166          2HG1      VAL 166  -5.888  -1.618   1.469
  482   HG13  VAL 166          3HG1      VAL 166  -6.500  -1.719   3.125
  483   HG21  VAL 166          1HG2      VAL 166  -8.266  -1.825  -0.075
  484   HG22  VAL 166          2HG2      VAL 166  -8.891  -0.182  -0.107
  485   HG23  VAL 166          3HG2      VAL 166  -7.169  -0.444  -0.314
  486    H    CYS 167           H        CYS 167  -8.634   1.186   4.007
  487    HA   CYS 167           HA       CYS 167  -7.624  -0.164   6.339
  488    HB2  CYS 167          1HB       CYS 167  -6.950   2.110   5.644
  489    HB3  CYS 167          2HB       CYS 167  -8.593   2.699   5.960
  490    HG   CYS 167           HG       CYS 167  -6.487   1.274   8.100
  491    H    GLU 168           H        GLU 168 -10.929   1.114   5.633
  492    HA   GLU 168           HA       GLU 168 -11.991   0.570   8.243
  493    HB2  GLU 168          1HB       GLU 168 -13.239   0.838   5.496
  494    HB3  GLU 168          2HB       GLU 168 -14.203   0.407   6.916
  495    HG2  GLU 168          1HG       GLU 168 -13.481   2.420   8.101
  496    HG3  GLU 168          2HG       GLU 168 -12.482   2.913   6.740
  497    H    ILE 169           H        ILE 169 -11.341  -1.641   5.575
  498    HA   ILE 169           HA       ILE 169 -12.757  -3.915   6.744
  499    HB   ILE 169           HB       ILE 169 -10.540  -3.707   4.685
  500   HG12  ILE 169          1HG1      ILE 169 -13.469  -4.484   4.271
  501   HG13  ILE 169          2HG1      ILE 169 -12.951  -2.809   4.199
  502   HG21  ILE 169          1HG2      ILE 169 -11.069  -6.081   4.105
  503   HG22  ILE 169          2HG2      ILE 169 -10.367  -5.909   5.699
  504   HG23  ILE 169          3HG2      ILE 169 -12.117  -6.173   5.536
  505   HD11  ILE 169          1HD1      ILE 169 -11.985  -5.017   2.360
  506   HD12  ILE 169          2HD1      ILE 169 -13.051  -3.661   1.962
  507   HD13  ILE 169          3HD1      ILE 169 -11.355  -3.351   2.374
  508    H    HIS 170           H        HIS 170  -9.492  -2.619   6.926
  509    HA   HIS 170           HA       HIS 170  -7.773  -2.767   8.337
  510    HB2  HIS 170          1HB       HIS 170  -9.772  -2.403   9.925
  511    HB3  HIS 170          2HB       HIS 170  -9.514  -4.070  10.423
  512    HD2  HIS 170          2HD       HIS 170  -6.872  -4.575  11.374
  513    HE1  HIS 170          1HE       HIS 170  -6.163  -0.543  12.551
  514    HE2  HIS 170          2HE       HIS 170  -5.330  -2.945  12.759
  515    H    PHE 171           H        PHE 171  -9.469  -5.911   8.375
  516    HA   PHE 171           HA       PHE 171  -6.816  -7.219   8.269
  517    HB2  PHE 171          1HB       PHE 171  -9.253  -8.160   9.692
  518    HB3  PHE 171          2HB       PHE 171  -8.036  -9.286   9.126
  519    HD1  PHE 171          1HD       PHE 171  -5.666  -9.150   9.907
  520    HD2  PHE 171          2HD       PHE 171  -8.800  -6.757  11.646
  521    HE1  PHE 171          1HE       PHE 171  -4.227  -8.707  11.884
  522    HE2  PHE 171          2HE       PHE 171  -7.360  -6.314  13.625
  523    HZ   PHE 171           HZ       PHE 171  -5.070  -7.284  13.742
  524    H    HIS 172           H        HIS 172  -6.137  -8.300   6.647
  525    HA   HIS 172           HA       HIS 172  -8.039  -8.988   4.428
  526    HB2  HIS 172          1HB       HIS 172  -5.413  -7.463   4.339
  527    HB3  HIS 172          2HB       HIS 172  -6.189  -8.144   2.920
  528    HD2  HIS 172          2HD       HIS 172  -6.881  -5.412   5.630
  529    HE1  HIS 172          1HE       HIS 172  -9.088  -4.384   2.151
  530    HE2  HIS 172          2HE       HIS 172  -8.354  -3.600   4.446
  531    H    GLU 173           H        GLU 173  -7.193 -10.500   2.829
  532    HA   GLU 173           HA       GLU 173  -5.339 -12.520   4.030
  533    HB2  GLU 173          1HB       GLU 173  -7.617 -13.298   3.696
  534    HB3  GLU 173          2HB       GLU 173  -7.549 -12.850   1.983
  535    HG2  GLU 173          1HG       GLU 173  -5.727 -14.500   1.624
  536    HG3  GLU 173          2HG       GLU 173  -5.764 -14.915   3.339
  537    H    ILE 174           H        ILE 174  -3.402 -12.798   3.132
  538    HA   ILE 174           HA       ILE 174  -2.967 -12.262   0.224
  539    HB   ILE 174           HB       ILE 174  -1.257 -11.198   2.508
  540   HG12  ILE 174          1HG1      ILE 174  -2.776  -9.893   0.211
  541   HG13  ILE 174          2HG1      ILE 174  -3.115  -9.750   1.934
  542   HG21  ILE 174          1HG2      ILE 174   0.367 -10.487   0.766
  543   HG22  ILE 174          2HG2      ILE 174   0.248 -12.227   0.844
  544   HG23  ILE 174          3HG2      ILE 174  -0.570 -11.356  -0.463
  545   HD11  ILE 174          1HD1      ILE 174  -2.113  -7.720   1.237
  546   HD12  ILE 174          2HD1      ILE 174  -0.906  -8.576   2.215
  547   HD13  ILE 174          3HD1      ILE 174  -0.771  -8.549   0.438
  548    H    ASN 175           H        ASN 175  -2.124 -14.016  -0.713
  549    HA   ASN 175           HA       ASN 175  -1.422 -16.153  -0.944
  550    HB2  ASN 175          1HB       ASN 175   0.793 -15.056   0.813
  551    HB3  ASN 175          2HB       ASN 175   0.881 -16.627   0.026
  552   HD21  ASN 175          1HD2      ASN 175   2.502 -14.153  -0.363
  553   HD22  ASN 175          2HD2      ASN 175   2.489 -13.971  -2.124
  554    H    ASN 176           H        ASN 176  -3.485 -16.001   0.798
  555    HA   ASN 176           HA       ASN 176  -4.694 -16.962   2.376
  556    HB2  ASN 176          1HB       ASN 176  -4.173 -18.915   0.951
  557    HB3  ASN 176          2HB       ASN 176  -2.868 -19.357   2.055
  558   HD21  ASN 176          1HD2      ASN 176  -6.375 -18.379   2.423
  559   HD22  ASN 176          2HD2      ASN 176  -6.737 -19.772   3.439
  560    H    LYS 177           H        LYS 177  -2.070 -15.568   3.274
  561    HA   LYS 177           HA       LYS 177  -2.199 -16.332   6.148
  562    HB2  LYS 177          1HB       LYS 177   0.039 -16.116   4.951
  563    HB3  LYS 177          2HB       LYS 177  -0.313 -14.415   4.715
  564    HG2  LYS 177          1HG       LYS 177   1.187 -14.679   6.576
  565    HG3  LYS 177          2HG       LYS 177  -0.346 -14.032   7.141
  566    HD2  LYS 177          1HD       LYS 177   0.566 -15.672   8.703
  567    HD3  LYS 177          2HD       LYS 177  -0.973 -16.240   8.057
  568    HE2  LYS 177          1HE       LYS 177   0.244 -17.703   6.446
  569    HE3  LYS 177          2HE       LYS 177   1.786 -17.107   7.075
  570    HZ1  LYS 177          1HZ       LYS 177   1.172 -19.224   8.092
  571    HZ2  LYS 177          2HZ       LYS 177  -0.231 -18.616   8.657
  572    HZ3  LYS 177          3HZ       LYS 177   1.193 -18.065   9.240
  573    H    MET 178           H        MET 178  -2.779 -14.796   7.704
  574    HA   MET 178           HA       MET 178  -4.681 -12.712   6.878
  575    HB2  MET 178          1HB       MET 178  -5.232 -14.286   8.708
  576    HB3  MET 178          2HB       MET 178  -3.769 -13.815   9.561
  577    HG2  MET 178          1HG       MET 178  -5.141 -12.537  10.730
  578    HG3  MET 178          2HG       MET 178  -4.919 -11.379   9.437
  579    HE1  MET 178          1HE       MET 178  -8.334 -11.581   7.512
  580    HE2  MET 178          2HE       MET 178  -6.743 -10.802   7.648
  581    HE3  MET 178          3HE       MET 178  -6.874 -12.480   7.059
  582    H    VAL 179           H        VAL 179  -4.159 -10.594   6.727
  583    HA   VAL 179           HA       VAL 179  -1.765  -9.590   8.169
  584    HB   VAL 179           HB       VAL 179  -1.127  -8.151   6.403
  585   HG11  VAL 179          1HG1      VAL 179  -0.331  -9.715   4.790
  586   HG12  VAL 179          2HG1      VAL 179  -0.321 -10.482   6.388
  587   HG13  VAL 179          3HG1      VAL 179  -1.584 -10.905   5.205
  588   HG21  VAL 179          1HG2      VAL 179  -3.396  -9.232   4.706
  589   HG22  VAL 179          2HG2      VAL 179  -3.287  -7.588   5.382
  590   HG23  VAL 179          3HG2      VAL 179  -2.115  -8.126   4.184
  591    H    GLU 180           H        GLU 180  -1.711  -7.535   8.857
  592    HA   GLU 180           HA       GLU 180  -4.349  -6.189   9.300
  593    HB2  GLU 180          1HB       GLU 180  -2.846  -6.725  11.281
  594    HB3  GLU 180          2HB       GLU 180  -1.683  -5.565  10.617
  595    HG2  GLU 180          1HG       GLU 180  -3.548  -3.830  10.664
  596    HG3  GLU 180          2HG       GLU 180  -4.566  -5.035  11.454
  597    H    CYS 181           H        CYS 181  -4.815  -4.368   8.195
  598    HA   CYS 181           HA       CYS 181  -2.634  -2.893   6.776
  599    HB2  CYS 181          1HB       CYS 181  -5.546  -3.136   5.941
  600    HB3  CYS 181          2HB       CYS 181  -4.263  -2.272   5.098
  601    HG   CYS 181           HG       CYS 181  -4.436  -5.494   5.833
  602    H    LYS 182           H        LYS 182  -2.315  -0.876   7.379
  603    HA   LYS 182           HA       LYS 182  -4.383   0.742   8.758
  604    HB2  LYS 182          1HB       LYS 182  -2.802   1.120  10.691
  605    HB3  LYS 182          2HB       LYS 182  -3.572  -0.465  10.591
  606    HG2  LYS 182          1HG       LYS 182  -1.428  -1.374   9.613
  607    HG3  LYS 182          2HG       LYS 182  -0.678   0.195   9.977
  608    HD2  LYS 182          1HD       LYS 182  -1.133  -0.111  12.369
  609    HD3  LYS 182          2HD       LYS 182  -2.096  -1.562  12.027
  610    HE2  LYS 182          1HE       LYS 182  -0.028  -2.598  10.998
  611    HE3  LYS 182          2HE       LYS 182   0.906  -1.227  11.616
  612    HZ1  LYS 182          1HZ       LYS 182  -0.680  -3.151  13.242
  613    HZ2  LYS 182          2HZ       LYS 182   0.214  -1.902  13.867
  614    HZ3  LYS 182          3HZ       LYS 182   0.928  -3.172  13.088
  615    H    LYS 183           H        LYS 183  -3.914   2.994   8.870
  616    HA   LYS 183           HA       LYS 183  -2.624   3.943   6.496
  617    HB2  LYS 183          1HB       LYS 183  -3.597   5.429   8.960
  618    HB3  LYS 183          2HB       LYS 183  -3.005   6.231   7.495
  619    HG2  LYS 183          1HG       LYS 183  -4.747   5.230   6.132
  620    HG3  LYS 183          2HG       LYS 183  -5.290   4.215   7.474
  621    HD2  LYS 183          1HD       LYS 183  -5.916   6.252   8.763
  622    HD3  LYS 183          2HD       LYS 183  -5.469   7.251   7.358
  623    HE2  LYS 183          1HE       LYS 183  -7.134   6.068   5.970
  624    HE3  LYS 183          2HE       LYS 183  -7.530   4.993   7.317
  625    HZ1  LYS 183          1HZ       LYS 183  -9.129   6.803   7.083
  626    HZ2  LYS 183          2HZ       LYS 183  -7.979   7.927   7.299
  627    HZ3  LYS 183          3HZ       LYS 183  -8.371   6.917   8.537
  628    H    ALA 184           H        ALA 184  -0.701   4.925   6.037
  629    HA   ALA 184           HA       ALA 184   1.526   4.052   7.623
  630    HB1  ALA 184          1HB       ALA 184   2.867   5.224   5.916
  631    HB2  ALA 184          2HB       ALA 184   1.605   4.211   5.180
  632    HB3  ALA 184          3HB       ALA 184   1.394   5.977   5.268
  633    H    GLN 185           H        GLN 185   2.714   5.031   9.140
  634    HA   GLN 185           HA       GLN 185   2.369   7.945   9.674
  635    HB2  GLN 185          1HB       GLN 185   2.792   5.705  11.671
  636    HB3  GLN 185          2HB       GLN 185   2.776   7.432  12.055
  637    HG2  GLN 185          1HG       GLN 185   0.414   7.546  11.160
  638    HG3  GLN 185          2HG       GLN 185   0.462   5.798  10.924
  639   HE21  GLN 185          1HE2      GLN 185  -1.196   5.282  12.410
  640   HE22  GLN 185          2HE2      GLN 185  -1.015   5.574  14.136
  641    HA   PRO 186           HA       PRO 186   6.531   8.577   8.820
  642    HB2  PRO 186          1HB       PRO 186   6.802  10.147  11.392
  643    HB3  PRO 186          2HB       PRO 186   7.340  10.589   9.740
  644    HG2  PRO 186          1HG       PRO 186   5.038  11.608  10.720
  645    HG3  PRO 186          2HG       PRO 186   5.085  10.986   9.037
  646    HD2  PRO 186          1HD       PRO 186   4.007   9.626  11.514
  647    HD3  PRO 186          2HD       PRO 186   3.318   9.726   9.871
  648    H    LYS 187           H        LYS 187   8.644   7.902   9.075
  649    HA   LYS 187           HA       LYS 187   9.308   5.712  10.720
  650    HB2  LYS 187          1HB       LYS 187  10.252   6.261   8.504
  651    HB3  LYS 187          2HB       LYS 187  10.987   7.729   9.164
  652    HG2  LYS 187          1HG       LYS 187  12.441   6.356  10.608
  653    HG3  LYS 187          2HG       LYS 187  11.685   4.883   9.947
  654    HD2  LYS 187          1HD       LYS 187  12.500   5.497   7.680
  655    HD3  LYS 187          2HD       LYS 187  13.157   7.007   8.310
  656    HE2  LYS 187          1HE       LYS 187  14.965   5.468   8.000
  657    HE3  LYS 187          2HE       LYS 187  14.753   5.747   9.732
  658    HZ1  LYS 187          1HZ       LYS 187  13.688   3.401   8.255
  659    HZ2  LYS 187          2HZ       LYS 187  13.639   3.604   9.886
  660    HZ3  LYS 187          3HZ       LYS 187  15.059   3.359   9.110
  661    H    GLU 188           H        GLU 188   9.602   9.043  11.306
  662    HA   GLU 188           HA       GLU 188  11.446   9.015  13.542
  663    HB2  GLU 188          1HB       GLU 188  11.078  10.946  12.103
  664    HB3  GLU 188          2HB       GLU 188   9.386  11.055  12.612
  665    HG2  GLU 188          1HG       GLU 188  10.053  11.635  14.887
  666    HG3  GLU 188          2HG       GLU 188  11.757  11.356  14.497
  667    H    VAL 189           H        VAL 189   7.987   8.423  13.326
  668    HA   VAL 189           HA       VAL 189   7.709   8.622  16.284
  669    HB   VAL 189           HB       VAL 189   5.556   9.411  16.145
  670   HG11  VAL 189          1HG1      VAL 189   5.694  11.467  14.891
  671   HG12  VAL 189          2HG1      VAL 189   7.297  11.102  15.547
  672   HG13  VAL 189          3HG1      VAL 189   6.952  10.816  13.826
  673   HG21  VAL 189          1HG2      VAL 189   5.529   8.812  13.163
  674   HG22  VAL 189          2HG2      VAL 189   4.575   7.988  14.411
  675   HG23  VAL 189          3HG2      VAL 189   4.261   9.683  14.049
  676    H    MET 190           H        MET 190   8.203   6.227  14.292
  677    HA   MET 190           HA       MET 190   6.225   4.343  15.478
  678    HB2  MET 190          1HB       MET 190   7.324   4.521  12.662
  679    HB3  MET 190          2HB       MET 190   6.509   3.090  13.284
  680    HG2  MET 190          1HG       MET 190   5.174   5.820  13.266
  681    HG3  MET 190          2HG       MET 190   5.143   4.711  11.909
  682    HE1  MET 190          1HE       MET 190   3.350   5.917  14.908
  683    HE2  MET 190          2HE       MET 190   2.438   4.540  15.561
  684    HE3  MET 190          3HE       MET 190   4.167   4.691  15.908
  685    H    SER 191           H        SER 191   7.197   3.200  16.876
  686    HA   SER 191           HA       SER 191   9.651   1.680  16.150
  687    HB2  SER 191          1HB       SER 191  10.412   3.252  17.785
  688    HB3  SER 191          2HB       SER 191   9.035   2.907  18.848
  689    HG   SER 191           HG       SER 191  11.039   1.823  19.418
  690    HA   PRO 192           HA       PRO 192   6.851  -1.690  17.163
  691    HB2  PRO 192          1HB       PRO 192   8.500  -3.834  16.913
  692    HB3  PRO 192          2HB       PRO 192   8.026  -2.832  15.511
  693    HG2  PRO 192          1HG       PRO 192  10.578  -2.659  17.147
  694    HG3  PRO 192          2HG       PRO 192  10.411  -2.722  15.362
  695    HD2  PRO 192          1HD       PRO 192  10.698  -0.372  16.762
  696    HD3  PRO 192          2HD       PRO 192   9.747  -0.471  15.258
  697    H    THR 193           H        THR 193   9.529  -0.752  19.093
  698    HA   THR 193           HA       THR 193  10.284  -1.075  21.098
  699    HB   THR 193           HB       THR 193   9.033  -0.793  22.887
  700    HG1  THR 193          1HG       THR 193   7.029  -1.717  23.237
  701   HG21  THR 193          1HG2      THR 193   7.055   0.496  22.379
  702   HG22  THR 193          2HG2      THR 193   6.898  -0.255  20.778
  703   HG23  THR 193          3HG2      THR 193   8.266   0.825  21.131
  704    H    GLY 194           H        GLY 194   9.025  -4.003  19.881
  705    HA2  GLY 194          1HA       GLY 194  11.378  -5.383  20.900
  706    HA3  GLY 194          2HA       GLY 194   9.869  -5.999  21.582
  707    H    SER 195           H        SER 195  11.904  -7.155  19.643
  708    HA   SER 195           HA       SER 195  10.497  -7.339  17.073
  709    HB2  SER 195          1HB       SER 195  13.135  -8.456  18.074
  710    HB3  SER 195          2HB       SER 195  12.461  -8.810  16.475
  711    HG   SER 195           HG       SER 195  13.231  -6.286  17.535
  712    H    ALA 196           H        ALA 196   9.115  -8.859  16.444
  713    HA   ALA 196           HA       ALA 196   8.667 -11.349  17.912
  714    HB1  ALA 196          1HB       ALA 196   7.009 -11.740  16.133
  715    HB2  ALA 196          2HB       ALA 196   6.846 -10.104  16.794
  716    HB3  ALA 196          3HB       ALA 196   7.631 -10.353  15.217
  717    H    ARG 197           H        ARG 197  10.568 -10.356  15.171
  718    HA   ARG 197           HA       ARG 197  11.166 -12.879  13.916
  719    HB2  ARG 197          1HB       ARG 197  12.630 -10.226  14.038
  720    HB3  ARG 197          2HB       ARG 197  13.073 -11.513  12.931
  721    HG2  ARG 197          1HG       ARG 197  11.191 -11.273  11.599
  722    HG3  ARG 197          2HG       ARG 197  10.235 -10.448  12.825
  723    HD2  ARG 197          1HD       ARG 197  12.716  -9.161  11.613
  724    HD3  ARG 197          2HD       ARG 197  11.127  -9.069  10.856
  725    HE   ARG 197           HE       ARG 197  10.286  -7.696  12.557
  726   HH11  ARG 197          1HH1      ARG 197  13.695  -8.311  13.339
  727   HH12  ARG 197          2HH1      ARG 197  13.555  -7.286  14.756
  728   HH21  ARG 197          1HH2      ARG 197  10.328  -6.384  14.188
  729   HH22  ARG 197          2HH2      ARG 197  11.764  -6.251  15.230
  730    H    GLY 198           H        GLY 198  13.496 -13.638  13.726
  731    HA2  GLY 198          1HA       GLY 198  15.561 -14.250  14.623
  732    HA3  GLY 198          2HA       GLY 198  15.182 -13.426  16.132
  733    H    ARG 199           H        ARG 199  13.052 -15.837  14.706
  734    HA   ARG 199           HA       ARG 199  14.010 -18.034  16.420
  735    HB2  ARG 199          1HB       ARG 199  11.661 -18.527  17.197
  736    HB3  ARG 199          2HB       ARG 199  12.483 -17.177  17.942
  737    HG2  ARG 199          1HG       ARG 199  10.148 -16.670  17.599
  738    HG3  ARG 199          2HG       ARG 199  11.170 -15.559  16.712
  739    HD2  ARG 199          1HD       ARG 199   9.152 -16.191  15.450
  740    HD3  ARG 199          2HD       ARG 199  10.621 -16.621  14.598
  741    HE   ARG 199           HE       ARG 199  10.047 -18.875  14.723
  742   HH11  ARG 199          1HH1      ARG 199   7.892 -17.233  16.973
  743   HH12  ARG 199          2HH1      ARG 199   6.945 -18.679  17.195
  744   HH21  ARG 199          1HH2      ARG 199   8.892 -20.536  15.012
  745   HH22  ARG 199          2HH2      ARG 199   7.496 -20.565  16.097
  746    H    SER 200           H        SER 200  13.050 -20.103  15.920
  747    HA   SER 200           HA       SER 200  13.434 -20.819  13.250
  748    HB2  SER 200          1HB       SER 200  11.873 -22.302  15.403
  749    HB3  SER 200          2HB       SER 200  12.480 -23.011  13.893
  750    HG   SER 200           HG       SER 200  13.972 -23.322  15.638
  751    H5'    G 201           H5'        G 201   7.658 -15.343  13.395
  752   H5''    G 201           H5"        G 201   8.209 -14.281  14.697
  753    H4'    G 201           H4'        G 201   7.616 -12.299  13.390
  754    H3'    G 201           H3'        G 201   5.964 -14.027  11.842
  755    H2'    G 201           H2'        G 201   7.634 -14.905  10.518
  756   HO2'    G 201           HO2        G 201   6.693 -12.547   9.444
  757    H1'    G 201           H1'        G 201   9.182 -12.318  10.601
  758    H8     G 201          8H          G 201  11.368 -12.817   9.335
  759    H1     G 201          1H          G 201  11.367 -19.030  11.122
  760    H21    G 201          1H2         G 201   9.603 -19.405  12.358
  761    H22    G 201          2H2         G 201   8.365 -18.158  12.560
  762   HO5'    G 201           HO5        G 201   5.798 -13.439  14.293
  763    H5'    U 202           H5'        U 202   4.964  -9.645  10.088
  764   H5''    U 202           H5"        U 202   6.618  -9.574  10.696
  765    H4'    U 202           H4'        U 202   6.166  -7.411  10.097
  766    H3'    U 202           H3'        U 202   6.642  -7.821  12.777
  767    H2'    U 202           H2'        U 202   4.420  -7.732  13.474
  768   HO2'    U 202           HO2        U 202   5.643  -5.545  14.082
  769    H1'    U 202           H1'        U 202   3.695  -5.519  11.556
  770    H3     U 202          3H          U 202  -0.625  -5.877  12.905
  771    H5     U 202          5H          U 202   0.568  -9.880  12.557
  772    H6     U 202          6H          U 202   2.814  -9.126  11.979
  773    H5'    A 203           H5'        A 203   6.391  -2.956  12.710
  774   H5''    A 203           H5"        A 203   6.766  -3.430  11.041
  775    H4'    A 203           H4'        A 203   8.588  -1.769  10.965
  776    H3'    A 203           H3'        A 203   8.670  -1.632  13.664
  777    H2'    A 203           H2'        A 203   6.316  -1.065  13.857
  778   HO2'    A 203           HO2        A 203   8.012   1.184  14.048
  779    H1'    A 203           H1'        A 203   6.905   1.095  11.806
  780    H8     A 203          8H          A 203   4.050  -0.909  13.464
  781    H61    A 203          1H6         A 203   0.484   3.094  10.169
  782    H62    A 203          2H6         A 203   0.406   1.874  11.444
  783    H2     A 203          2H          A 203   4.569   3.647   8.947
  784    H5'    G 204           H5'        G 204  10.182   1.427   9.983
  785   H5''    G 204           H5"        G 204   8.966   0.172   9.676
  786    H4'    G 204           H4'        G 204  10.780  -0.941   8.202
  787    H3'    G 204           H3'        G 204  12.480   0.986   9.136
  788    H2'    G 204           H2'        G 204  11.068   2.726   8.254
  789   HO2'    G 204           HO2        G 204  13.029   2.335   6.209
  790    H1'    G 204           H1'        G 204  11.008   1.115   5.702
  791    H8     G 204          8H          G 204   9.937   2.581   3.898
  792    H1     G 204          1H          G 204   6.242   5.709   8.150
  793    H21    G 204          1H2         G 204   6.521   4.826  10.109
  794    H22    G 204          2H2         G 204   7.603   3.452  10.324
  795    H5'    U 205           H5'        U 205  12.755  -0.150   4.675
  796   H5''    U 205           H5"        U 205  14.430  -0.461   4.212
  797    H4'    U 205           H4'        U 205  13.290   0.566   2.391
  798    H3'    U 205           H3'        U 205  15.633   1.789   3.535
  799   HO3'    U 205           HO3        U 205  16.073   2.044   1.330
  800    H2'    U 205           H2'        U 205  14.501   3.760   4.009
  801   HO2'    U 205           HO2        U 205  15.102   3.964   1.212
  802    H1'    U 205           H1'        U 205  12.818   3.067   1.593
  803    H3     U 205          3H          U 205  11.169   6.913   4.925
  804    H5     U 205          5H          U 205   9.378   5.949   1.275
  805    H6     U 205          6H          U 205  10.956   4.114   1.018